data_2mcd_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 2mcd _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 23.3 t . . . . . 0 N--CA 1.474 0.767 0 N-CA-C 110.31 -0.255 . . . . 0.0 110.31 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 22.2 m -140.19 152.92 21.95 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 125.124 1.37 . . . . 0.0 112.884 -176.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.6 m -140.97 155.82 46.17 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 125.967 1.707 . . . . 0.0 111.534 178.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 60.2 t80 -138.14 76.9 1.6 Allowed 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.645 1.178 . . . . 0.0 111.286 179.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -79.47 43.99 2.63 Favored Glycine 0 CA--C 1.537 1.46 0 C-N-CA 125.518 1.532 . . . . 0.0 114.589 -178.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -130.88 67.31 80.59 Favored Pre-proline 0 CA--C 1.553 1.084 0 C-N-CA 125.23 1.412 . . . . 0.0 112.953 -172.294 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -71.21 165.76 31.39 Favored 'Trans proline' 0 CA--C 1.544 1.017 0 C-N-CA 123.703 2.936 . . . . 0.0 112.617 174.232 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 61.8 m -129.42 66.41 76.8 Favored Pre-proline 0 N--CA 1.478 0.93 0 C-N-CA 124.93 1.292 . . . . 0.0 112.308 -178.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -70.4 159.24 53.6 Favored 'Trans proline' 0 CA--C 1.543 0.927 0 C-N-CA 123.559 2.839 . . . . 0.0 112.799 178.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 58.6 tp -146.05 130.55 17.79 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.033 1.333 . . . . 0.0 111.356 176.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 77.7 p -143.13 18.37 1.93 Allowed 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 125.089 1.356 . . . . 0.0 113.964 -177.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.0 t -90.11 2.39 55.32 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 114.633 1.345 . . . . 0.0 114.633 -167.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -137.4 127.3 25.69 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.832 1.253 . . . . 0.0 111.939 -176.418 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 69.3 m -136.88 62.48 1.6 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.976 2.11 . . . . 0.0 110.338 178.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 61.84 21.28 12.13 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.778 2.031 . . . . 0.0 115.237 -177.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -64.06 -25.78 68.26 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 115.106 1.521 . . . . 0.0 115.106 -171.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 . . . . . 0 CA--C 1.548 0.892 0 C-N-CA 125.632 1.573 . . . . 0.0 113.217 -179.137 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.584 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -83.67 143.95 29.73 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.348 1.059 . . . . 0.0 110.908 169.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 59.0 mt -128.08 157.66 40.1 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.336 1.054 . . . . 0.0 112.65 -169.496 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -79.2 138.82 38.0 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.22 1.008 . . . . 0.0 110.193 166.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -95.85 -15.3 22.57 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 114.658 1.355 . . . . 0.0 114.658 -173.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -150.28 169.4 21.45 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.721 1.209 . . . . 0.0 113.105 -172.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 72.49 -163.67 54.68 Favored Glycine 0 CA--C 1.54 1.65 0 C-N-CA 124.169 0.89 . . . . 0.0 114.041 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -67.63 -16.94 47.82 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 123.173 2.582 . . . . 0.0 113.713 -176.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.3 mt -94.01 5.88 50.28 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.723 1.209 . . . . 0.0 113.931 175.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.12 123.33 13.31 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 120.91 1.687 . . . . 0.0 112.387 -177.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 81.78 3.58 90.56 Favored Glycine 0 CA--C 1.54 1.641 0 C-N-CA 125.523 1.535 . . . . 0.0 115.323 -175.015 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 16.4 mt -101.46 162.1 21.53 Favored Pre-proline 0 CA--C 1.556 1.208 0 C-N-CA 126.145 1.778 . . . . 0.0 110.926 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -76.8 159.35 34.83 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 124.269 3.312 . . . . 0.0 113.562 -164.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 42.4 t -96.55 -33.85 4.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 CA-C-O 118.621 -0.704 . . . . 0.0 112.743 174.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 16.2 p -124.5 172.18 9.4 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 114.707 1.373 . . . . 0.0 114.707 -178.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 13.6 ptp180 -63.65 -35.03 79.19 Favored 'General case' 0 N--CA 1.482 1.125 0 O-C-N 121.358 -0.839 . . . . 0.0 112.052 174.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.0 t -64.98 -46.58 80.86 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.427 0.691 . . . . 0.0 110.411 171.134 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -59.78 -42.64 93.81 Favored 'General case' 0 CA--C 1.539 0.538 0 O-C-N 121.658 -0.651 . . . . 0.0 111.616 177.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.01 -43.66 94.98 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 123.957 0.903 . . . . 0.0 113.035 177.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.6 tmt_? -64.49 -43.61 93.6 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 119.311 0.959 . . . . 0.0 111.668 176.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 77.5 t -63.13 -44.34 99.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 123.605 0.762 . . . . 0.0 110.983 176.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 20.4 mt -57.89 -51.26 70.34 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 118.113 -0.946 . . . . 0.0 112.103 173.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 65.7 mt -54.37 -50.12 59.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 CA-C-N 119.25 0.932 . . . . 0.0 110.365 177.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -64.19 -47.8 78.36 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 -178.104 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -70.45 -42.84 70.98 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 119.131 0.878 . . . . 0.0 112.466 -177.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -56.22 -54.79 41.06 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 124.286 1.034 . . . . 0.0 110.073 172.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.423 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 68.4 t90 -61.07 -45.37 95.03 Favored 'General case' 0 C--O 1.219 -0.505 0 CA-C-O 117.755 -1.117 . . . . 0.0 111.934 177.674 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -55.49 -47.69 75.76 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 120.562 1.528 . . . . 0.0 112.433 178.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -70.65 -48.44 54.92 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 119.524 1.056 . . . . 0.0 112.521 178.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.5 mmp_? -55.34 -49.8 71.3 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.063 0.545 . . . . 0.0 110.48 177.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.8 tmtt? -69.79 -29.23 66.49 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.882 1.673 . . . . 0.0 113.637 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 34.0 ttpt -58.92 -37.1 75.89 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.965 1.257 . . . . 0.0 110.851 165.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 68.3 m -81.89 -22.57 36.79 Favored 'General case' 0 N--CA 1.481 1.106 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 168.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -139.92 73.06 33.9 Favored Pre-proline 0 N--CA 1.477 0.916 0 C-N-CA 126.669 1.988 . . . . 0.0 111.534 -164.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -62.05 -6.68 8.34 Favored 'Trans proline' 0 CA--C 1.546 1.099 0 C-N-CA 124.095 3.196 . . . . 0.0 116.5 -165.168 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 37.7 p90 -83.9 -11.58 56.71 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 126.458 1.903 . . . . 0.0 114.875 175.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.5 tp -65.54 136.55 56.54 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 -167.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 27.2 mmm180 -84.23 156.07 22.18 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 124.886 1.275 . . . . 0.0 112.798 179.39 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.423 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -138.75 127.46 23.45 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 126.224 1.81 . . . . 0.0 110.1 -175.636 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -150.17 139.66 21.49 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.604 1.161 . . . . 0.0 111.772 177.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 62.6 mtt -135.01 11.04 3.6 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 114.098 1.148 . . . . 0.0 114.098 -167.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 29.8 m -63.02 155.02 28.8 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.117 0.967 . . . . 0.0 111.541 177.039 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -55.23 -36.31 65.86 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 121.09 -1.007 . . . . 0.0 113.448 -171.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -60.86 -34.16 74.18 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.964 0.905 . . . . 0.0 112.841 175.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.05 -41.84 98.55 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 119.071 0.851 . . . . 0.0 111.56 174.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.6 mp -71.34 -45.94 67.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 C-N-CA 123.855 0.862 . . . . 0.0 109.413 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 15.5 m-30 -56.21 -47.02 79.22 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 118.746 0.703 . . . . 0.0 112.693 174.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.9 tmt_? -76.0 -38.18 57.64 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.582 1.153 . . . . 0.0 112.366 -172.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 6.1 ttm180 -75.18 -41.28 58.32 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.675 0.79 . . . . 0.0 112.249 173.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 38.7 m-85 -124.6 81.43 60.3 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 126.028 1.731 . . . . 0.0 111.027 -173.009 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -66.28 -17.48 54.25 Favored 'Trans proline' 0 CA--C 1.539 0.75 0 C-N-CA 123.114 2.543 . . . . 0.0 114.499 -171.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 10.2 p-80 -74.25 -22.89 59.12 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.875 0.87 . . . . 0.0 113.299 173.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -84.32 -15.04 47.99 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 125.819 1.648 . . . . 0.0 113.162 -175.748 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 57.8 ttp180 . . . . . 0 C--O 1.254 1.299 0 C-N-CA 124.501 1.12 . . . . 0.0 111.985 174.018 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 78.8 p . . . . . 0 N--CA 1.478 0.944 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.8 p -156.4 148.11 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 126.263 1.825 . . . . 0.0 110.718 175.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 79.2 p -150.87 151.69 32.59 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.81 1.244 . . . . 0.0 112.552 174.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 38.6 t80 -153.9 155.87 36.5 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.082 1.353 . . . . 0.0 111.739 176.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -77.1 172.83 55.08 Favored Glycine 0 CA--C 1.539 1.568 0 C-N-CA 124.411 1.005 . . . . 0.0 114.801 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -148.13 148.42 29.41 Favored Pre-proline 0 CA--C 1.551 1.007 0 C-N-CA 125.076 1.35 . . . . 0.0 111.826 174.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -74.53 118.33 5.29 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 123.247 2.632 . . . . 0.0 111.708 178.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 68.6 m -139.2 61.63 21.67 Favored Pre-proline 0 N--CA 1.476 0.856 0 C-N-CA 125.068 1.347 . . . . 0.0 111.92 -179.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -66.22 126.39 15.63 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 123.2 2.6 . . . . 0.0 111.904 -178.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 21.9 tp -141.58 -3.35 1.16 Allowed 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 124.524 1.13 . . . . 0.0 113.963 -175.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 21.4 m -64.59 138.35 58.35 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.482 1.113 . . . . 0.0 113.202 -173.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 65.4 p -90.94 -16.56 27.87 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -178.565 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.1 pp20? -77.82 160.84 28.07 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 124.499 1.12 . . . . 0.0 113.6 179.198 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 81.4 p -122.05 20.73 10.68 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 125.816 1.646 . . . . 0.0 114.074 -170.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 60.64 -7.92 0.07 Allowed 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 127.805 2.442 . . . . 0.0 116.391 -170.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -64.19 -25.49 68.1 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 120.858 -1.151 . . . . 0.0 113.998 -177.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 . . . . . 0 N--CA 1.472 0.669 0 C-N-CA 125.229 1.412 . . . . 0.0 114.604 176.81 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.55 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -91.24 163.47 14.23 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.642 1.577 . . . . 0.0 111.408 165.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 96.7 mt -136.64 157.18 47.38 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 125.147 1.379 . . . . 0.0 112.18 -176.337 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 84.8 m-70 -80.82 144.13 32.28 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.681 0.792 . . . . 0.0 109.906 162.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -109.01 -6.11 15.79 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.631 1.345 . . . . 0.0 114.631 -173.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -147.54 164.59 32.94 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.904 1.282 . . . . 0.0 112.917 -175.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 69.23 -161.77 52.07 Favored Glycine 0 CA--C 1.541 1.681 0 C-N-CA 123.888 0.756 . . . . 0.0 113.892 -179.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -68.09 -15.93 43.89 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 123.212 2.608 . . . . 0.0 113.752 -177.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 81.3 mt -92.49 4.2 53.98 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.815 1.246 . . . . 0.0 113.924 175.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.27 113.27 1.87 Allowed 'General case' 0 CA--C 1.548 0.893 0 CA-C-N 121.048 1.749 . . . . 0.0 111.807 -179.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.32 9.76 62.95 Favored Glycine 0 CA--C 1.542 1.743 0 C-N-CA 125.179 1.371 . . . . 0.0 115.676 -173.263 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 5.3 mp -111.84 156.56 41.46 Favored Pre-proline 0 CA--C 1.556 1.19 0 C-N-CA 126.911 2.084 . . . . 0.0 111.545 178.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -63.17 162.21 27.38 Favored 'Trans proline' 0 C--N 1.356 0.921 0 C-N-CA 125.056 3.837 . . . . 0.0 114.33 -172.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 8.2 t -105.5 -30.04 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 123.666 0.786 . . . . 0.0 111.824 172.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 26.6 p -126.9 170.71 11.96 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 125.087 1.355 . . . . 0.0 114.237 -178.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 42.9 ttm-85 -60.37 -41.4 93.65 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.011 0.924 . . . . 0.0 110.848 172.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 28.4 m -60.47 -45.45 93.69 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.903 0.881 . . . . 0.0 111.017 173.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -59.78 -49.32 78.19 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 118.443 0.565 . . . . 0.0 110.9 175.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.03 -43.73 98.46 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.633 0.773 . . . . 0.0 112.637 -177.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 73.0 ttt180 -68.91 -40.94 78.8 Favored 'General case' 0 N--CA 1.478 0.935 0 O-C-N 121.213 -0.929 . . . . 0.0 112.497 178.1 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 77.3 t -64.76 -42.22 94.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 CA-C-N 118.365 0.529 . . . . 0.0 111.192 175.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 87.4 mt -65.54 -41.56 92.9 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 118.179 -0.915 . . . . 0.0 112.541 176.267 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 47.7 mt -53.65 -50.89 47.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 CA-C-N 119.368 0.986 . . . . 0.0 109.729 169.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -64.19 -46.63 83.1 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 113.255 0.835 . . . . 0.0 113.255 -178.241 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -69.96 -44.41 69.56 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.136 0.975 . . . . 0.0 112.598 -176.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -61.04 -52.11 66.36 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 118.554 -0.736 . . . . 0.0 110.117 172.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.411 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 61.7 t90 -56.06 -46.44 78.93 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-N 119.452 1.024 . . . . 0.0 112.126 177.004 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -51.75 -55.36 20.13 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 119.72 1.145 . . . . 0.0 112.459 176.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -74.25 -42.97 58.81 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 121.137 -0.977 . . . . 0.0 112.822 -175.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 35.7 mmt180 -57.29 -45.34 84.21 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.296 0.638 . . . . 0.0 109.835 174.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.9 tmtt? -69.72 -32.18 70.6 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.106 0.962 . . . . 0.0 113.516 178.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 66.4 mttt -61.89 -31.14 71.4 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 119.761 1.164 . . . . 0.0 111.715 167.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 70.6 m -81.82 -24.21 36.01 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 115.14 1.533 . . . . 0.0 115.14 165.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -142.49 78.97 15.86 Favored Pre-proline 0 CA--C 1.55 0.949 0 C-N-CA 126.819 2.048 . . . . 0.0 111.561 -166.136 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -62.21 -5.08 5.97 Favored 'Trans proline' 0 CA--C 1.547 1.161 0 C-N-CA 123.707 2.938 . . . . 0.0 116.566 -167.005 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 39.5 p90 -88.04 -3.53 58.89 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.815 2.046 . . . . 0.0 115.065 175.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.84 141.82 43.3 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-N 119.96 1.255 . . . . 0.0 113.447 -177.634 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 1.9 mpp_? -103.24 153.82 19.99 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 125.255 1.422 . . . . 0.0 112.412 174.301 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.411 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.3 tm? -127.37 128.11 45.32 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.837 1.655 . . . . 0.0 110.264 -173.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 58.4 t0 -143.25 128.7 19.01 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.355 1.062 . . . . 0.0 110.956 179.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 65.3 mtt -127.47 10.76 6.75 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.459 1.504 . . . . 0.0 113.127 -177.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 72.6 m -68.14 152.44 45.48 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 121.42 -0.8 . . . . 0.0 111.383 172.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -57.21 -34.58 68.68 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -166.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 33.7 mmtp -59.12 -37.28 76.83 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.002 0.921 . . . . 0.0 112.484 177.03 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.38 -37.25 82.7 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.546 0.739 . . . . 0.0 111.844 173.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 2.5 mm -75.18 -44.0 43.69 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 C-N-CA 123.374 0.67 . . . . 0.0 109.396 -175.31 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 10.2 m-30 -60.86 -45.39 94.72 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 123.088 0.555 . . . . 0.0 112.106 174.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 6.5 tmm_? -74.15 -35.14 64.05 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.126 0.971 . . . . 0.0 112.52 -173.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 73.4 mtp85 -74.78 -40.61 61.07 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.702 0.801 . . . . 0.0 112.564 170.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 34.3 m-85 -130.3 77.38 76.29 Favored Pre-proline 0 CA--C 1.545 0.785 0 C-N-CA 125.594 1.558 . . . . 0.0 111.266 -169.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -66.51 -16.85 52.31 Favored 'Trans proline' 0 CA--C 1.539 0.767 0 C-N-CA 123.077 2.518 . . . . 0.0 113.979 -173.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 12.1 p-80 -74.05 -22.39 59.56 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.278 1.031 . . . . 0.0 113.495 172.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.47 -19.57 27.8 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 125.986 1.715 . . . . 0.0 112.753 -172.584 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 . . . . . 0 C--O 1.256 1.411 0 C-N-CA 124.625 1.17 . . . . 0.0 112.202 174.738 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 88.6 p . . . . . 0 N--CA 1.474 0.774 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.3 p -150.89 148.51 14.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 125.391 1.476 . . . . 0.0 111.027 178.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.2 t -148.18 141.74 25.44 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.623 1.169 . . . . 0.0 111.668 175.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -152.3 154.51 35.83 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.713 1.605 . . . . 0.0 110.912 176.416 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 173.62 -154.81 20.84 Favored Glycine 0 CA--C 1.534 1.276 0 C-N-CA 123.702 0.668 . . . . 0.0 114.148 -178.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . 50.71 56.43 17.23 Favored Pre-proline 0 CA--C 1.557 1.243 0 C-N-CA 126.323 1.849 . . . . 0.0 114.981 -179.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -66.75 159.44 51.26 Favored 'Trans proline' 0 CA--C 1.544 0.981 0 C-N-CA 123.242 2.628 . . . . 0.0 112.328 174.346 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 37.3 p -136.57 56.78 14.33 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 124.835 1.254 . . . . 0.0 113.863 -173.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -64.67 143.29 80.44 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 123.208 2.605 . . . . 0.0 112.233 177.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 58.2 tp -153.34 142.65 21.55 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.86 1.264 . . . . 0.0 111.715 -177.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 66.5 p -145.57 140.69 27.6 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.201 1.4 . . . . 0.0 111.354 168.125 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.4 m -141.02 13.22 2.24 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 -169.045 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -148.1 156.35 42.51 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.672 1.189 . . . . 0.0 113.466 -170.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 19.4 t -154.55 148.39 25.54 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.471 1.508 . . . . 0.0 111.156 175.014 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 56.95 24.25 9.19 Favored 'General case' 0 CA--C 1.552 1.019 0 C-N-CA 125.676 1.59 . . . . 0.0 114.712 178.114 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -75.7 -24.8 56.26 Favored 'General case' 0 N--CA 1.475 0.799 0 O-C-N 120.816 -1.177 . . . . 0.0 113.918 -174.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 . . . . . 0 CA--C 1.546 0.815 0 C-N-CA 125.624 1.57 . . . . 0.0 114.693 -175.806 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.573 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -84.61 144.05 28.86 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.437 1.095 . . . . 0.0 110.7 166.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.4 mt -128.05 157.55 40.38 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.408 1.083 . . . . 0.0 112.441 -169.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -78.07 138.72 38.91 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.896 0.879 . . . . 0.0 110.044 166.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -94.09 -22.75 18.3 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 114.321 1.23 . . . . 0.0 114.321 -175.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -140.68 165.91 26.19 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.99 1.316 . . . . 0.0 112.855 -170.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.37 -163.14 54.81 Favored Glycine 0 CA--C 1.54 1.599 0 C-N-CA 124.247 0.927 . . . . 0.0 114.201 177.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -67.49 -17.08 48.62 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 123.314 2.676 . . . . 0.0 113.754 -176.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.5 mt -93.94 5.0 53.1 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.662 1.185 . . . . 0.0 113.782 175.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.32 123.69 14.64 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 120.936 1.698 . . . . 0.0 112.282 -177.06 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 82.58 3.04 90.68 Favored Glycine 0 CA--C 1.541 1.664 0 C-N-CA 125.631 1.586 . . . . 0.0 115.321 -174.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 18.0 mt -102.1 161.63 22.8 Favored Pre-proline 0 CA--C 1.556 1.184 0 C-N-CA 126.057 1.743 . . . . 0.0 111.087 -179.214 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -77.06 156.65 34.05 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 124.208 3.272 . . . . 0.0 113.837 -164.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 39.2 t -94.73 -35.73 6.37 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 O-C-N 121.569 -0.707 . . . . 0.0 112.82 176.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 19.9 p -123.44 172.67 8.53 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 125.229 1.412 . . . . 0.0 114.017 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 47.7 ttp180 -64.7 -36.43 84.26 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 121.11 -0.994 . . . . 0.0 110.97 174.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 30.4 m -60.53 -44.27 96.25 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.476 0.71 . . . . 0.0 110.937 170.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 -63.19 -43.67 97.56 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.48 -0.762 . . . . 0.0 111.74 176.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.6 -41.45 96.22 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 118.79 0.723 . . . . 0.0 112.743 177.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 22.9 tpp85 -61.75 -45.89 91.98 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.096 1.359 . . . . 0.0 111.762 175.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 73.4 t -65.08 -44.14 95.76 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 123.705 0.802 . . . . 0.0 111.11 177.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 17.9 mt -56.46 -49.71 73.81 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 118.603 -0.713 . . . . 0.0 111.997 173.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 51.8 mt -54.24 -52.05 42.02 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 CA-C-N 118.573 0.624 . . . . 0.0 110.322 176.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 22.5 t80 -66.6 -47.19 73.45 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -177.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -68.33 -45.47 72.82 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 118.722 0.692 . . . . 0.0 112.244 -177.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 58.1 mm-40 -60.51 -51.4 69.62 Favored 'General case' 0 C--N 1.342 0.248 0 CA-C-O 118.38 -0.819 . . . . 0.0 109.926 174.278 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.418 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 67.5 t90 -56.6 -43.61 80.3 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 119.797 1.18 . . . . 0.0 112.598 177.63 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -59.04 -49.64 77.1 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 119.849 1.204 . . . . 0.0 113.109 177.009 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -71.56 -46.31 59.78 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 119.673 1.124 . . . . 0.0 112.471 -179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 33.4 mmt180 -58.8 -44.6 90.83 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.752 0.821 . . . . 0.0 109.721 176.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 74.5 tttt -70.8 -29.41 65.59 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 176.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -59.47 -35.2 73.64 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 119.922 1.237 . . . . 0.0 110.857 166.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 8.4 t -78.22 -32.9 50.12 Favored 'General case' 0 CA--C 1.553 1.088 0 N-CA-C 114.617 1.34 . . . . 0.0 114.617 167.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -132.97 77.82 67.22 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 127.196 2.198 . . . . 0.0 112.198 -166.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -63.9 5.79 0.34 Allowed 'Trans proline' 0 CA--C 1.549 1.247 0 C-N-CA 124.697 3.598 . . . . 0.0 117.532 -165.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 31.2 p90 -99.78 -6.01 27.67 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 127.306 2.242 . . . . 0.0 114.806 177.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 13.1 tp -65.77 139.51 58.35 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 115.224 1.565 . . . . 0.0 115.224 -167.011 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 11.6 ptp85 -90.02 157.74 17.67 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 125.834 1.653 . . . . 0.0 113.788 176.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.418 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.4 tm? -137.95 130.95 30.13 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 126.935 2.094 . . . . 0.0 109.924 -172.348 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -142.03 136.65 30.45 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.288 1.035 . . . . 0.0 110.632 172.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 61.9 mtt -123.61 5.76 8.89 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.912 1.285 . . . . 0.0 114.268 -172.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 35.0 t -63.74 148.22 49.7 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 119.011 0.823 . . . . 0.0 111.557 178.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -53.82 -31.86 50.76 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 121.202 -0.937 . . . . 0.0 112.813 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 53.8 tptt -54.93 -41.24 70.78 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.956 1.302 . . . . 0.0 112.623 172.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.68 -36.41 83.77 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.159 0.983 . . . . 0.0 112.263 176.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.9 mp -74.35 -46.51 43.6 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 C-N-CA 124.185 0.994 . . . . 0.0 109.458 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -56.43 -44.74 80.69 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 119.076 0.853 . . . . 0.0 112.132 174.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.3 tmt_? -72.4 -40.55 67.12 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 124.576 1.15 . . . . 0.0 112.26 -174.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 73.4 mtt85 -72.04 -38.75 69.46 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 173.091 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -131.48 79.39 69.54 Favored Pre-proline 0 CA--C 1.545 0.753 0 C-N-CA 125.584 1.553 . . . . 0.0 110.822 -166.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -66.85 -16.05 48.88 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 123.064 2.509 . . . . 0.0 113.986 -173.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 12.1 p-80 -73.49 -23.94 60.11 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.052 0.941 . . . . 0.0 113.134 172.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.44 -27.99 37.83 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.579 1.552 . . . . 0.0 112.3 -173.201 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 51.8 ttt85 . . . . . 0 C--O 1.255 1.359 0 C-N-CA 124.69 1.196 . . . . 0.0 112.288 175.357 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.6 t . . . . . 0 N--CA 1.473 0.684 0 CA-C-O 120.622 0.249 . . . . 0.0 111.088 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 9.7 p -83.73 143.77 11.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 124.444 1.098 . . . . 0.0 112.02 -178.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 50.4 m -79.44 152.94 30.02 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.04 0.936 . . . . 0.0 112.379 175.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -124.55 146.8 48.81 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.937 1.295 . . . . 0.0 111.566 176.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 72.56 177.19 30.65 Favored Glycine 0 CA--C 1.539 1.546 0 C-N-CA 123.993 0.806 . . . . 0.0 113.73 -169.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -149.27 151.32 33.66 Favored Pre-proline 0 CA--C 1.55 0.952 0 C-N-CA 125.033 1.333 . . . . 0.0 111.929 179.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.48 149.33 68.54 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 123.209 2.606 . . . . 0.0 112.219 175.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 49.8 m -75.01 147.58 83.76 Favored Pre-proline 0 N--CA 1.474 0.728 0 C-N-CA 123.921 0.888 . . . . 0.0 112.791 -178.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -71.06 164.82 34.43 Favored 'Trans proline' 0 CA--C 1.543 0.95 0 C-N-CA 123.522 2.815 . . . . 0.0 112.322 172.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.3 tt -136.34 127.71 28.4 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.975 1.31 . . . . 0.0 110.836 178.159 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 31.2 m -139.8 29.71 2.1 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.286 1.435 . . . . 0.0 112.591 -173.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.5 m -74.39 -10.07 59.21 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 115.921 1.823 . . . . 0.0 115.921 -164.076 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -129.08 136.09 49.78 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.939 1.296 . . . . 0.0 111.884 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 81.7 p -158.54 166.66 31.61 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.425 1.49 . . . . 0.0 112.575 -177.361 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 61.12 21.35 11.76 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 115.35 1.611 . . . . 0.0 115.35 172.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -74.45 -19.61 60.33 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 120.769 -1.207 . . . . 0.0 114.158 -175.009 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 . . . . . 0 CA--C 1.553 1.058 0 C-N-CA 125.416 1.486 . . . . 0.0 113.41 -177.656 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.619 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -95.23 150.52 20.14 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.981 1.312 . . . . 0.0 112.137 173.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 91.5 mt -130.43 157.62 42.11 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.623 1.569 . . . . 0.0 111.675 -179.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -79.06 141.26 37.55 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.102 0.961 . . . . 0.0 110.463 168.004 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -100.25 -11.85 20.02 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 -173.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -149.41 167.83 25.08 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.791 1.236 . . . . 0.0 113.233 -172.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.41 -163.62 54.11 Favored Glycine 0 CA--C 1.54 1.647 0 C-N-CA 124.16 0.886 . . . . 0.0 114.014 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -67.64 -16.56 46.97 Favored 'Trans proline' 0 CA--C 1.542 0.882 0 C-N-CA 123.262 2.642 . . . . 0.0 113.686 -177.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.0 mt -92.89 4.66 53.51 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.702 1.201 . . . . 0.0 113.873 175.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.63 122.62 11.76 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 120.874 1.67 . . . . 0.0 112.016 -177.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.2 5.06 89.35 Favored Glycine 0 CA--C 1.541 1.704 0 C-N-CA 125.399 1.476 . . . . 0.0 115.404 -174.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 18.7 mt -104.74 159.07 30.55 Favored Pre-proline 0 CA--C 1.556 1.177 0 C-N-CA 126.227 1.811 . . . . 0.0 111.263 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -79.38 160.12 25.89 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 124.523 3.482 . . . . 0.0 113.805 -164.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 19.1 t -102.36 -33.15 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 N-CA-C 113.381 0.882 . . . . 0.0 113.381 -175.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 19.7 p -123.44 171.28 9.59 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 114.3 1.222 . . . . 0.0 114.3 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 46.3 ttt180 -61.83 -40.14 94.24 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 124.356 1.063 . . . . 0.0 110.767 177.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 31.4 m -63.6 -44.42 94.06 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 124.683 1.193 . . . . 0.0 111.552 171.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 78.5 m-20 -60.1 -47.0 87.72 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.007 0.821 . . . . 0.0 110.993 174.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.66 -39.56 91.82 Favored 'General case' 0 CA--C 1.541 0.596 0 O-C-N 121.405 -0.81 . . . . 0.0 112.575 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 78.9 ttt180 -64.49 -43.66 93.46 Favored 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 119.24 0.927 . . . . 0.0 112.344 172.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 54.9 t -60.62 -49.24 85.25 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 CA-C-N 118.797 0.726 . . . . 0.0 111.182 175.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -62.64 -42.66 99.73 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 118.22 -0.895 . . . . 0.0 112.15 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 56.0 mt -55.86 -51.37 61.1 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 CA-C-N 119.408 1.004 . . . . 0.0 110.471 170.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 20.2 t80 -63.67 -47.63 80.44 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -175.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 12.3 t30 -68.99 -44.07 73.57 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 118.913 0.779 . . . . 0.0 112.169 -179.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -56.21 -53.5 56.46 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 122.701 0.401 . . . . 0.0 110.059 174.285 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.42 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 62.6 t90 -59.37 -46.8 87.64 Favored 'General case' 0 C--O 1.218 -0.587 0 CA-C-O 117.415 -1.278 . . . . 0.0 111.793 177.226 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -55.91 -48.76 75.09 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 120.928 1.694 . . . . 0.0 113.306 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -69.01 -47.4 65.59 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.171 0.896 . . . . 0.0 111.982 179.279 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 38.8 mmm-85 -59.16 -47.63 84.59 Favored 'General case' 0 C--O 1.216 -0.67 0 O-C-N 121.645 -0.659 . . . . 0.0 110.699 177.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 18.9 tptm -62.42 -35.09 78.15 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 126.07 1.748 . . . . 0.0 113.043 176.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 14.9 tmtt? -59.44 -36.82 76.65 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 119.603 1.092 . . . . 0.0 111.126 168.458 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 66.5 m -81.7 -18.34 44.73 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 115.926 1.824 . . . . 0.0 115.926 168.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -140.13 84.07 15.19 Favored Pre-proline 0 N--CA 1.477 0.903 0 C-N-CA 126.603 1.961 . . . . 0.0 111.88 -165.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -62.04 -0.92 1.91 Allowed 'Trans proline' 0 CA--C 1.549 1.256 0 C-N-CA 124.274 3.316 . . . . 0.0 116.598 -171.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 31.3 p90 -98.25 -10.96 23.17 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.667 1.987 . . . . 0.0 115.161 177.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 11.1 tp -66.82 137.73 56.82 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 114.671 1.36 . . . . 0.0 114.671 -166.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 18.6 mmt85 -99.37 159.25 15.15 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 126.05 1.74 . . . . 0.0 112.44 -179.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.42 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.4 tm? -137.07 133.51 35.5 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.573 1.949 . . . . 0.0 109.958 -169.556 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 54.0 t0 -141.43 130.53 23.34 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.186 0.994 . . . . 0.0 111.079 176.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 65.4 mtt -124.47 6.88 8.3 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.259 1.423 . . . . 0.0 113.409 -179.002 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 68.7 m -64.18 147.25 52.76 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 121.496 -0.753 . . . . 0.0 110.547 168.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.4 -26.23 67.71 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 113.526 0.935 . . . . 0.0 113.526 -166.009 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 61.0 mtpt -56.95 -34.79 68.37 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.76 1.224 . . . . 0.0 113.248 172.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.92 -39.69 92.93 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 118.914 0.779 . . . . 0.0 111.613 173.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.6 mp -73.62 -46.13 48.94 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 C-N-CA 124.299 1.039 . . . . 0.0 109.24 -179.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.4 m-30 -55.87 -46.13 78.34 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 119.152 0.887 . . . . 0.0 112.464 175.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.72 -41.59 44.53 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.387 1.075 . . . . 0.0 112.532 -173.087 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 6.9 ttm180 -75.27 -39.81 59.4 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.642 0.777 . . . . 0.0 112.447 176.563 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -124.73 74.58 64.19 Favored Pre-proline 0 CA--C 1.547 0.854 0 C-N-CA 125.999 1.72 . . . . 0.0 111.214 -172.521 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -67.09 -10.25 27.91 Favored 'Trans proline' 0 CA--C 1.538 0.694 0 C-N-CA 123.521 2.814 . . . . 0.0 114.626 -173.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 14.7 p-80 -77.98 -24.55 47.99 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.341 1.056 . . . . 0.0 113.407 172.079 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -77.76 -48.84 15.64 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.292 1.037 . . . . 0.0 112.057 -161.447 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 10.7 mmt180 . . . . . 0 C--O 1.254 1.301 0 C-N-CA 126.442 1.897 . . . . 0.0 112.923 179.633 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.2 t . . . . . 0 N--CA 1.476 0.865 0 N-CA-C 113.021 0.749 . . . . 0.0 113.021 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 13.1 p -153.75 142.94 14.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 126.0 1.72 . . . . 0.0 110.271 174.236 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 82.1 p -155.62 159.95 40.04 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.331 1.053 . . . . 0.0 113.366 -178.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 90.7 t80 -148.08 151.37 35.54 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.458 1.503 . . . . 0.0 111.252 170.016 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -179.71 47.33 0.08 OUTLIER Glycine 0 CA--C 1.532 1.156 0 C-N-CA 123.848 0.737 . . . . 0.0 113.772 177.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -129.09 62.11 60.63 Favored Pre-proline 0 CA--C 1.554 1.117 0 C-N-CA 124.429 1.092 . . . . 0.0 113.944 -171.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -69.97 168.74 20.95 Favored 'Trans proline' 0 CA--C 1.545 1.054 0 C-N-CA 123.379 2.72 . . . . 0.0 112.163 169.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 14.8 t -134.88 83.8 39.76 Favored Pre-proline 0 N--CA 1.474 0.764 0 C-N-CA 124.465 1.106 . . . . 0.0 111.316 176.093 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -80.22 64.03 8.82 Favored 'Trans proline' 0 CA--C 1.546 1.115 0 C-N-CA 124.454 3.436 . . . . 0.0 111.475 -179.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -75.77 -6.61 51.45 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 115.784 1.772 . . . . 0.0 115.784 -170.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.2 m -64.11 139.67 58.79 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.633 1.173 . . . . 0.0 113.132 -175.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 77.9 p -133.41 15.05 4.11 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 125.19 1.396 . . . . 0.0 114.291 -171.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -64.03 -27.92 69.45 Favored 'General case' 0 N--CA 1.476 0.871 0 O-C-N 120.901 -1.125 . . . . 0.0 113.691 -171.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 31.1 p -79.84 -45.89 17.89 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.579 1.151 . . . . 0.0 112.214 171.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 57.8 mt-10 -60.21 -27.0 66.82 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.78 1.232 . . . . 0.0 112.868 179.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -67.37 -14.18 62.69 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.018 1.327 . . . . 0.0 114.239 175.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 . . . . . 0 N--CA 1.476 0.853 0 N-CA-C 115.624 1.713 . . . . 0.0 115.624 179.583 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.621 0 CA-C-O 120.398 0.142 . . . . 0.0 111.34 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -84.36 143.71 29.3 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.318 1.047 . . . . 0.0 111.22 170.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 58.3 mt -126.88 157.46 39.3 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.718 1.207 . . . . 0.0 112.629 -170.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -79.41 137.47 37.28 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.01 0.924 . . . . 0.0 110.24 166.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -93.74 -16.9 23.74 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 -174.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -150.65 170.31 19.49 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.772 1.229 . . . . 0.0 113.005 -172.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.59 -163.99 54.79 Favored Glycine 0 CA--C 1.54 1.655 0 C-N-CA 124.155 0.883 . . . . 0.0 114.049 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -67.58 -17.11 48.2 Favored 'Trans proline' 0 CA--C 1.542 0.882 0 C-N-CA 123.265 2.643 . . . . 0.0 113.752 -176.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.7 mt -95.32 6.89 47.8 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.699 1.199 . . . . 0.0 113.834 175.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -54.7 123.46 13.34 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 120.853 1.66 . . . . 0.0 112.442 -176.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 81.63 3.0 90.72 Favored Glycine 0 CA--C 1.54 1.625 0 C-N-CA 125.577 1.561 . . . . 0.0 115.387 -175.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 19.0 mt -100.57 161.21 24.68 Favored Pre-proline 0 CA--C 1.555 1.144 0 C-N-CA 126.062 1.745 . . . . 0.0 111.0 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -75.24 157.24 41.87 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 124.197 3.265 . . . . 0.0 113.63 -165.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 52.0 t -92.5 -36.27 7.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 O-C-N 121.434 -0.791 . . . . 0.0 112.719 175.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 16.4 p -122.41 172.36 8.39 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 124.999 1.319 . . . . 0.0 114.496 -178.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 34.6 ptt-85 -63.48 -34.4 77.69 Favored 'General case' 0 N--CA 1.483 1.193 0 O-C-N 121.298 -0.876 . . . . 0.0 112.26 172.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 17.7 t -66.4 -44.96 81.57 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.16 0.584 . . . . 0.0 110.605 171.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -60.4 -43.16 96.94 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.619 -0.676 . . . . 0.0 111.397 175.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.47 -43.97 97.53 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.775 0.83 . . . . 0.0 112.78 176.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 60.3 ttp180 -65.34 -41.75 93.6 Favored 'General case' 0 N--CA 1.477 0.917 0 O-C-N 121.341 -0.849 . . . . 0.0 112.233 177.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 71.0 t -63.73 -45.0 98.52 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 C-N-CA 123.65 0.78 . . . . 0.0 111.073 175.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 21.4 mt -58.61 -48.96 79.22 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 118.56 -0.733 . . . . 0.0 112.335 174.148 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 57.2 mt -54.2 -51.12 50.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-N 118.598 0.636 . . . . 0.0 109.915 176.232 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -64.17 -50.65 67.33 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.856 0.687 . . . . 0.0 112.856 -177.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -66.46 -45.79 78.58 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 119.193 0.906 . . . . 0.0 112.395 -177.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -62.2 -45.83 91.6 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 119.135 -0.459 . . . . 0.0 110.505 178.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 68.6 t90 -60.09 -46.58 89.12 Favored 'General case' 0 C--O 1.217 -0.617 0 CA-C-O 117.506 -1.235 . . . . 0.0 111.953 172.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -57.35 -45.15 84.64 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 121.149 1.795 . . . . 0.0 113.042 179.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -69.53 -50.02 48.94 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 119.559 1.072 . . . . 0.0 112.187 178.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -56.64 -49.74 74.11 Favored 'General case' 0 C--O 1.216 -0.672 0 O-C-N 121.789 -0.569 . . . . 0.0 110.602 176.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.9 tmtt? -66.44 -30.92 71.38 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.664 1.586 . . . . 0.0 113.634 179.271 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 2.4 tmpt? -58.73 -37.92 77.22 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 120.015 1.279 . . . . 0.0 110.756 165.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 51.5 m -83.03 -16.94 45.07 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 115.575 1.694 . . . . 0.0 115.575 169.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -142.91 72.11 18.99 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 127.328 2.251 . . . . 0.0 111.194 -166.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -61.56 -6.26 6.87 Favored 'Trans proline' 0 CA--C 1.548 1.185 0 C-N-CA 123.921 3.081 . . . . 0.0 116.545 -165.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 38.9 p90 -86.13 -9.78 56.02 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 126.76 2.024 . . . . 0.0 115.032 174.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.6 tp -65.76 138.06 57.68 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 114.762 1.393 . . . . 0.0 114.762 -165.463 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 82.0 mtp180 -84.26 155.23 22.55 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 125.737 1.615 . . . . 0.0 112.997 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -138.52 129.87 27.34 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 126.608 1.963 . . . . 0.0 109.947 -173.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 50.8 t0 -147.4 131.54 17.35 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.084 0.954 . . . . 0.0 111.439 -179.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 65.6 mtt -132.3 6.03 4.14 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 114.526 1.306 . . . . 0.0 114.526 -171.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 66.6 m -63.44 155.87 27.83 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 121.313 -0.867 . . . . 0.0 111.591 174.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 24.1 p-10 -48.62 -43.41 36.28 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.288 1.218 . . . . 0.0 114.288 -176.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 62.1 mtpt -55.5 -38.02 68.64 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.858 1.263 . . . . 0.0 113.52 173.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.87 -40.73 96.39 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 119.26 0.936 . . . . 0.0 111.931 176.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -73.75 -45.96 48.64 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 C-N-CA 124.617 1.167 . . . . 0.0 109.73 -179.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 14.9 m-30 -56.93 -45.13 82.96 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 118.806 0.73 . . . . 0.0 112.61 175.094 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -74.51 -36.4 63.2 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.44 1.096 . . . . 0.0 111.99 -174.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 72.1 mtt85 -70.16 -40.28 74.83 Favored 'General case' 0 N--CA 1.484 1.229 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 169.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 35.3 m-85 -132.22 88.41 40.4 Favored Pre-proline 0 CA--C 1.546 0.792 0 C-N-CA 125.398 1.479 . . . . 0.0 110.87 -167.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -68.05 -19.96 44.88 Favored 'Trans proline' 0 CA--C 1.538 0.711 0 C-N-CA 122.795 2.33 . . . . 0.0 114.013 -170.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 8.4 p-80 -71.94 -23.63 61.49 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 123.619 0.767 . . . . 0.0 112.919 173.01 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -85.31 1.93 46.27 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 126.56 1.944 . . . . 0.0 113.593 -179.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? . . . . . 0 C--O 1.253 1.256 0 C-N-CA 125.715 1.606 . . . . 0.0 110.84 172.404 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 69.9 m . . . . . 0 N--CA 1.477 0.891 0 N-CA-C 111.748 0.277 . . . . 0.0 111.748 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.6 p -152.2 146.3 15.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 C-N-CA 124.751 1.221 . . . . 0.0 111.803 179.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.1 p -148.01 149.92 33.03 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.74 1.616 . . . . 0.0 111.292 171.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -154.63 164.33 38.9 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.41 1.084 . . . . 0.0 112.756 -175.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 101.74 132.82 7.86 Favored Glycine 0 CA--C 1.535 1.317 0 C-N-CA 125.673 1.606 . . . . 0.0 113.908 173.347 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -155.24 154.65 28.94 Favored Pre-proline 0 CA--C 1.552 1.034 0 C-N-CA 126.321 1.849 . . . . 0.0 111.137 178.363 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo -69.9 153.1 68.67 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 123.142 2.562 . . . . 0.0 112.343 174.171 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 67.8 m -134.53 66.17 69.23 Favored Pre-proline 0 N--CA 1.477 0.894 0 C-N-CA 124.709 1.204 . . . . 0.0 112.445 -175.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -66.97 135.68 38.57 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 123.102 2.535 . . . . 0.0 111.567 175.301 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 90.0 mt -142.85 152.47 42.2 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.474 1.509 . . . . 0.0 112.158 -176.249 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 54.7 p -80.41 161.2 25.07 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.204 1.402 . . . . 0.0 112.353 169.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 88.6 p -145.96 -4.73 0.63 Allowed 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.565 1.32 . . . . 0.0 114.565 -178.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -121.6 -3.14 9.32 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 126.322 1.849 . . . . 0.0 114.765 -171.507 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 42.3 m -73.17 141.32 47.4 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.059 0.944 . . . . 0.0 113.481 -173.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 60.42 10.04 2.28 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 116.859 2.17 . . . . 0.0 116.859 171.453 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -69.46 -20.58 63.75 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 114.789 1.403 . . . . 0.0 114.789 -174.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 . . . . . 0 CA--C 1.549 0.905 0 C-N-CA 124.991 1.317 . . . . 0.0 114.532 -179.732 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.569 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -82.78 146.35 29.02 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.218 1.007 . . . . 0.0 110.898 167.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 61.5 mt -128.9 157.78 40.63 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.57 1.148 . . . . 0.0 112.712 -169.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 -80.8 141.62 34.53 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.074 0.95 . . . . 0.0 110.206 166.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -100.16 -13.1 19.08 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 114.811 1.411 . . . . 0.0 114.811 -171.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -149.56 167.74 25.46 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.586 1.154 . . . . 0.0 113.221 -172.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.69 -162.03 53.72 Favored Glycine 0 CA--C 1.541 1.704 0 C-N-CA 124.17 0.891 . . . . 0.0 113.916 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -67.52 -16.44 47.25 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 123.194 2.596 . . . . 0.0 113.649 -177.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 97.2 mt -92.68 4.22 54.12 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.756 1.222 . . . . 0.0 113.915 175.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.1 122.21 11.17 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 120.941 1.7 . . . . 0.0 112.139 -177.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 82.64 4.62 90.02 Favored Glycine 0 CA--C 1.539 1.593 0 C-N-CA 125.457 1.503 . . . . 0.0 115.372 -174.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 16.5 mt -102.1 159.86 28.12 Favored Pre-proline 0 CA--C 1.555 1.14 0 C-N-CA 126.15 1.78 . . . . 0.0 111.271 -179.172 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.78 160.45 37.56 Favored 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 124.317 3.344 . . . . 0.0 113.884 -165.296 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 29.6 t -103.24 -32.01 2.99 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 178.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 18.1 p -124.51 170.42 10.91 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 125.181 1.393 . . . . 0.0 113.898 177.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 39.3 ttm180 -66.03 -34.58 78.42 Favored 'General case' 0 N--CA 1.48 1.046 0 O-C-N 121.019 -1.05 . . . . 0.0 111.113 178.359 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 34.2 m -61.51 -46.54 89.54 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.028 0.931 . . . . 0.0 111.255 168.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -60.22 -44.51 95.13 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 119.14 0.882 . . . . 0.0 111.426 176.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.39 -41.1 96.84 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.439 0.696 . . . . 0.0 112.538 178.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 20.7 ttp180 -67.88 -40.51 83.53 Favored 'General case' 0 N--CA 1.479 1.005 0 O-C-N 121.114 -0.991 . . . . 0.0 112.344 176.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 72.2 t -62.74 -45.18 99.47 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 C-N-CA 123.486 0.715 . . . . 0.0 110.799 175.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 23.7 mt -58.27 -49.05 78.5 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 118.389 -0.815 . . . . 0.0 112.193 173.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 51.9 mt -52.76 -52.12 30.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 CA-C-N 118.796 0.726 . . . . 0.0 110.043 176.012 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -65.95 -50.83 63.0 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 -176.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -68.57 -43.03 77.44 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 118.933 0.788 . . . . 0.0 112.511 -175.259 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -64.85 -45.88 84.23 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 118.639 -0.696 . . . . 0.0 110.48 175.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 68.1 t90 -58.98 -47.35 85.47 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-O 117.08 -1.438 . . . . 0.0 111.579 173.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -55.15 -49.32 72.11 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 121.329 1.877 . . . . 0.0 112.771 178.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -64.47 -51.73 61.57 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 121.124 -0.985 . . . . 0.0 112.427 179.015 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 10.3 mmm180 -58.22 -47.47 83.4 Favored 'General case' 0 C--O 1.213 -0.829 0 C-N-CA 123.114 0.566 . . . . 0.0 110.51 177.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 18.8 tptp -60.17 -37.33 79.85 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 125.936 1.695 . . . . 0.0 113.143 177.414 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 61.1 mtpt -62.89 -31.16 72.16 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 119.194 0.906 . . . . 0.0 111.866 170.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 68.7 m -83.15 -20.06 35.45 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 115.922 1.823 . . . . 0.0 115.922 165.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -145.16 77.81 12.72 Favored Pre-proline 0 N--CA 1.479 0.988 0 C-N-CA 127.06 2.144 . . . . 0.0 111.254 -162.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -56.77 -24.25 54.48 Favored 'Trans proline' 0 CA--C 1.546 1.077 0 C-N-CA 122.624 2.216 . . . . 0.0 114.756 -170.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 44.8 p90 -71.85 -6.55 42.54 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 116.043 1.868 . . . . 0.0 116.043 177.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 14.0 tp -70.58 131.83 44.57 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 120.981 1.719 . . . . 0.0 114.101 -170.444 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 41.4 ptt180 -87.79 160.07 18.18 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 124.904 1.282 . . . . 0.0 113.735 176.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -139.17 129.83 25.99 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.741 2.016 . . . . 0.0 109.995 -169.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -147.87 135.04 20.43 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.287 1.035 . . . . 0.0 111.332 178.147 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 63.8 mtt -129.82 1.48 4.87 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 114.731 1.382 . . . . 0.0 114.731 -169.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 66.2 m -62.36 151.1 37.74 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 119.057 0.844 . . . . 0.0 111.613 175.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 43.2 p-10 -50.74 -37.81 44.0 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 114.65 1.352 . . . . 0.0 114.65 -174.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt -52.97 -40.05 63.42 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.408 1.483 . . . . 0.0 113.167 173.317 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.5 -39.01 89.41 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 123.625 0.77 . . . . 0.0 112.042 176.226 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.6 mp -73.83 -45.19 50.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 C-N-CA 123.391 0.677 . . . . 0.0 109.3 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 9.9 m-30 -55.94 -44.51 78.45 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 118.779 0.718 . . . . 0.0 112.214 175.199 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.0 -39.72 55.19 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.975 1.31 . . . . 0.0 112.49 -174.497 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 94.5 mtt-85 -74.89 -36.52 62.24 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.888 0.875 . . . . 0.0 112.704 175.268 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 48.3 m-85 -131.68 75.92 75.56 Favored Pre-proline 0 CA--C 1.546 0.816 0 C-N-CA 125.958 1.703 . . . . 0.0 110.834 -170.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -66.12 -14.92 46.55 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.083 2.522 . . . . 0.0 114.031 -175.303 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 13.2 p-80 -73.52 -24.39 60.14 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.198 0.999 . . . . 0.0 113.279 171.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.71 -53.71 5.99 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.861 1.265 . . . . 0.0 112.061 -162.591 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 65.7 ttt-85 . . . . . 0 C--O 1.253 1.28 0 C-N-CA 126.635 1.974 . . . . 0.0 112.737 -176.181 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 21.5 t . . . . . 0 N--CA 1.473 0.723 0 CA-C-O 120.363 0.125 . . . . 0.0 111.256 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 48.3 t -138.98 130.23 34.85 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 C-N-CA 125.469 1.507 . . . . 0.0 109.777 177.112 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 68.4 m -140.26 135.87 32.73 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.024 1.329 . . . . 0.0 111.427 178.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -154.04 155.32 35.28 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.135 1.374 . . . . 0.0 111.69 176.281 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -172.41 130.1 1.85 Allowed Glycine 0 CA--C 1.533 1.216 0 C-N-CA 124.345 0.974 . . . . 0.0 112.421 171.067 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -146.65 61.32 6.7 Favored Pre-proline 0 CA--C 1.553 1.092 0 C-N-CA 124.91 1.284 . . . . 0.0 111.757 178.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -67.75 150.18 78.94 Favored 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 123.371 2.714 . . . . 0.0 112.834 -177.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 75.1 p -153.23 153.78 29.91 Favored Pre-proline 0 N--CA 1.474 0.757 0 C-N-CA 125.324 1.449 . . . . 0.0 112.131 178.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.11 152.08 67.35 Favored 'Trans proline' 0 CA--C 1.54 0.82 0 C-N-CA 123.106 2.537 . . . . 0.0 112.178 175.047 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 60.5 tp -146.82 134.78 21.41 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.747 1.219 . . . . 0.0 111.529 -179.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.8 t -151.47 146.2 25.75 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.981 1.312 . . . . 0.0 110.996 169.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 78.9 p -141.92 9.13 1.92 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.144 1.378 . . . . 0.0 113.987 -176.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -112.43 120.46 41.73 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.799 1.24 . . . . 0.0 112.34 -172.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 40.4 m -124.23 3.85 8.52 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.942 1.297 . . . . 0.0 113.755 176.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 58.09 17.03 4.19 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 126.452 1.901 . . . . 0.0 115.539 -178.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -76.12 -24.14 54.93 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 114.036 1.125 . . . . 0.0 114.036 -174.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 . . . . . 0 N--CA 1.476 0.869 0 C-N-CA 125.702 1.601 . . . . 0.0 114.472 -179.218 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.51 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -88.48 154.89 19.99 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.757 1.223 . . . . 0.0 111.114 164.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 91.6 mt -132.59 157.55 44.45 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.952 1.301 . . . . 0.0 112.112 -175.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -81.24 138.61 35.76 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.468 0.707 . . . . 0.0 109.974 163.218 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -97.26 -20.57 17.8 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 -174.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -140.66 165.47 27.4 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.211 1.405 . . . . 0.0 112.428 -171.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.17 -163.27 54.89 Favored Glycine 0 CA--C 1.54 1.648 0 C-N-CA 124.246 0.927 . . . . 0.0 114.13 178.115 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -67.74 -17.14 47.42 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 123.267 2.645 . . . . 0.0 113.833 -175.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.2 mt -94.08 5.95 50.09 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 124.612 1.165 . . . . 0.0 113.935 175.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.42 122.37 11.05 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 120.875 1.67 . . . . 0.0 112.123 -177.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.25 5.66 88.68 Favored Glycine 0 CA--C 1.541 1.718 0 C-N-CA 125.568 1.556 . . . . 0.0 115.469 -175.104 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 20.3 mt -104.02 160.71 25.2 Favored Pre-proline 0 CA--C 1.557 1.228 0 C-N-CA 126.348 1.859 . . . . 0.0 111.295 -179.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -71.36 164.95 34.01 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 124.318 3.346 . . . . 0.0 113.408 -169.165 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.9 t -107.53 -29.58 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 O-C-N 121.324 -0.86 . . . . 0.0 112.468 175.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 22.1 p -125.73 172.12 10.07 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 125.31 1.444 . . . . 0.0 114.056 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 34.6 ptt-85 -63.42 -35.6 80.97 Favored 'General case' 0 N--CA 1.48 1.071 0 O-C-N 121.284 -0.885 . . . . 0.0 111.92 173.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 37.2 m -65.39 -44.08 88.62 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.971 0.909 . . . . 0.0 110.95 172.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 76.3 m-20 -60.52 -46.42 90.19 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 118.522 0.601 . . . . 0.0 111.066 175.043 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.94 -42.3 98.95 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.61 0.764 . . . . 0.0 112.611 179.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 62.8 ttp85 -64.55 -42.84 95.43 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 118.962 0.801 . . . . 0.0 112.234 175.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 54.5 t -62.39 -47.87 91.01 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 123.752 0.821 . . . . 0.0 111.078 176.128 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.2 mp -58.95 -48.63 80.82 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 118.519 -0.753 . . . . 0.0 112.791 175.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 55.2 mt -55.49 -51.03 61.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 CA-C-N 118.775 0.716 . . . . 0.0 110.173 176.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -65.62 -49.19 69.62 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -177.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -66.72 -46.61 74.97 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 118.986 0.812 . . . . 0.0 112.299 -177.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -60.31 -49.71 76.51 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 118.458 -0.782 . . . . 0.0 110.25 175.044 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 64.3 t90 -56.44 -47.12 79.78 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-O 117.719 -1.134 . . . . 0.0 112.116 176.385 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -57.15 -48.26 79.13 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 120.792 1.633 . . . . 0.0 113.078 178.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -68.92 -48.52 63.08 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 119.902 1.228 . . . . 0.0 112.399 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 34.2 mmt180 -60.54 -39.62 88.57 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.673 0.789 . . . . 0.0 110.175 178.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -72.64 -30.13 64.04 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 125.057 1.343 . . . . 0.0 113.581 176.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.7 mmtp -62.29 -31.46 72.06 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 120.135 1.334 . . . . 0.0 111.412 165.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 60.2 m -80.0 -25.76 40.16 Favored 'General case' 0 N--CA 1.483 1.193 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 165.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -139.85 78.58 24.87 Favored Pre-proline 0 N--CA 1.478 0.961 0 C-N-CA 126.775 2.03 . . . . 0.0 111.667 -168.41 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -59.93 -11.78 16.43 Favored 'Trans proline' 0 CA--C 1.546 1.121 0 C-N-CA 123.539 2.826 . . . . 0.0 116.495 -166.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 40.6 p90 -85.08 -7.11 59.24 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 126.778 2.031 . . . . 0.0 115.21 176.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.4 tp -62.32 137.73 58.31 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 114.515 1.302 . . . . 0.0 114.515 -167.56 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 30.1 mmm180 -83.83 154.74 23.33 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 125.258 1.423 . . . . 0.0 113.113 179.107 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -137.62 130.35 29.98 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.826 2.05 . . . . 0.0 109.671 -175.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 59.2 t0 -143.74 129.61 19.43 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.011 0.924 . . . . 0.0 111.004 176.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 66.1 mtt -124.98 13.54 8.45 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.476 1.511 . . . . 0.0 112.952 -179.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 38.8 t -59.9 148.45 34.91 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.568 -0.707 . . . . 0.0 110.906 170.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -54.66 -35.25 63.33 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.21 -0.931 . . . . 0.0 112.437 -178.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -60.3 -36.19 77.33 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.369 1.067 . . . . 0.0 113.039 175.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.49 -41.06 98.55 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 118.95 0.795 . . . . 0.0 111.429 174.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.79 -46.91 59.16 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 C-N-CA 123.791 0.837 . . . . 0.0 109.758 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 16.9 m-30 -55.08 -46.42 75.44 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 118.89 0.768 . . . . 0.0 112.575 175.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.7 tmt_? -76.71 -38.47 54.27 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.508 1.123 . . . . 0.0 112.332 -172.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 19.9 ttm180 -75.9 -37.13 59.12 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.804 0.842 . . . . 0.0 112.646 175.328 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 34.9 m-85 -128.1 82.81 67.73 Favored Pre-proline 0 CA--C 1.547 0.864 0 C-N-CA 126.13 1.772 . . . . 0.0 110.648 -173.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -66.01 -19.68 57.63 Favored 'Trans proline' 0 CA--C 1.539 0.738 0 C-N-CA 122.971 2.447 . . . . 0.0 114.174 -172.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 8.1 p-80 -72.09 -20.6 61.62 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.917 0.887 . . . . 0.0 113.294 172.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -91.88 -0.91 57.52 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 127.015 2.126 . . . . 0.0 113.578 -178.531 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.231 0 C-N-CA 124.769 1.228 . . . . 0.0 111.211 170.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 64.1 m . . . . . 0 N--CA 1.477 0.882 0 CA-C-O 120.722 0.296 . . . . 0.0 111.784 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 27.0 m -126.7 155.38 37.28 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 125.221 1.408 . . . . 0.0 112.547 -178.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 79.8 p -145.02 155.7 43.51 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.689 1.595 . . . . 0.0 111.988 177.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 51.1 p90 -153.54 165.58 35.42 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.057 1.343 . . . . 0.0 112.535 -175.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 81.94 162.53 30.41 Favored Glycine 0 CA--C 1.538 1.507 0 C-N-CA 124.992 1.282 . . . . 0.0 114.742 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -152.34 154.15 31.71 Favored Pre-proline 0 CA--C 1.55 0.97 0 C-N-CA 125.852 1.661 . . . . 0.0 111.723 -179.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -69.44 160.35 50.13 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 123.353 2.702 . . . . 0.0 112.447 174.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 37.2 p -132.62 56.43 22.62 Favored Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 125.158 1.383 . . . . 0.0 113.98 -173.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -68.03 156.09 67.14 Favored 'Trans proline' 0 CA--C 1.542 0.925 0 C-N-CA 123.368 2.712 . . . . 0.0 112.891 178.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.5 pp -146.12 157.53 43.85 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.548 1.539 . . . . 0.0 111.784 173.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 83.5 p -140.0 -11.3 1.13 Allowed 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 115.876 1.806 . . . . 0.0 115.876 -173.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.2 t -152.92 154.1 34.36 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.409 1.084 . . . . 0.0 112.616 -178.187 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -129.95 9.42 5.34 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 127.233 2.213 . . . . 0.0 113.257 179.443 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 6.9 t -142.77 -178.53 5.84 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.272 1.429 . . . . 0.0 113.067 -172.136 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 56.23 50.02 14.22 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 126.315 1.846 . . . . 0.0 113.3 -179.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 25.8 m-20 -76.69 56.34 1.14 Allowed 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.536 1.535 . . . . 0.0 111.702 174.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 . . . . . 0 N--CA 1.478 0.925 0 C-N-CA 126.57 1.948 . . . . 0.0 114.16 -176.24 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.6 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -85.32 159.13 20.1 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.774 1.23 . . . . 0.0 111.294 167.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 95.1 mt -133.94 157.02 47.07 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.871 1.269 . . . . 0.0 112.529 -174.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 -82.09 140.31 33.92 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 123.908 0.883 . . . . 0.0 109.944 163.205 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -98.19 -20.3 17.36 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 -174.423 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -140.45 165.13 28.28 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.124 1.369 . . . . 0.0 112.492 -171.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 72.92 -162.93 54.9 Favored Glycine 0 CA--C 1.541 1.674 0 C-N-CA 124.2 0.905 . . . . 0.0 114.074 178.4 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -67.54 -17.0 48.36 Favored 'Trans proline' 0 CA--C 1.541 0.865 0 C-N-CA 123.325 2.683 . . . . 0.0 113.763 -176.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.0 mt -93.85 5.66 50.93 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.701 1.2 . . . . 0.0 113.915 175.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.86 121.53 9.46 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 120.823 1.647 . . . . 0.0 111.909 -178.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.37 8.09 85.61 Favored Glycine 0 CA--C 1.54 1.631 0 C-N-CA 125.358 1.456 . . . . 0.0 115.5 -174.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 18.3 mt -107.84 159.51 30.19 Favored Pre-proline 0 CA--C 1.558 1.258 0 C-N-CA 126.42 1.888 . . . . 0.0 111.469 -179.176 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -71.75 166.27 30.0 Favored 'Trans proline' 0 C--N 1.354 0.853 0 C-N-CA 124.655 3.57 . . . . 0.0 113.968 -169.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 5.7 t -111.58 -26.35 3.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 123.856 0.862 . . . . 0.0 112.486 177.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 29.8 p -127.87 172.6 10.72 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 125.296 1.439 . . . . 0.0 114.236 179.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -68.51 -36.93 79.57 Favored 'General case' 0 N--CA 1.482 1.157 0 O-C-N 121.167 -0.958 . . . . 0.0 111.358 176.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 10.2 p -63.56 -42.6 98.34 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 118.492 -0.765 . . . . 0.0 111.761 169.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 84.5 m-20 -58.37 -50.98 71.73 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 119.582 1.083 . . . . 0.0 110.809 173.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.01 -41.19 97.8 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.565 0.746 . . . . 0.0 112.531 -178.229 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 33.6 ttt85 -65.58 -43.58 89.3 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.08 0.952 . . . . 0.0 112.063 177.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 70.4 t -64.47 -45.79 94.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 C-N-CA 123.756 0.822 . . . . 0.0 111.227 175.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 54.6 mt -61.28 -43.92 98.09 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 118.309 -0.853 . . . . 0.0 112.406 176.414 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 47.7 mt -55.5 -51.57 56.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 CA-C-N 119.143 0.883 . . . . 0.0 109.949 173.28 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -63.3 -46.97 84.25 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -178.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 55.4 m-20 -68.91 -45.9 69.67 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.84 0.856 . . . . 0.0 112.189 -177.131 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -63.62 -46.45 85.66 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 119.131 -0.461 . . . . 0.0 110.793 177.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.413 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 66.8 t90 -60.03 -46.04 90.83 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-O 117.657 -1.163 . . . . 0.0 111.658 172.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -56.19 -45.72 79.68 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 120.873 1.67 . . . . 0.0 112.877 179.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -67.75 -52.06 41.89 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 119.644 1.111 . . . . 0.0 112.401 177.103 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 13.1 mmm180 -56.84 -48.41 78.12 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 121.759 -0.588 . . . . 0.0 110.626 178.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.9 tmtt? -67.21 -30.14 69.99 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.593 1.557 . . . . 0.0 113.562 178.435 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -60.77 -36.52 79.15 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 120.293 1.406 . . . . 0.0 111.096 166.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 64.9 m -79.95 -20.69 45.03 Favored 'General case' 0 N--CA 1.482 1.166 0 N-CA-C 115.343 1.609 . . . . 0.0 115.343 167.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -141.5 73.34 24.82 Favored Pre-proline 0 CA--C 1.548 0.894 0 C-N-CA 127.084 2.153 . . . . 0.0 111.469 -166.078 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -61.31 -7.98 9.52 Favored 'Trans proline' 0 CA--C 1.546 1.084 0 C-N-CA 123.744 2.963 . . . . 0.0 116.325 -166.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 41.2 p90 -84.64 -10.17 57.58 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.586 1.954 . . . . 0.0 114.88 174.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 16.5 tp -65.48 135.47 55.21 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 119.862 1.21 . . . . 0.0 113.952 -167.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -83.57 156.08 22.95 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.761 1.225 . . . . 0.0 113.021 178.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.413 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -137.23 130.98 31.75 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 127.027 2.131 . . . . 0.0 109.228 -174.23 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -137.81 129.66 28.57 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.233 1.013 . . . . 0.0 110.829 178.062 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 63.8 mtt -126.72 16.21 7.5 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.469 1.508 . . . . 0.0 113.53 -178.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 47.6 t -63.3 148.97 46.81 Favored 'General case' 0 N--CA 1.47 0.575 0 O-C-N 121.573 -0.704 . . . . 0.0 110.615 165.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -56.51 -32.02 64.67 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 121.118 -0.989 . . . . 0.0 112.329 178.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 60.3 mtpt -59.78 -33.43 71.69 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.31 1.044 . . . . 0.0 112.997 174.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.27 -40.81 97.46 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 119.161 0.891 . . . . 0.0 111.486 173.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.87 -46.99 58.21 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 C-N-CA 123.814 0.846 . . . . 0.0 109.405 179.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.7 m-30 -56.24 -45.54 79.94 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 118.759 0.708 . . . . 0.0 112.568 176.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.09 -38.55 52.13 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 124.409 1.084 . . . . 0.0 112.121 -173.589 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 62.1 ttm-85 -75.61 -35.57 60.49 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.934 0.893 . . . . 0.0 112.494 175.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 46.7 m-85 -128.53 82.93 67.61 Favored Pre-proline 0 CA--C 1.546 0.795 0 C-N-CA 126.088 1.755 . . . . 0.0 110.724 -174.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -66.03 -18.54 57.06 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 123.088 2.526 . . . . 0.0 114.092 -172.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 7.8 p-80 -73.83 -21.63 60.06 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.022 0.929 . . . . 0.0 113.333 173.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -90.17 -8.36 51.38 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 126.113 1.765 . . . . 0.0 113.86 -173.163 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? . . . . . 0 C--O 1.254 1.311 0 C-N-CA 125.109 1.363 . . . . 0.0 110.977 175.418 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 12.3 t . . . . . 0 N--CA 1.474 0.752 0 CA-C-O 120.492 0.186 . . . . 0.0 111.458 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.1 p -149.11 146.67 17.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 125.308 1.443 . . . . 0.0 111.503 178.1 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.1 m -132.08 132.74 43.6 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.17 1.388 . . . . 0.0 111.013 177.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 54.6 p90 -154.93 162.86 40.96 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.084 1.354 . . . . 0.0 112.445 -177.141 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 173.6 147.66 6.06 Favored Glycine 0 CA--C 1.536 1.383 0 C-N-CA 124.693 1.14 . . . . 0.0 113.171 174.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -147.29 60.58 5.71 Favored Pre-proline 0 CA--C 1.554 1.122 0 C-N-CA 124.712 1.205 . . . . 0.0 112.534 -179.459 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -67.82 152.22 77.66 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 123.356 2.704 . . . . 0.0 112.586 179.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 9.3 t -147.3 73.52 11.88 Favored Pre-proline 0 N--CA 1.475 0.802 0 C-N-CA 124.548 1.139 . . . . 0.0 111.379 177.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -73.17 155.3 52.06 Favored 'Trans proline' 0 CA--C 1.542 0.896 0 C-N-CA 123.621 2.881 . . . . 0.0 112.824 -179.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -150.27 154.73 38.4 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.496 1.518 . . . . 0.0 112.307 174.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 32.9 m -127.24 -4.3 6.17 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 115.088 1.514 . . . . 0.0 115.088 -173.158 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 49.5 m -142.24 150.94 41.58 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.859 1.264 . . . . 0.0 112.606 -172.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -151.41 137.8 18.55 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.11 1.364 . . . . 0.0 111.467 177.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 75.6 p -111.25 -7.17 14.45 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 125.415 1.486 . . . . 0.0 114.801 -178.224 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -67.71 -12.3 60.21 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 -173.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -68.68 -21.81 64.41 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.683 1.193 . . . . 0.0 113.543 172.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 . . . . . 0 N--CA 1.476 0.853 0 C-N-CA 125.511 1.524 . . . . 0.0 113.605 177.253 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.546 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -85.04 156.89 20.91 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.539 1.136 . . . . 0.0 111.443 168.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 98.2 mt -131.97 156.27 46.49 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.028 1.331 . . . . 0.0 112.381 -175.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 84.9 m-70 -83.04 142.82 31.04 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.057 0.943 . . . . 0.0 109.755 163.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -103.14 -18.17 15.05 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 114.695 1.368 . . . . 0.0 114.695 -172.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -139.8 163.05 33.65 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.114 1.365 . . . . 0.0 112.459 -172.369 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.05 -160.91 54.12 Favored Glycine 0 CA--C 1.539 1.572 0 C-N-CA 124.137 0.875 . . . . 0.0 114.001 178.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -67.63 -16.4 46.7 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 123.339 2.693 . . . . 0.0 113.763 -176.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 98.6 mt -92.95 4.87 53.2 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.647 1.179 . . . . 0.0 113.807 174.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.84 114.0 2.33 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 121.233 1.833 . . . . 0.0 111.91 -179.081 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.68 5.86 68.41 Favored Glycine 0 CA--C 1.543 1.785 0 C-N-CA 125.322 1.439 . . . . 0.0 115.57 -173.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 6.0 mp -104.97 156.24 36.35 Favored Pre-proline 0 CA--C 1.556 1.191 0 C-N-CA 126.807 2.043 . . . . 0.0 111.63 178.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -67.87 163.29 36.09 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 124.912 3.741 . . . . 0.0 113.987 -170.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.8 t -105.42 -30.18 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 O-C-N 121.373 -0.829 . . . . 0.0 112.319 175.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 17.8 p -125.87 170.05 12.03 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 125.235 1.414 . . . . 0.0 114.266 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 37.5 ttt180 -62.07 -39.13 91.36 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.593 1.157 . . . . 0.0 111.084 174.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 18.5 t -62.62 -46.71 87.01 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.843 0.857 . . . . 0.0 111.101 171.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 78.5 m-20 -57.99 -48.94 78.51 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 118.852 0.751 . . . . 0.0 111.069 176.284 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.58 -42.87 97.56 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -179.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 70.2 ttp85 -67.07 -41.99 85.46 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 121.199 -0.938 . . . . 0.0 112.597 176.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 78.5 t -63.84 -43.4 97.84 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.034 0 C-N-CA 123.603 0.761 . . . . 0.0 111.14 175.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 55.1 mt -60.49 -47.19 87.21 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 118.169 -0.92 . . . . 0.0 112.102 175.062 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 60.6 mt -53.4 -50.28 49.2 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 CA-C-N 119.064 0.847 . . . . 0.0 110.111 173.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 12.3 t80 -62.89 -51.16 68.06 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 112.916 0.709 . . . . 0.0 112.916 -178.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -70.87 -41.44 71.37 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -174.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 57.4 mm-40 -58.7 -53.52 57.41 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 118.574 -0.727 . . . . 0.0 110.057 169.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.404 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 61.4 t90 -55.9 -44.58 78.35 Favored 'General case' 0 C--O 1.218 -0.577 0 CA-C-O 117.444 -1.265 . . . . 0.0 112.081 178.124 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -56.33 -51.05 69.66 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 120.755 1.616 . . . . 0.0 112.856 176.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -68.13 -45.29 74.02 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 119.879 1.218 . . . . 0.0 112.618 179.469 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 31.4 mmt180 -59.79 -44.48 93.92 Favored 'General case' 0 C--O 1.218 -0.583 0 C-N-CA 123.773 0.829 . . . . 0.0 109.952 177.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -63.69 -36.55 84.21 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 126.055 1.742 . . . . 0.0 112.819 175.329 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -62.3 -30.82 71.41 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 119.381 0.992 . . . . 0.0 111.845 170.012 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 68.4 m -82.91 -20.97 34.38 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 115.44 1.644 . . . . 0.0 115.44 166.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -140.53 79.0 20.86 Favored Pre-proline 0 CA--C 1.547 0.86 0 C-N-CA 127.077 2.151 . . . . 0.0 111.419 -167.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -63.81 6.03 0.31 Allowed 'Trans proline' 0 CA--C 1.55 1.311 0 C-N-CA 124.252 3.301 . . . . 0.0 116.878 -169.184 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 40.5 p90 -103.55 -6.76 21.4 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 127.402 2.281 . . . . 0.0 114.668 175.425 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 13.7 tp -64.82 135.5 55.85 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 -165.381 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 85.0 mtp180 -86.21 156.57 20.25 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.593 1.557 . . . . 0.0 113.063 178.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.404 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -138.38 131.49 30.02 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.726 2.01 . . . . 0.0 110.043 -173.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 33.3 t0 -146.6 135.96 22.83 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.066 0.946 . . . . 0.0 111.432 177.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 66.3 mtt -133.3 3.41 3.64 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 114.467 1.284 . . . . 0.0 114.467 -173.503 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 72.5 m -60.6 145.05 50.33 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 119.166 0.894 . . . . 0.0 110.96 173.082 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -61.82 -25.39 67.47 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 114.813 1.412 . . . . 0.0 114.813 -163.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -56.11 -38.38 70.69 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.091 0.956 . . . . 0.0 112.719 171.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.77 -35.75 75.28 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 123.8 0.84 . . . . 0.0 112.05 172.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 4.8 mm -78.35 -43.61 26.88 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 C-N-CA 123.85 0.86 . . . . 0.0 109.544 -175.052 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -59.5 -43.53 93.33 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.255 0.622 . . . . 0.0 111.932 173.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.72 -39.27 57.63 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.52 1.128 . . . . 0.0 112.774 -174.52 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 88.2 mtt-85 -69.63 -40.3 76.62 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.749 0.82 . . . . 0.0 112.478 172.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -127.67 77.89 75.57 Favored Pre-proline 0 CA--C 1.544 0.748 0 C-N-CA 125.094 1.358 . . . . 0.0 111.142 -168.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -68.02 -10.1 27.82 Favored 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 123.389 2.726 . . . . 0.0 114.097 -175.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 14.2 p-80 -78.9 -21.9 46.7 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.144 0.977 . . . . 0.0 113.469 169.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -89.7 -32.52 16.99 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.774 1.63 . . . . 0.0 112.462 -168.844 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 . . . . . 0 C--O 1.254 1.335 0 C-N-CA 124.723 1.209 . . . . 0.0 113.715 174.811 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.7 t . . . . . 0 N--CA 1.474 0.726 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.9 m -131.47 11.47 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 C-N-CA 125.809 1.644 . . . . 0.0 112.99 178.252 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 40.0 m -82.37 54.24 2.52 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 125.678 1.591 . . . . 0.0 113.276 -169.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 82.4 m-85 -133.72 166.13 23.33 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.907 1.683 . . . . 0.0 112.99 -172.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 104.87 107.38 3.21 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 125.732 1.635 . . . . 0.0 112.77 178.409 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -153.39 153.06 28.75 Favored Pre-proline 0 CA--C 1.552 1.037 0 C-N-CA 126.157 1.783 . . . . 0.0 111.049 177.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -71.17 140.94 38.48 Favored 'Trans proline' 0 CA--C 1.543 0.957 0 C-N-CA 123.148 2.565 . . . . 0.0 112.373 177.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 71.2 m -138.82 63.57 32.31 Favored Pre-proline 0 N--CA 1.477 0.888 0 C-N-CA 125.193 1.397 . . . . 0.0 111.847 -179.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -67.78 131.7 24.88 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 C-N-CA 123.337 2.691 . . . . 0.0 112.387 -177.071 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 62.3 tp -155.76 134.2 11.67 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.309 1.443 . . . . 0.0 111.051 178.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 31.6 t -154.83 131.35 10.54 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.648 1.179 . . . . 0.0 111.22 170.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.3 t -158.99 82.52 0.79 Allowed 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.849 1.259 . . . . 0.0 110.416 175.166 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -140.62 -11.81 1.02 Allowed 'General case' 0 N--CA 1.479 1.016 0 N-CA-C 115.797 1.777 . . . . 0.0 115.797 -174.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 21.3 t -65.39 111.98 3.31 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 119.516 1.053 . . . . 0.0 111.407 -171.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 53.63 20.46 2.17 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 125.867 1.667 . . . . 0.0 114.583 -173.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -75.3 -27.45 59.34 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 -169.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 . . . . . 0 CA--C 1.548 0.878 0 C-N-CA 125.893 1.677 . . . . 0.0 113.898 179.998 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.634 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -96.7 149.07 22.22 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.064 1.346 . . . . 0.0 112.401 174.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 89.5 mt -128.29 157.39 41.07 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.694 1.597 . . . . 0.0 111.741 -179.293 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -77.46 140.02 39.75 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.898 0.879 . . . . 0.0 110.479 167.195 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -99.1 -12.39 20.55 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 -174.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -149.49 168.16 24.24 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.786 1.235 . . . . 0.0 113.211 -172.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.78 -164.47 54.14 Favored Glycine 0 CA--C 1.54 1.615 0 C-N-CA 124.151 0.882 . . . . 0.0 114.094 179.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -67.72 -16.82 47.14 Favored 'Trans proline' 0 CA--C 1.542 0.925 0 C-N-CA 123.254 2.636 . . . . 0.0 113.674 -177.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.1 mt -92.49 4.42 53.55 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.784 1.234 . . . . 0.0 113.877 175.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.01 122.9 11.93 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 120.922 1.692 . . . . 0.0 112.088 -177.342 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.23 4.45 89.65 Favored Glycine 0 CA--C 1.54 1.612 0 C-N-CA 125.418 1.485 . . . . 0.0 115.384 -174.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 21.5 mt -103.85 160.05 27.33 Favored Pre-proline 0 CA--C 1.555 1.141 0 C-N-CA 126.204 1.802 . . . . 0.0 111.174 179.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -80.23 156.69 22.8 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 124.12 3.213 . . . . 0.0 113.664 -163.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 24.1 t -95.52 -36.32 6.59 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -177.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 22.2 p -123.52 174.24 7.52 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 124.965 1.306 . . . . 0.0 114.413 -178.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -64.12 -39.52 94.22 Favored 'General case' 0 N--CA 1.483 1.184 0 O-C-N 121.176 -0.953 . . . . 0.0 110.83 176.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 35.1 m -61.42 -45.1 95.74 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.196 0.998 . . . . 0.0 111.283 171.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -61.35 -46.92 88.22 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 118.842 0.746 . . . . 0.0 111.16 175.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.16 -38.69 89.99 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.467 -0.77 . . . . 0.0 112.313 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 69.4 ttt180 -67.3 -41.56 85.18 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 119.202 0.91 . . . . 0.0 112.622 173.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 59.7 t -61.12 -49.98 82.43 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 CA-C-N 118.713 0.688 . . . . 0.0 110.972 173.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -62.61 -40.75 97.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 118.319 -0.848 . . . . 0.0 112.464 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 48.8 mt -56.36 -50.72 70.6 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 CA-C-N 119.17 0.895 . . . . 0.0 110.31 170.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -64.29 -45.44 87.98 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -178.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 55.4 t30 -68.39 -46.58 69.63 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.918 0.887 . . . . 0.0 111.948 -177.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 55.6 mm-40 -60.19 -51.75 68.26 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 118.488 -0.767 . . . . 0.0 110.55 172.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.426 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 60.4 t90 -56.26 -47.17 79.06 Favored 'General case' 0 C--O 1.222 -0.358 0 CA-C-N 119.526 1.057 . . . . 0.0 111.929 177.673 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -58.39 -45.5 88.22 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 120.46 1.482 . . . . 0.0 113.027 178.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -69.46 -49.72 52.26 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-N 120.001 1.273 . . . . 0.0 112.747 178.126 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 32.6 mmt180 -59.0 -41.05 86.76 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.93 0.892 . . . . 0.0 109.839 178.066 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 21.5 ttpt -69.7 -31.86 70.13 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.088 1.355 . . . . 0.0 113.447 174.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -59.52 -33.22 71.1 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 120.022 1.283 . . . . 0.0 110.777 167.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 53.1 m -81.02 -24.32 37.99 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 115.453 1.649 . . . . 0.0 115.453 165.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -140.02 78.89 23.47 Favored Pre-proline 0 CA--C 1.552 1.024 0 C-N-CA 127.004 2.122 . . . . 0.0 112.251 -168.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -61.66 -5.81 6.34 Favored 'Trans proline' 0 CA--C 1.549 1.231 0 C-N-CA 123.859 3.039 . . . . 0.0 116.653 -168.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 41.4 p90 -90.89 -6.37 54.26 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.795 2.038 . . . . 0.0 114.887 175.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.3 tp -62.77 135.5 57.38 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 119.702 1.137 . . . . 0.0 113.776 -168.089 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 54.3 mmt-85 -86.06 157.36 20.08 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.61 1.164 . . . . 0.0 112.761 179.199 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.426 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -136.72 131.82 34.01 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 126.714 2.005 . . . . 0.0 110.04 -172.612 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 54.9 t0 -142.89 131.09 21.98 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.186 0.994 . . . . 0.0 111.12 176.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 64.7 mtt -127.71 6.75 6.18 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.359 1.464 . . . . 0.0 113.56 -177.277 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 71.3 m -63.21 147.48 50.81 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 118.884 0.766 . . . . 0.0 110.39 169.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -61.27 -28.33 69.11 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -163.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -57.11 -34.34 68.26 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.459 1.104 . . . . 0.0 113.41 172.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.7 -40.21 96.42 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 119.075 0.852 . . . . 0.0 111.704 173.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.63 -45.71 65.85 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 C-N-CA 124.406 1.083 . . . . 0.0 109.212 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 8.4 m-30 -56.92 -46.43 82.0 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 118.716 0.689 . . . . 0.0 112.279 175.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.72 -38.49 62.3 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.68 1.192 . . . . 0.0 112.57 -173.03 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 75.1 mtp85 -72.37 -38.85 68.42 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 172.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 27.3 m-85 -130.23 83.37 63.19 Favored Pre-proline 0 CA--C 1.548 0.866 0 C-N-CA 125.256 1.423 . . . . 0.0 110.902 -168.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -66.99 -16.79 50.5 Favored 'Trans proline' 0 CA--C 1.541 0.832 0 C-N-CA 123.04 2.493 . . . . 0.0 114.252 -171.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 12.4 p-80 -74.86 -23.45 58.42 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.153 0.981 . . . . 0.0 113.257 173.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -82.65 -24.36 33.81 Favored 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 125.719 1.608 . . . . 0.0 112.723 -171.708 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 8.3 tmm_? . . . . . 0 C--O 1.254 1.292 0 C-N-CA 125.162 1.385 . . . . 0.0 111.918 178.445 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 21.7 m . . . . . 0 N--CA 1.476 0.852 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.5 p -150.65 152.76 11.14 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 125.197 1.399 . . . . 0.0 111.359 -179.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 33.2 t -140.37 149.62 42.9 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.955 1.302 . . . . 0.0 112.039 176.537 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 22.4 t80 -134.98 28.94 3.47 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.887 1.675 . . . . 0.0 111.319 175.431 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 74.79 -156.98 50.04 Favored Glycine 0 CA--C 1.536 1.403 0 C-N-CA 124.282 0.944 . . . . 0.0 112.78 -168.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -130.77 63.15 69.02 Favored Pre-proline 0 CA--C 1.554 1.121 0 C-N-CA 124.837 1.255 . . . . 0.0 112.517 -178.539 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_endo -67.52 151.87 79.23 Favored 'Trans proline' 0 CA--C 1.542 0.919 0 C-N-CA 123.318 2.679 . . . . 0.0 112.523 177.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 78.6 p -152.11 155.97 33.66 Favored Pre-proline 0 N--CA 1.476 0.854 0 C-N-CA 125.358 1.463 . . . . 0.0 112.007 179.136 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -74.63 133.66 17.47 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 123.017 2.478 . . . . 0.0 112.009 177.295 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.3 mp -122.06 151.97 40.31 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.869 1.668 . . . . 0.0 111.018 175.298 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 78.1 p -147.62 149.02 31.74 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.24 1.416 . . . . 0.0 111.764 172.129 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.5 m -135.77 9.35 3.34 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 -170.039 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -146.78 140.18 25.64 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.788 1.235 . . . . 0.0 111.937 -175.495 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 15.4 t -154.09 152.31 30.3 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.339 1.456 . . . . 0.0 111.196 174.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 52.91 40.93 31.77 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 125.493 1.517 . . . . 0.0 113.953 177.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -74.23 82.69 1.84 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.505 1.122 . . . . 0.0 111.549 179.511 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 . . . . . 0 CA--C 1.551 1.013 0 C-N-CA 125.861 1.664 . . . . 0.0 113.701 -171.408 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.604 0 N-CA-C 112.425 0.528 . . . . 0.0 112.425 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -87.62 158.79 18.78 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.756 1.223 . . . . 0.0 111.562 167.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 95.8 mt -135.83 157.03 47.86 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 125.34 1.456 . . . . 0.0 111.812 -177.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -82.2 139.97 33.99 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.535 0.734 . . . . 0.0 109.463 162.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -101.28 -19.07 15.82 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -173.359 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -140.1 164.12 30.9 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 125.323 1.449 . . . . 0.0 112.145 -173.129 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 72.37 -161.37 54.33 Favored Glycine 0 CA--C 1.542 1.727 0 C-N-CA 124.105 0.86 . . . . 0.0 113.992 179.269 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -67.9 -16.8 46.23 Favored 'Trans proline' 0 CA--C 1.541 0.872 0 C-N-CA 123.325 2.684 . . . . 0.0 113.895 -174.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 89.5 mt -95.24 6.78 48.09 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.81 1.244 . . . . 0.0 113.829 175.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.2 113.52 1.97 Allowed 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 121.067 1.758 . . . . 0.0 112.018 -178.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.63 7.68 64.62 Favored Glycine 0 CA--C 1.542 1.779 0 C-N-CA 125.418 1.485 . . . . 0.0 115.672 -173.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 5.7 mp -108.61 155.73 40.02 Favored Pre-proline 0 CA--C 1.556 1.211 0 C-N-CA 126.666 1.986 . . . . 0.0 111.877 179.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -64.82 163.35 28.32 Favored 'Trans proline' 0 C--N 1.354 0.817 0 C-N-CA 125.207 3.938 . . . . 0.0 114.235 -172.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 9.1 t -106.96 -30.29 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 123.719 0.808 . . . . 0.0 112.041 174.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 24.2 p -126.88 169.52 13.18 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 125.161 1.385 . . . . 0.0 114.004 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 41.0 ptt180 -61.97 -36.07 80.35 Favored 'General case' 0 N--CA 1.482 1.138 0 O-C-N 121.306 -0.871 . . . . 0.0 111.789 173.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 22.3 m -63.86 -43.3 96.53 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.361 1.065 . . . . 0.0 110.845 172.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -60.81 -49.75 76.23 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 118.688 0.676 . . . . 0.0 111.2 174.494 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.41 -42.97 93.03 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-N 118.721 0.691 . . . . 0.0 112.308 -179.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.94 -49.04 76.34 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.261 1.024 . . . . 0.0 111.895 175.808 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 51.7 t -60.2 -47.59 91.51 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 123.638 0.775 . . . . 0.0 111.234 177.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 88.0 mt -61.6 -42.87 99.48 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 118.277 -0.868 . . . . 0.0 111.968 179.222 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 55.7 mt -56.79 -52.7 51.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 CA-C-N 119.147 0.885 . . . . 0.0 110.156 172.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -64.44 -45.97 85.15 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 -176.361 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 46.2 m-20 -67.2 -49.11 65.82 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.337 1.055 . . . . 0.0 111.811 -178.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -65.33 -43.22 91.63 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 118.927 -0.558 . . . . 0.0 110.972 179.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.413 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 58.2 t90 -57.48 -47.66 81.28 Favored 'General case' 0 C--O 1.217 -0.612 0 CA-C-O 117.217 -1.373 . . . . 0.0 111.315 170.693 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -61.13 -40.79 95.12 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 121.124 1.784 . . . . 0.0 113.519 -178.822 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -65.92 -51.58 57.37 Favored 'General case' 0 N--CA 1.478 0.965 0 CA-C-N 120.212 1.369 . . . . 0.0 111.896 175.253 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -55.28 -48.25 74.33 Favored 'General case' 0 C--O 1.215 -0.715 0 C-N-CA 122.921 0.488 . . . . 0.0 110.491 176.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.24 -33.19 75.19 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 126.772 2.029 . . . . 0.0 113.648 179.125 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 44.6 mttp -61.37 -31.46 71.35 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 120.163 1.347 . . . . 0.0 111.579 166.401 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 5.6 t -81.76 -24.86 35.78 Favored 'General case' 0 N--CA 1.484 1.262 0 N-CA-C 115.04 1.496 . . . . 0.0 115.04 165.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -137.8 72.69 48.23 Favored Pre-proline 0 CA--C 1.552 1.031 0 C-N-CA 127.708 2.403 . . . . 0.0 111.754 -165.42 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -61.52 -9.05 12.21 Favored 'Trans proline' 0 CA--C 1.547 1.13 0 C-N-CA 123.667 2.911 . . . . 0.0 116.296 -166.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 41.3 p90 -82.89 -15.15 52.58 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 126.267 1.827 . . . . 0.0 114.812 174.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 20.6 tp -60.54 134.82 57.45 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 114.514 1.301 . . . . 0.0 114.514 -162.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 6.7 mmp_? -74.92 155.0 37.91 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.753 1.221 . . . . 0.0 112.619 177.222 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.413 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -136.16 126.84 27.19 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 126.374 1.87 . . . . 0.0 109.989 -177.244 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 55.1 t0 -147.47 122.99 10.42 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.726 0.81 . . . . 0.0 110.738 171.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 3.4 ptt? -137.79 31.83 2.49 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.955 1.702 . . . . 0.0 111.707 173.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 27.1 t -62.12 152.62 32.41 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 121.582 -0.699 . . . . 0.0 110.143 161.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -53.82 -37.32 63.45 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 121.027 -1.046 . . . . 0.0 113.525 -169.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -61.32 -33.4 73.53 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.007 0.923 . . . . 0.0 112.729 176.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.4 -39.01 93.03 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 123.505 0.722 . . . . 0.0 111.777 173.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.98 -45.36 64.2 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 123.482 0.713 . . . . 0.0 109.301 179.246 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 10.8 m-30 -55.09 -46.46 75.49 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.032 0.533 . . . . 0.0 112.17 175.025 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.55 -31.02 41.96 Favored 'General case' 0 C--N 1.343 0.306 0 C-N-CA 124.712 1.205 . . . . 0.0 113.771 -172.683 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 86.0 mtt180 -82.78 -32.54 27.71 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.818 0.847 . . . . 0.0 112.854 173.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -126.86 73.93 75.95 Favored Pre-proline 0 CA--C 1.543 0.702 0 C-N-CA 125.723 1.609 . . . . 0.0 110.874 -173.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -66.71 -12.7 36.99 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 123.2 2.6 . . . . 0.0 113.874 -176.413 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 15.0 p-80 -73.65 -23.87 59.91 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.041 0.936 . . . . 0.0 113.258 170.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -85.79 -34.06 21.22 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.814 1.646 . . . . 0.0 112.102 -168.395 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 2.9 tmm_? . . . . . 0 C--O 1.256 1.397 0 C-N-CA 125.71 1.604 . . . . 0.0 111.117 176.681 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.3 t . . . . . 0 N--CA 1.474 0.756 0 CA-C-O 120.242 0.068 . . . . 0.0 110.881 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.6 p -151.85 141.16 15.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 124.651 1.18 . . . . 0.0 111.877 176.611 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 68.5 m -141.99 140.5 32.7 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.779 1.632 . . . . 0.0 110.82 175.777 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 55.4 p90 -153.47 163.52 39.8 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.67 1.188 . . . . 0.0 112.758 -179.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 85.5 134.3 3.27 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 125.502 1.525 . . . . 0.0 114.156 178.041 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -150.85 65.98 7.16 Favored Pre-proline 0 CA--C 1.554 1.1 0 C-N-CA 125.443 1.497 . . . . 0.0 111.208 178.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -68.23 143.97 60.87 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 123.508 2.805 . . . . 0.0 113.062 -174.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 59.3 p -148.98 47.68 0.52 Allowed Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 125.088 1.355 . . . . 0.0 113.83 178.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -64.24 139.92 68.41 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 123.118 2.545 . . . . 0.0 112.838 -176.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.8 tt -152.15 118.85 5.72 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.171 1.388 . . . . 0.0 110.01 179.432 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 23.2 t -152.02 146.4 25.54 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.477 1.111 . . . . 0.0 111.776 170.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 79.2 p -145.16 12.64 1.4 Allowed 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.476 1.51 . . . . 0.0 113.797 -178.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -111.86 157.77 20.23 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.028 1.331 . . . . 0.0 113.355 -170.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 8.6 t -146.75 165.82 28.49 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.576 1.55 . . . . 0.0 111.436 176.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 61.15 -8.01 0.08 Allowed 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 127.732 2.413 . . . . 0.0 116.998 -179.64 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -68.07 -13.88 62.54 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.066 1.346 . . . . 0.0 114.249 -177.689 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 . . . . . 0 CA--C 1.549 0.941 0 C-N-CA 125.811 1.644 . . . . 0.0 113.107 173.971 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.578 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -87.43 158.55 18.96 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.156 1.382 . . . . 0.0 111.227 167.204 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 96.6 mt -133.7 156.81 47.27 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.927 1.291 . . . . 0.0 112.379 -175.27 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 -79.41 137.48 37.28 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.438 0.695 . . . . 0.0 110.125 163.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -95.66 -15.11 22.93 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 -174.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -150.04 169.3 21.55 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.888 1.275 . . . . 0.0 112.944 -173.01 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.16 -164.5 54.91 Favored Glycine 0 CA--C 1.54 1.641 0 C-N-CA 124.107 0.861 . . . . 0.0 114.054 179.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -67.71 -17.42 47.66 Favored 'Trans proline' 0 CA--C 1.541 0.83 0 C-N-CA 123.312 2.675 . . . . 0.0 113.827 -176.091 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 98.0 mt -94.31 6.85 47.4 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.553 1.141 . . . . 0.0 113.878 175.225 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -54.67 122.06 9.83 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 120.829 1.649 . . . . 0.0 112.037 -178.262 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 82.3 8.32 86.49 Favored Glycine 0 CA--C 1.541 1.702 0 C-N-CA 125.138 1.351 . . . . 0.0 115.453 -175.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 25.4 mt -106.44 160.62 25.61 Favored Pre-proline 0 CA--C 1.558 1.256 0 C-N-CA 126.557 1.943 . . . . 0.0 111.189 178.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -69.55 163.77 36.84 Favored 'Trans proline' 0 C--N 1.354 0.866 0 C-N-CA 124.386 3.391 . . . . 0.0 113.591 -169.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 11.3 t -105.83 -30.24 2.68 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 O-C-N 121.454 -0.779 . . . . 0.0 112.177 174.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 23.2 p -126.65 171.54 11.05 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 125.184 1.394 . . . . 0.0 114.099 -178.212 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 39.0 ttm180 -61.64 -37.98 86.0 Favored 'General case' 0 N--CA 1.48 1.054 0 O-C-N 121.487 -0.758 . . . . 0.0 110.947 171.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 10.1 t -59.47 -48.74 80.49 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 123.613 0.765 . . . . 0.0 110.331 172.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -60.44 -47.35 86.48 Favored 'General case' 0 CA--C 1.537 0.47 0 O-C-N 122.137 -0.352 . . . . 0.0 111.1 177.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.89 -44.32 97.03 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 118.733 0.697 . . . . 0.0 112.778 -179.592 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 57.8 ttm-85 -62.41 -46.98 86.1 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 119.112 0.869 . . . . 0.0 111.513 176.43 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 54.0 t -63.42 -46.23 95.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.055 0.942 . . . . 0.0 111.489 178.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 52.0 mt -60.66 -45.69 93.16 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 118.194 -0.908 . . . . 0.0 112.003 176.566 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 61.4 mt -54.58 -51.54 49.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 CA-C-N 119.263 0.938 . . . . 0.0 109.975 173.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -62.91 -47.04 84.97 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -178.268 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 57.6 m-20 -69.7 -46.27 66.39 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.947 0.899 . . . . 0.0 112.051 -176.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -63.25 -44.62 94.66 Favored 'General case' 0 N--CA 1.465 0.303 0 O-C-N 121.993 -0.442 . . . . 0.0 111.551 176.343 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.423 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 66.7 t90 -61.11 -47.73 84.9 Favored 'General case' 0 C--O 1.219 -0.517 0 CA-C-O 117.622 -1.18 . . . . 0.0 111.226 172.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -54.48 -44.5 72.66 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 120.907 1.685 . . . . 0.0 112.883 178.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -67.44 -53.87 25.27 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 119.492 1.042 . . . . 0.0 112.632 176.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 77.2 mtm-85 -64.47 -35.0 79.52 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 121.275 -0.89 . . . . 0.0 111.885 -177.546 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.8 tmtt? -74.09 -30.13 62.2 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.359 1.464 . . . . 0.0 113.594 174.543 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -61.75 -35.27 77.63 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 120.051 1.296 . . . . 0.0 110.929 165.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 8.2 t -74.46 -34.27 63.1 Favored 'General case' 0 CA--C 1.553 1.086 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 167.425 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -133.78 80.65 55.0 Favored Pre-proline 0 CA--C 1.549 0.905 0 C-N-CA 127.029 2.132 . . . . 0.0 111.749 -168.212 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -61.8 -6.31 7.34 Favored 'Trans proline' 0 CA--C 1.546 1.091 0 C-N-CA 123.604 2.869 . . . . 0.0 116.345 -168.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 44.1 p90 -88.9 -3.93 58.6 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.694 1.998 . . . . 0.0 114.828 174.534 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.6 tp -66.57 133.38 50.2 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 120.09 1.313 . . . . 0.0 113.255 -173.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 50.9 ttp180 -85.11 152.27 23.52 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.233 1.413 . . . . 0.0 112.723 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.423 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -132.28 130.92 41.49 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.985 2.114 . . . . 0.0 109.826 -174.504 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -143.87 136.04 26.65 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.151 0.98 . . . . 0.0 110.754 176.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 66.4 mtt -132.63 15.71 4.4 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.769 1.228 . . . . 0.0 113.567 -177.193 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 74.7 m -69.37 154.18 42.43 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.457 -0.777 . . . . 0.0 110.925 172.533 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -56.94 -34.54 68.12 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 121.018 -1.051 . . . . 0.0 113.709 -168.572 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -61.64 -32.77 72.94 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 176.235 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.8 -39.72 92.74 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 119.182 0.901 . . . . 0.0 111.665 174.287 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -74.11 -46.57 44.83 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 C-N-CA 124.536 1.134 . . . . 0.0 109.478 179.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 13.8 m-30 -54.94 -45.21 74.83 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 119.064 0.847 . . . . 0.0 112.416 175.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -76.6 -38.3 55.02 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.909 1.284 . . . . 0.0 112.227 -173.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 72.6 mtt85 -70.14 -39.14 75.56 Favored 'General case' 0 N--CA 1.483 1.213 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 171.342 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 29.7 m-85 -130.59 82.81 63.91 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 125.435 1.494 . . . . 0.0 110.988 -165.61 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -69.05 -5.74 16.51 Favored 'Trans proline' 0 CA--C 1.54 0.788 0 C-N-CA 123.728 2.952 . . . . 0.0 114.726 -172.262 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 7.6 p-80 -86.92 -20.51 27.27 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.144 1.378 . . . . 0.0 113.801 170.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -92.39 -14.1 29.14 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 125.881 1.673 . . . . 0.0 113.679 -171.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 14.0 ptt180 . . . . . 0 C--O 1.253 1.261 0 C-N-CA 125.251 1.42 . . . . 0.0 113.515 173.297 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 66.1 m . . . . . 0 N--CA 1.475 0.812 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 23.9 m -138.29 152.95 26.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 125.636 1.574 . . . . 0.0 111.66 176.027 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 21.3 t -151.4 146.82 26.24 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.075 1.35 . . . . 0.0 110.916 175.083 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -138.96 148.57 43.69 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.888 1.275 . . . . 0.0 112.328 -172.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 81.89 129.93 1.2 Allowed Glycine 0 CA--C 1.538 1.492 0 C-N-CA 125.201 1.381 . . . . 0.0 113.26 -175.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -150.39 73.12 9.14 Favored Pre-proline 0 CA--C 1.553 1.06 0 C-N-CA 124.905 1.282 . . . . 0.0 111.336 -178.007 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -66.54 146.65 80.33 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 123.298 2.665 . . . . 0.0 112.481 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 33.3 p -146.17 60.54 6.39 Favored Pre-proline 0 N--CA 1.477 0.903 0 C-N-CA 124.782 1.233 . . . . 0.0 113.051 -174.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -62.16 142.85 93.41 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 123.17 2.58 . . . . 0.0 112.138 177.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -136.3 12.77 3.28 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 115.448 1.647 . . . . 0.0 115.448 -168.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 37.1 t -146.17 145.25 30.4 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.678 1.191 . . . . 0.0 112.157 178.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.4 t -141.12 19.07 2.27 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.914 1.685 . . . . 0.0 111.601 171.241 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.4 mp0 -105.56 153.21 22.08 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.798 1.639 . . . . 0.0 112.629 -168.218 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 6.7 t -137.07 53.39 1.89 Allowed 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.718 1.607 . . . . 0.0 110.663 179.135 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 58.67 14.18 3.0 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 126.246 1.819 . . . . 0.0 114.882 -174.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -81.01 -14.27 58.07 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.994 1.718 . . . . 0.0 114.959 -173.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 . . . . . 0 CA--C 1.55 0.952 0 C-N-CA 125.58 1.552 . . . . 0.0 113.03 176.985 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.615 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -91.33 155.78 18.26 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.152 1.381 . . . . 0.0 111.466 166.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 88.0 mt -132.5 158.03 43.14 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 125.05 1.34 . . . . 0.0 112.31 -174.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 -85.3 142.28 29.46 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.901 0.88 . . . . 0.0 110.042 163.001 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -102.48 -11.47 18.54 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 -171.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -149.19 167.12 26.83 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.658 1.183 . . . . 0.0 113.166 -172.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.02 -161.01 53.21 Favored Glycine 0 CA--C 1.541 1.709 0 C-N-CA 124.062 0.839 . . . . 0.0 113.854 179.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -67.63 -16.41 46.69 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 123.163 2.575 . . . . 0.0 113.563 -177.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 97.7 mt -93.3 5.22 52.27 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.657 1.183 . . . . 0.0 113.95 176.015 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.61 120.84 8.44 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-N 121.114 1.779 . . . . 0.0 112.025 -178.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 82.55 7.23 87.76 Favored Glycine 0 CA--C 1.54 1.652 0 C-N-CA 125.402 1.477 . . . . 0.0 115.45 -174.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 16.3 mt -104.68 159.86 27.92 Favored Pre-proline 0 CA--C 1.558 1.287 0 C-N-CA 126.371 1.868 . . . . 0.0 111.445 -178.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -71.9 163.92 37.3 Favored 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 124.63 3.554 . . . . 0.0 114.163 -168.029 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 10.5 t -108.88 -26.55 3.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 123.902 0.881 . . . . 0.0 112.52 176.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 22.3 p -127.05 172.0 10.87 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 125.508 1.523 . . . . 0.0 113.924 178.292 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -64.83 -36.8 85.51 Favored 'General case' 0 N--CA 1.484 1.264 0 O-C-N 121.183 -0.948 . . . . 0.0 111.251 173.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 32.5 m -61.59 -46.82 88.24 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.948 0.899 . . . . 0.0 111.017 171.095 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -59.36 -46.55 88.33 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 118.776 0.716 . . . . 0.0 111.014 175.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.47 -41.55 98.85 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.692 0.797 . . . . 0.0 112.698 -178.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 60.6 mtp85 -67.81 -39.15 84.01 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.517 0.727 . . . . 0.0 112.396 175.401 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 73.4 t -64.15 -46.56 93.24 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.112 0 CA-C-N 118.847 0.748 . . . . 0.0 111.312 174.255 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.7 mp -60.29 -45.3 93.83 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 118.417 -0.802 . . . . 0.0 112.506 175.439 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 51.1 mt -54.4 -49.86 61.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 CA-C-N 118.969 0.804 . . . . 0.0 110.187 172.303 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 13.8 t80 -63.39 -51.25 66.62 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -177.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -67.11 -43.88 81.33 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 119.103 0.865 . . . . 0.0 112.455 -177.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -56.44 -52.69 63.72 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.237 0.615 . . . . 0.0 110.127 174.551 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 62.9 t90 -59.01 -47.76 84.03 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-O 117.09 -1.433 . . . . 0.0 111.631 176.59 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -56.62 -47.58 79.34 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 121.262 1.846 . . . . 0.0 113.249 -179.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -68.26 -47.7 67.03 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 119.516 1.053 . . . . 0.0 111.938 179.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 15.8 mmp_? -61.47 -44.57 96.86 Favored 'General case' 0 C--O 1.216 -0.702 0 O-C-N 121.642 -0.661 . . . . 0.0 110.596 178.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -61.75 -35.64 78.69 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 126.102 1.761 . . . . 0.0 113.147 174.335 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 63.0 tttm -62.34 -34.64 77.04 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 119.225 0.92 . . . . 0.0 111.263 170.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 7.9 t -77.72 -29.69 51.35 Favored 'General case' 0 CA--C 1.555 1.168 0 N-CA-C 114.762 1.393 . . . . 0.0 114.762 166.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -133.39 81.21 55.87 Favored Pre-proline 0 N--CA 1.476 0.86 0 C-N-CA 127.511 2.324 . . . . 0.0 111.94 -165.643 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -63.94 7.37 0.21 Allowed 'Trans proline' 0 CA--C 1.551 1.337 0 C-N-CA 124.456 3.437 . . . . 0.0 117.009 -169.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 39.5 p90 -105.24 -6.01 20.12 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 127.199 2.2 . . . . 0.0 114.785 176.33 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 12.9 tp -66.61 139.46 57.89 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.65 1.352 . . . . 0.0 114.65 -168.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 18.2 mmt85 -97.98 158.17 15.69 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 125.342 1.457 . . . . 0.0 112.908 -178.154 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -139.16 129.81 25.98 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 126.333 1.853 . . . . 0.0 110.297 -167.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -147.3 134.33 20.35 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.208 1.003 . . . . 0.0 111.19 177.475 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 64.4 mtt -131.14 3.65 4.36 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -172.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 70.4 m -63.84 153.25 37.28 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.541 0.736 . . . . 0.0 110.904 172.068 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -55.34 -33.25 63.19 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 -166.554 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 57.6 mtmt -59.4 -35.46 74.01 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.851 0.86 . . . . 0.0 113.285 174.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.52 -39.59 94.05 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.209 0.913 . . . . 0.0 111.723 173.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.77 -46.48 61.18 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 C-N-CA 124.212 1.005 . . . . 0.0 109.276 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 13.2 m-30 -56.66 -45.55 81.58 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 118.737 0.699 . . . . 0.0 112.511 174.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.4 tmt_? -75.74 -37.18 59.57 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.482 1.113 . . . . 0.0 112.255 -172.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 37.3 mtp85 -70.99 -38.83 72.7 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 118.587 0.63 . . . . 0.0 112.665 169.397 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -131.27 83.57 59.36 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 125.23 1.412 . . . . 0.0 111.263 -167.638 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -66.88 -18.52 52.59 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 122.846 2.364 . . . . 0.0 113.977 -172.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 8.8 p-80 -72.29 -24.56 61.35 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.901 0.88 . . . . 0.0 113.187 173.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.14 -14.01 48.37 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 126.004 1.722 . . . . 0.0 113.296 -175.837 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.326 0 C-N-CA 124.821 1.249 . . . . 0.0 112.723 178.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 85.0 p . . . . . 0 N--CA 1.478 0.975 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 12.7 p -156.71 -42.61 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.197 0 C-N-CA 124.54 1.136 . . . . 0.0 112.492 171.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 39.3 m 61.85 149.28 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 127.423 2.289 . . . . 0.0 115.377 -174.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -141.82 -15.66 0.8 Allowed 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 115.046 1.498 . . . . 0.0 115.046 -175.676 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -66.84 132.53 31.57 Favored Glycine 0 CA--C 1.536 1.377 0 O-C-N 121.108 -0.995 . . . . 0.0 113.5 -177.363 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -147.85 68.61 10.74 Favored Pre-proline 0 CA--C 1.553 1.074 0 C-N-CA 125.098 1.359 . . . . 0.0 111.479 -179.255 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -69.64 153.1 69.89 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 123.47 2.78 . . . . 0.0 112.775 -179.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 70.4 m -135.32 67.31 67.58 Favored Pre-proline 0 N--CA 1.475 0.812 0 C-N-CA 125.054 1.342 . . . . 0.0 111.926 -177.193 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -65.66 141.74 67.66 Favored 'Trans proline' 0 CA--C 1.542 0.904 0 C-N-CA 123.2 2.6 . . . . 0.0 111.939 177.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 27.0 tp -135.25 -10.69 2.21 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 114.336 1.235 . . . . 0.0 114.336 -171.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 32.1 p -79.15 141.54 37.16 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.362 1.065 . . . . 0.0 113.082 -178.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 47.4 m -139.27 19.42 2.58 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.841 1.256 . . . . 0.0 113.697 -174.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 54.76 30.94 14.48 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 125.241 1.417 . . . . 0.0 113.527 -173.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 29.9 p -87.95 154.77 20.25 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.123 1.769 . . . . 0.0 112.932 -179.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 59.41 15.44 4.42 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 115.734 1.753 . . . . 0.0 115.734 179.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -77.29 96.47 4.6 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 121.15 -0.969 . . . . 0.0 110.127 169.06 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 . . . . . 0 N--CA 1.477 0.899 0 C-N-CA 126.546 1.938 . . . . 0.0 115.91 177.434 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.588 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -87.01 146.33 26.16 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.725 1.21 . . . . 0.0 110.922 166.11 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.9 mt -128.13 157.54 40.48 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.449 1.1 . . . . 0.0 112.707 -169.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -77.82 138.11 38.78 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.901 0.88 . . . . 0.0 110.428 166.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -95.25 -15.13 23.44 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 114.478 1.288 . . . . 0.0 114.478 -175.21 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -150.19 169.72 20.65 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.876 1.27 . . . . 0.0 113.088 -172.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.2 -164.75 54.91 Favored Glycine 0 CA--C 1.54 1.605 0 C-N-CA 124.184 0.897 . . . . 0.0 114.138 179.385 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -67.69 -17.13 47.69 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 123.325 2.683 . . . . 0.0 113.788 -176.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.8 mt -94.58 6.61 48.34 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.785 1.234 . . . . 0.0 113.815 175.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -54.57 123.33 12.81 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 120.952 1.705 . . . . 0.0 112.256 -177.228 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 82.41 3.13 90.65 Favored Glycine 0 CA--C 1.541 1.678 0 C-N-CA 125.501 1.524 . . . . 0.0 115.378 -174.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 20.9 mt -102.01 163.54 17.56 Favored Pre-proline 0 CA--C 1.555 1.156 0 C-N-CA 126.265 1.826 . . . . 0.0 110.888 179.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -76.33 157.33 37.21 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 124.186 3.257 . . . . 0.0 113.383 -164.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 35.3 t -92.99 -35.88 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 O-C-N 121.533 -0.729 . . . . 0.0 112.502 174.511 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 19.6 p -123.29 172.67 8.47 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 114.716 1.376 . . . . 0.0 114.716 -177.501 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 15.0 ptp180 -61.73 -36.66 81.61 Favored 'General case' 0 N--CA 1.482 1.162 0 O-C-N 121.448 -0.783 . . . . 0.0 111.934 173.148 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 25.3 m -66.07 -44.31 84.88 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.895 0.878 . . . . 0.0 110.705 173.16 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -61.23 -42.21 98.22 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 121.714 -0.616 . . . . 0.0 111.401 175.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.09 -44.48 92.23 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.105 0.962 . . . . 0.0 112.831 177.639 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 81.1 mtp180 -66.12 -40.7 90.9 Favored 'General case' 0 N--CA 1.478 0.974 0 O-C-N 121.415 -0.803 . . . . 0.0 112.262 176.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 78.4 t -63.79 -45.85 96.06 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 123.356 0.663 . . . . 0.0 111.071 174.159 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 15.8 mt -57.26 -48.88 77.75 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 118.466 -0.778 . . . . 0.0 112.035 174.11 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 52.8 mt -54.48 -49.42 65.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 CA-C-N 118.736 0.698 . . . . 0.0 110.294 176.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 13.6 t80 -64.79 -51.62 61.23 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -179.32 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.9 t30 -66.36 -43.8 84.96 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 118.639 0.654 . . . . 0.0 112.544 -176.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -60.62 -51.27 70.11 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 118.845 -0.598 . . . . 0.0 110.025 174.044 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 62.5 t90 -56.26 -46.26 79.71 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-O 118.001 -0.999 . . . . 0.0 112.5 176.216 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -56.38 -51.31 68.78 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 120.053 1.297 . . . . 0.0 112.491 177.288 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -70.09 -45.58 66.66 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 119.75 1.159 . . . . 0.0 112.488 -178.112 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 58.1 mmt-85 -55.91 -44.01 77.88 Favored 'General case' 0 N--CA 1.475 0.789 0 O-C-N 121.839 -0.538 . . . . 0.0 109.642 174.327 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 78.8 tttt -69.24 -33.24 72.97 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 178.388 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -59.32 -32.5 70.12 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 119.941 1.246 . . . . 0.0 111.137 167.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 67.1 m -81.6 -24.26 36.57 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 115.374 1.62 . . . . 0.0 115.374 166.334 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -145.77 78.93 11.46 Favored Pre-proline 0 CA--C 1.552 1.029 0 C-N-CA 126.758 2.023 . . . . 0.0 111.974 -164.787 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_endo -60.87 -7.51 7.81 Favored 'Trans proline' 0 CA--C 1.548 1.209 0 C-N-CA 123.605 2.87 . . . . 0.0 116.682 -167.56 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 42.2 p90 -86.46 -2.8 58.76 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 126.996 2.118 . . . . 0.0 115.25 176.036 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.35 133.28 52.74 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 124.714 1.206 . . . . 0.0 114.153 -173.975 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -88.77 152.18 21.94 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 125.278 1.431 . . . . 0.0 113.0 176.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -133.36 129.22 37.15 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.63 1.572 . . . . 0.0 110.494 -174.06 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -145.99 134.98 22.61 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.319 1.048 . . . . 0.0 110.843 174.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 66.8 mtt -129.81 12.48 5.77 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.739 1.216 . . . . 0.0 113.818 -176.284 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 75.3 m -66.99 153.62 43.19 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 121.345 -0.847 . . . . 0.0 111.11 174.247 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -55.17 -36.08 65.47 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -169.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 59.2 mtmt -61.41 -33.19 73.27 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.052 0.941 . . . . 0.0 113.323 176.068 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.01 -40.43 97.73 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 119.194 0.906 . . . . 0.0 111.632 173.206 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.86 -46.14 61.93 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 C-N-CA 123.833 0.853 . . . . 0.0 109.541 -179.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 16.5 m-30 -55.58 -47.01 77.14 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.364 0.666 . . . . 0.0 112.641 174.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.4 tmt_? -77.51 -36.77 52.24 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 124.292 1.037 . . . . 0.0 112.254 -172.254 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 51.1 ttt85 -75.73 -34.56 60.35 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.831 0.852 . . . . 0.0 112.629 174.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 35.6 m-85 -130.74 88.64 45.75 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 125.588 1.555 . . . . 0.0 110.871 -175.316 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -67.51 -19.77 48.35 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 123.057 2.504 . . . . 0.0 114.6 -168.201 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 7.9 p-80 -73.78 -22.48 59.82 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.783 0.833 . . . . 0.0 113.07 173.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.5 4.96 37.61 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 126.571 1.948 . . . . 0.0 113.636 -177.773 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.256 1.402 0 C-N-CA 125.412 1.485 . . . . 0.0 111.433 172.255 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 79.6 p . . . . . 0 N--CA 1.475 0.785 0 CA-C-O 120.835 0.35 . . . . 0.0 111.617 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.3 p -151.54 140.94 15.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 124.492 1.117 . . . . 0.0 111.595 175.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.6 p -156.02 153.66 29.83 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.448 1.499 . . . . 0.0 111.797 174.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -153.69 156.09 37.19 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.028 1.331 . . . . 0.0 112.295 177.041 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 78.46 148.52 3.93 Favored Glycine 0 CA--C 1.54 1.614 0 C-N-CA 125.1 1.333 . . . . 0.0 114.228 -178.219 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -150.36 64.45 6.67 Favored Pre-proline 0 CA--C 1.555 1.142 0 C-N-CA 124.996 1.318 . . . . 0.0 111.941 179.133 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -68.68 131.09 21.99 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 123.19 2.594 . . . . 0.0 112.082 -179.29 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 73.2 m -140.58 68.97 31.55 Favored Pre-proline 0 N--CA 1.477 0.898 0 C-N-CA 125.162 1.385 . . . . 0.0 111.101 -178.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_endo -67.69 154.73 72.51 Favored 'Trans proline' 0 CA--C 1.543 0.96 0 C-N-CA 123.362 2.708 . . . . 0.0 112.492 179.581 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.1 mp -77.38 -21.38 53.31 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.893 0.877 . . . . 0.0 113.23 -176.499 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 14.0 t -151.97 159.6 43.72 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.636 1.575 . . . . 0.0 111.493 175.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.6 t -150.14 -42.51 0.13 Allowed 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.364 1.066 . . . . 0.0 112.458 178.566 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.6 mp0 -70.84 119.38 14.89 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.521 1.128 . . . . 0.0 112.274 -177.013 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 3.4 t -149.41 36.32 0.73 Allowed 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.627 1.171 . . . . 0.0 112.234 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -136.76 4.59 2.81 Favored 'General case' 0 N--CA 1.478 0.925 0 N-CA-C 114.989 1.477 . . . . 0.0 114.989 -169.491 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -72.86 -24.67 60.9 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 -173.103 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 . . . . . 0 CA--C 1.549 0.912 0 C-N-CA 125.935 1.694 . . . . 0.0 113.786 179.035 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.587 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -87.2 143.44 27.29 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.426 1.091 . . . . 0.0 110.938 169.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 59.9 mt -127.9 157.51 40.33 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.517 1.127 . . . . 0.0 112.482 -170.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 93.5 m-70 -79.1 139.15 38.15 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.939 0.896 . . . . 0.0 110.242 167.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -94.19 -23.68 17.81 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -174.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -141.14 166.44 24.76 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.192 1.397 . . . . 0.0 112.61 -170.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 74.18 -163.86 54.6 Favored Glycine 0 CA--C 1.539 1.574 0 C-N-CA 124.277 0.942 . . . . 0.0 114.166 178.056 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -67.41 -17.21 49.1 Favored 'Trans proline' 0 CA--C 1.541 0.86 0 C-N-CA 123.281 2.654 . . . . 0.0 113.778 -175.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.9 mt -93.49 5.11 52.7 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.656 1.182 . . . . 0.0 113.81 175.377 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.26 123.61 14.33 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 120.954 1.707 . . . . 0.0 112.318 -176.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 81.98 2.9 90.69 Favored Glycine 0 CA--C 1.541 1.681 0 C-N-CA 125.71 1.624 . . . . 0.0 115.339 -174.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 17.0 mt -101.63 162.49 20.27 Favored Pre-proline 0 CA--C 1.557 1.224 0 C-N-CA 126.07 1.748 . . . . 0.0 110.951 -179.107 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -77.69 155.29 31.14 Favored 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 124.113 3.209 . . . . 0.0 113.751 -164.107 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 45.1 t -91.53 -36.44 7.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 CA-C-O 118.514 -0.755 . . . . 0.0 112.574 175.271 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 16.9 p -124.68 172.77 9.01 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 115.038 1.496 . . . . 0.0 115.038 -177.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 56.5 ttt180 -59.26 -41.36 88.63 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 125.253 1.421 . . . . 0.0 111.192 174.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.3 t -62.71 -47.32 84.09 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 123.612 0.765 . . . . 0.0 110.832 171.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 69.0 m-20 -60.08 -42.21 94.12 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.418 -0.801 . . . . 0.0 111.862 178.341 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.04 -43.52 92.06 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.63 0.772 . . . . 0.0 112.696 177.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 92.5 mtt180 -66.63 -38.33 86.69 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 121.163 -0.961 . . . . 0.0 113.005 175.55 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 77.6 t -66.31 -43.49 91.48 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 CA-C-N 118.835 0.743 . . . . 0.0 111.321 174.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 16.5 mt -56.82 -48.39 78.1 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 118.595 0.634 . . . . 0.0 112.173 172.542 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 59.9 mt -54.83 -51.26 54.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 122.943 0.497 . . . . 0.0 110.082 175.364 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 15.0 t80 -65.09 -48.0 75.25 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -177.001 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 20.1 t30 -69.64 -45.04 69.36 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.502 0.721 . . . . 0.0 112.246 -176.43 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 48.0 tt0 -66.04 -44.96 83.13 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 118.113 -0.946 . . . . 0.0 110.849 175.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.409 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 66.1 t90 -58.35 -46.0 87.11 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 119.987 1.267 . . . . 0.0 111.588 173.4 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -55.3 -46.15 76.23 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 120.71 1.595 . . . . 0.0 112.768 177.415 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -68.54 -52.24 34.18 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 119.533 1.061 . . . . 0.0 112.766 177.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 38.6 mmt180 -57.01 -45.34 83.12 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.447 0.699 . . . . 0.0 110.281 179.243 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.8 tmtt? -70.8 -29.49 65.68 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.785 1.634 . . . . 0.0 113.477 178.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 65.4 tttm -60.71 -35.34 76.07 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 120.237 1.381 . . . . 0.0 110.933 165.714 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 61.1 m -80.04 -23.47 41.39 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 115.226 1.565 . . . . 0.0 115.226 167.265 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -140.0 75.39 29.71 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 126.883 2.073 . . . . 0.0 111.8 -167.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -61.35 -6.23 6.49 Favored 'Trans proline' 0 CA--C 1.547 1.147 0 C-N-CA 123.947 3.098 . . . . 0.0 116.59 -167.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 41.3 p90 -87.44 -8.3 56.66 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 126.648 1.979 . . . . 0.0 114.938 174.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 16.2 tp -65.24 136.55 56.75 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 119.857 1.208 . . . . 0.0 114.048 -168.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 82.3 mtt85 -83.44 155.97 23.15 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.894 1.277 . . . . 0.0 113.084 179.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.409 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.4 tm? -138.8 128.29 24.54 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 126.606 1.962 . . . . 0.0 109.841 -174.672 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -146.5 137.48 24.23 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.111 0.964 . . . . 0.0 110.849 174.407 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 65.6 mtt -126.03 12.34 7.76 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.776 1.23 . . . . 0.0 113.713 -175.284 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 32.9 t -61.24 143.87 54.82 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.488 -0.758 . . . . 0.0 110.405 172.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 32.7 m-20 -60.51 -24.95 65.74 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 121.011 -1.056 . . . . 0.0 113.517 -172.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -56.25 -38.45 71.13 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.038 0.935 . . . . 0.0 112.609 169.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.42 -38.65 91.78 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.745 0.818 . . . . 0.0 112.035 173.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -70.38 -46.28 71.66 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 123.806 0.842 . . . . 0.0 109.396 -179.277 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 10.2 m-30 -58.83 -45.91 88.89 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 118.545 0.612 . . . . 0.0 112.284 174.448 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.09 -29.24 60.57 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 124.276 1.031 . . . . 0.0 113.267 -173.654 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -78.85 -38.91 36.76 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.085 0.954 . . . . 0.0 112.374 169.385 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -130.9 83.06 62.34 Favored Pre-proline 0 CA--C 1.546 0.814 0 C-N-CA 125.635 1.574 . . . . 0.0 110.84 -168.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.69 -15.46 44.53 Favored 'Trans proline' 0 CA--C 1.539 0.767 0 C-N-CA 123.067 2.511 . . . . 0.0 114.212 -170.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 12.5 p-80 -74.2 -22.71 59.26 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.083 0.953 . . . . 0.0 113.219 173.418 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -81.02 -25.63 37.03 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.389 1.475 . . . . 0.0 112.622 -171.435 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 69.9 ttp85 . . . . . 0 C--O 1.254 1.319 0 C-N-CA 124.585 1.154 . . . . 0.0 112.506 177.711 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 70.9 p . . . . . 0 N--CA 1.474 0.771 0 CA-C-O 121.133 0.492 . . . . 0.0 111.479 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 9.5 p -158.69 155.59 4.36 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 C-N-CA 125.091 1.357 . . . . 0.0 111.296 -178.183 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.2 p -143.14 149.39 38.01 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.923 1.289 . . . . 0.0 112.491 173.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -144.23 169.21 18.31 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 126.023 1.729 . . . . 0.0 111.815 -177.61 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 89.01 82.97 1.29 Allowed Glycine 0 CA--C 1.532 1.141 0 C-N-CA 124.712 1.149 . . . . 0.0 113.441 174.15 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.16 63.19 28.83 Favored Pre-proline 0 CA--C 1.554 1.119 0 C-N-CA 125.329 1.452 . . . . 0.0 111.434 175.093 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -68.38 150.26 75.79 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 123.606 2.87 . . . . 0.0 113.136 -175.625 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 54.1 p -146.51 50.78 1.05 Allowed Pre-proline 0 CA--C 1.552 1.023 0 C-N-CA 125.037 1.335 . . . . 0.0 113.841 -179.459 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -63.49 140.81 77.79 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 123.151 2.568 . . . . 0.0 112.447 -179.54 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -139.8 6.18 2.21 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 115.547 1.684 . . . . 0.0 115.547 -174.523 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.2 t -76.48 130.18 37.59 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 121.366 -0.834 . . . . 0.0 111.79 -178.235 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.4 t -158.09 150.22 21.98 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.33 1.452 . . . . 0.0 111.354 178.195 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -149.81 151.36 33.42 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.108 1.363 . . . . 0.0 112.236 175.118 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 12.3 t -152.58 99.68 2.49 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.763 1.225 . . . . 0.0 109.804 176.235 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -149.81 30.48 0.73 Allowed 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.28 1.032 . . . . 0.0 113.623 -168.652 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -75.51 61.11 1.26 Allowed 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.931 1.693 . . . . 0.0 112.268 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 . . . . . 0 N--CA 1.475 0.797 0 C-N-CA 126.413 1.885 . . . . 0.0 112.425 -170.907 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.488 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -86.58 155.06 20.61 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.523 1.129 . . . . 0.0 110.837 164.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 91.3 mt -132.99 157.32 45.49 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.803 1.241 . . . . 0.0 112.105 -175.129 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -81.81 137.53 35.28 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 123.352 0.661 . . . . 0.0 109.615 162.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -96.48 -21.59 17.63 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 114.426 1.269 . . . . 0.0 114.426 -173.422 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -140.8 165.53 27.27 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.202 1.401 . . . . 0.0 112.373 -171.535 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.17 -162.72 54.79 Favored Glycine 0 CA--C 1.54 1.629 0 C-N-CA 124.162 0.887 . . . . 0.0 114.124 178.296 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -67.85 -17.36 46.92 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 123.251 2.634 . . . . 0.0 113.809 -175.168 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 97.8 mt -94.13 6.26 49.15 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.557 1.143 . . . . 0.0 113.901 175.273 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.45 122.01 10.28 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 120.798 1.636 . . . . 0.0 112.123 -178.04 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.15 6.28 88.23 Favored Glycine 0 CA--C 1.541 1.693 0 C-N-CA 125.447 1.499 . . . . 0.0 115.432 -175.18 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 18.2 mt -103.99 160.77 25.0 Favored Pre-proline 0 CA--C 1.559 1.293 0 C-N-CA 126.137 1.775 . . . . 0.0 111.33 -179.208 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -72.24 164.73 34.75 Favored 'Trans proline' 0 C--N 1.354 0.832 0 C-N-CA 124.307 3.338 . . . . 0.0 113.553 -168.497 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 10.6 t -110.12 -27.38 2.89 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 O-C-N 121.288 -0.883 . . . . 0.0 112.458 176.583 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 17.7 p -125.87 172.65 9.71 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 125.385 1.474 . . . . 0.0 114.203 179.726 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 10.1 mmt180 -60.19 -40.96 91.9 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 121.378 -0.826 . . . . 0.0 111.442 170.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 8.6 t -63.15 -44.28 95.98 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 122.617 0.367 . . . . 0.0 110.761 174.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -60.01 -45.14 93.74 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.717 -0.614 . . . . 0.0 111.417 175.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.72 -41.82 95.7 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.595 0.758 . . . . 0.0 112.67 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 34.0 mtp-105 -61.42 -45.8 92.8 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 118.803 0.729 . . . . 0.0 111.773 173.051 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 55.4 t -60.96 -49.78 83.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 124.046 0.938 . . . . 0.0 111.199 177.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.6 mp -60.13 -49.83 76.08 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 118.6 -0.714 . . . . 0.0 112.562 177.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 60.8 mt -54.47 -52.61 38.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-N 118.859 0.754 . . . . 0.0 110.199 175.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -65.44 -47.41 76.26 Favored 'General case' 0 C--O 1.224 -0.267 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -176.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -67.61 -45.95 73.99 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 119.47 1.032 . . . . 0.0 112.528 -178.071 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -64.86 -44.44 89.7 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 118.957 -0.544 . . . . 0.0 110.722 178.606 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.409 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 71.3 t90 -60.29 -46.0 91.4 Favored 'General case' 0 C--O 1.219 -0.545 0 CA-C-O 117.787 -1.102 . . . . 0.0 111.897 171.298 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -55.72 -49.2 73.67 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 121.042 1.747 . . . . 0.0 112.637 179.576 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -65.53 -53.71 38.42 Favored 'General case' 0 C--O 1.245 0.835 0 O-C-N 121.067 -1.02 . . . . 0.0 111.931 178.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 9.8 mmm180 -58.32 -47.12 84.72 Favored 'General case' 0 C--O 1.215 -0.739 0 C-N-CA 122.435 0.294 . . . . 0.0 111.039 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 13.7 tmtt? -67.37 -30.96 70.89 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.32 1.048 . . . . 0.0 113.192 178.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 8.9 mtpm? -66.64 -26.56 67.12 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 120.194 1.361 . . . . 0.0 112.531 168.565 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 79.8 p -91.06 -9.18 46.71 Favored 'General case' 0 N--CA 1.486 1.34 0 N-CA-C 116.185 1.92 . . . . 0.0 116.185 163.104 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -144.64 72.55 15.48 Favored Pre-proline 0 CA--C 1.552 1.02 0 C-N-CA 127.353 2.261 . . . . 0.0 111.4 -172.103 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -61.1 -7.78 8.72 Favored 'Trans proline' 0 CA--C 1.546 1.114 0 C-N-CA 123.835 3.024 . . . . 0.0 116.577 -166.277 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 41.0 p90 -84.31 -10.49 57.58 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 126.502 1.921 . . . . 0.0 115.037 174.506 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.4 tp -64.84 137.08 57.55 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.674 1.124 . . . . 0.0 113.747 -169.589 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 23.3 mmt85 -90.06 156.46 18.37 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.593 1.157 . . . . 0.0 112.78 -179.107 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.409 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.4 tm? -137.69 131.81 31.96 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 126.996 2.119 . . . . 0.0 109.266 -171.772 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 52.5 t0 -141.85 130.65 22.92 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.68 0.792 . . . . 0.0 111.041 175.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 65.0 mtt -122.8 9.23 9.45 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.836 1.654 . . . . 0.0 112.841 -179.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 28.9 t -64.52 153.73 38.14 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.026 0.93 . . . . 0.0 111.507 172.516 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -51.4 -38.28 52.64 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.238 1.015 . . . . 0.0 112.79 -179.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -58.78 -39.1 80.04 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.531 1.133 . . . . 0.0 112.914 176.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.24 -42.38 99.26 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 123.25 0.62 . . . . 0.0 111.551 175.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.02 -46.92 64.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.297 0 C-N-CA 123.651 0.781 . . . . 0.0 109.902 -179.036 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 18.8 m-30 -55.35 -46.48 76.4 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 118.869 0.759 . . . . 0.0 112.599 175.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 1.5 ttp85 -78.2 -35.18 48.87 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.906 0.882 . . . . 0.0 112.93 -172.053 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 61.7 ttm-85 -80.71 -37.24 30.98 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 124.433 1.093 . . . . 0.0 112.847 175.495 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -129.71 76.96 77.77 Favored Pre-proline 0 CA--C 1.547 0.846 0 C-N-CA 126.54 1.936 . . . . 0.0 110.893 -173.32 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -65.41 -17.67 58.26 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 123.109 2.54 . . . . 0.0 114.281 -172.598 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 7.6 p-80 -74.15 -23.98 59.34 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.078 0.951 . . . . 0.0 113.32 172.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -85.53 -4.79 59.26 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 126.278 1.831 . . . . 0.0 113.496 -178.795 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 57.5 ttp180 . . . . . 0 C--O 1.254 1.302 0 C-N-CA 125.405 1.482 . . . . 0.0 111.843 173.777 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 8.8 t . . . . . 0 N--CA 1.475 0.797 0 CA-C-O 120.666 0.269 . . . . 0.0 111.662 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.9 p -140.86 139.27 34.36 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 125.381 1.472 . . . . 0.0 111.354 175.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 80.2 p -154.01 162.14 41.42 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.726 1.611 . . . . 0.0 111.618 179.535 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 84.1 m-85 -133.43 132.43 41.11 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.632 1.173 . . . . 0.0 111.363 -177.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 72.5 165.08 8.05 Favored Glycine 0 CA--C 1.54 1.619 0 C-N-CA 124.605 1.097 . . . . 0.0 114.235 -172.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -146.95 55.31 2.39 Favored Pre-proline 0 CA--C 1.555 1.14 0 C-N-CA 124.617 1.167 . . . . 0.0 112.984 178.037 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -66.83 141.48 59.32 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.097 2.532 . . . . 0.0 112.378 -179.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 9.6 t -152.08 80.88 5.84 Favored Pre-proline 0 CA--C 1.545 0.773 0 C-N-CA 124.479 1.112 . . . . 0.0 110.88 176.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -78.13 95.72 1.08 Allowed 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 123.659 2.906 . . . . 0.0 111.562 -176.498 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 97.9 mt -115.69 -3.26 12.29 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.963 1.305 . . . . 0.0 114.397 -175.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 21.1 t -81.52 134.61 35.54 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.751 0.82 . . . . 0.0 112.054 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 81.4 p -158.42 163.15 37.48 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.525 1.53 . . . . 0.0 112.353 179.44 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -131.05 144.55 51.52 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.217 1.407 . . . . 0.0 111.181 173.244 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 59.8 m -142.44 151.47 41.8 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.745 1.218 . . . . 0.0 112.85 -172.477 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 57.01 25.64 10.94 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.983 1.713 . . . . 0.0 115.467 172.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -70.95 -22.42 62.22 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 114.29 1.218 . . . . 0.0 114.29 -174.339 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 . . . . . 0 CA--C 1.551 1.017 0 C-N-CA 125.906 1.682 . . . . 0.0 113.014 -179.239 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.566 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -92.93 154.54 18.13 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.128 1.371 . . . . 0.0 111.639 168.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 81.4 mt -129.25 157.12 42.75 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.145 1.378 . . . . 0.0 112.051 -176.284 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 79.3 m-70 -82.94 143.34 30.76 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.716 0.806 . . . . 0.0 109.584 162.347 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -107.13 -9.56 16.12 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 114.898 1.444 . . . . 0.0 114.898 -170.225 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -148.53 165.72 30.38 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.745 1.218 . . . . 0.0 112.957 -174.299 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 68.52 -158.9 52.32 Favored Glycine 0 CA--C 1.541 1.658 0 C-N-CA 123.931 0.777 . . . . 0.0 113.83 -179.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_endo -68.05 -15.45 43.26 Favored 'Trans proline' 0 CA--C 1.541 0.865 0 C-N-CA 123.268 2.645 . . . . 0.0 113.746 -177.441 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.0 mt -94.46 5.5 51.62 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.765 1.226 . . . . 0.0 113.949 176.301 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.93 114.12 2.41 Favored 'General case' 0 CA--C 1.549 0.907 0 CA-C-N 121.276 1.853 . . . . 0.0 111.995 -179.28 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.17 1.81 71.95 Favored Glycine 0 CA--C 1.542 1.763 0 C-N-CA 125.682 1.611 . . . . 0.0 115.694 -174.209 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 6.7 mp -98.61 157.17 34.74 Favored Pre-proline 0 CA--C 1.556 1.198 0 C-N-CA 126.792 2.037 . . . . 0.0 111.563 179.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -68.06 160.13 49.98 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 124.748 3.632 . . . . 0.0 113.664 -172.003 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 15.2 t -103.95 -30.77 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 O-C-N 121.445 -0.784 . . . . 0.0 112.2 175.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 22.3 p -124.96 170.31 11.24 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 125.143 1.377 . . . . 0.0 114.144 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 43.0 ttt-85 -59.97 -40.1 87.94 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.033 0.933 . . . . 0.0 111.119 173.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 37.4 m -62.77 -43.9 97.59 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.019 0.927 . . . . 0.0 111.291 172.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -60.59 -46.46 90.17 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 118.866 0.757 . . . . 0.0 111.274 175.069 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.19 -42.22 98.2 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 118.623 0.647 . . . . 0.0 112.55 179.587 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 74.5 mtp180 -64.45 -43.16 95.13 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 121.525 -0.735 . . . . 0.0 112.376 175.449 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 53.4 t -62.91 -48.33 88.55 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 C-N-CA 123.79 0.836 . . . . 0.0 111.142 176.195 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.7 mp -59.67 -45.15 92.91 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 118.45 -0.786 . . . . 0.0 112.602 176.542 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 49.7 mt -54.76 -51.49 51.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 CA-C-N 118.884 0.765 . . . . 0.0 110.157 173.346 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -65.44 -48.46 72.65 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 113.318 0.859 . . . . 0.0 113.318 -176.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 23.7 t30 -69.43 -42.78 74.56 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 118.627 0.648 . . . . 0.0 112.49 -176.704 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -65.01 -45.96 83.37 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 118.772 -0.633 . . . . 0.0 110.778 175.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.429 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 64.7 t90 -58.99 -47.34 85.53 Favored 'General case' 0 C--O 1.22 -0.454 0 CA-C-O 117.919 -1.039 . . . . 0.0 111.658 173.05 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -57.93 -45.22 86.9 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 120.645 1.566 . . . . 0.0 112.927 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -66.86 -52.76 39.77 Favored 'General case' 0 C--O 1.245 0.824 0 CA-C-N 119.599 1.09 . . . . 0.0 112.435 177.234 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -55.84 -48.51 75.36 Favored 'General case' 0 C--O 1.218 -0.595 0 O-C-N 121.776 -0.578 . . . . 0.0 110.16 177.513 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 18.5 ttpt -63.04 -34.02 76.67 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.214 1.405 . . . . 0.0 113.397 177.197 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -59.64 -33.66 71.81 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 119.998 1.272 . . . . 0.0 111.001 169.171 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 63.0 m -84.37 -17.66 38.69 Favored 'General case' 0 N--CA 1.484 1.234 0 N-CA-C 116.106 1.891 . . . . 0.0 116.106 165.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -143.09 72.89 18.29 Favored Pre-proline 0 CA--C 1.553 1.073 0 C-N-CA 127.266 2.226 . . . . 0.0 111.738 -165.278 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -61.84 -5.23 5.7 Favored 'Trans proline' 0 CA--C 1.547 1.166 0 C-N-CA 123.934 3.089 . . . . 0.0 116.649 -167.301 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 38.9 p90 -88.12 -9.11 54.27 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 126.921 2.088 . . . . 0.0 114.965 175.721 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.3 tp -65.43 137.5 57.51 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 114.725 1.38 . . . . 0.0 114.725 -164.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 34.4 mmt180 -84.21 155.01 22.71 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 125.139 1.376 . . . . 0.0 113.128 178.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.429 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -138.77 131.98 29.94 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.898 2.079 . . . . 0.0 109.681 -174.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 53.5 t0 -143.86 132.44 22.33 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.894 0.877 . . . . 0.0 111.152 174.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 66.7 mtt -125.9 2.21 7.35 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.313 1.445 . . . . 0.0 113.729 -176.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 73.4 m -62.73 144.7 56.14 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 118.96 0.8 . . . . 0.0 110.216 169.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -61.26 -25.04 66.82 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 -165.038 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -56.32 -34.48 66.58 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.86 0.864 . . . . 0.0 112.966 171.492 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.31 -40.04 95.0 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.508 0.723 . . . . 0.0 111.922 173.141 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.6 mp -73.28 -45.42 53.07 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 C-N-CA 124.204 1.001 . . . . 0.0 109.261 -179.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 11.7 m-30 -55.59 -46.15 77.29 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 118.618 0.644 . . . . 0.0 112.235 175.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.4 tmt_? -77.66 -39.92 43.45 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.65 1.18 . . . . 0.0 112.523 -173.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 62.2 ttm-85 -76.89 -35.69 57.24 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.144 0.978 . . . . 0.0 112.994 177.123 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 45.1 m-85 -127.19 72.68 76.96 Favored Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 125.991 1.717 . . . . 0.0 111.115 -174.534 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -66.68 -11.08 30.42 Favored 'Trans proline' 0 CA--C 1.542 0.898 0 C-N-CA 123.348 2.699 . . . . 0.0 114.171 -175.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 16.1 p-80 -74.83 -23.48 58.46 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.003 0.921 . . . . 0.0 113.343 171.296 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -81.04 -45.66 16.2 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.82 1.248 . . . . 0.0 111.892 -164.462 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 20.8 mmt85 . . . . . 0 C--O 1.253 1.268 0 C-N-CA 127.054 2.142 . . . . 0.0 111.121 172.794 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 70.4 p . . . . . 0 N--CA 1.477 0.91 0 N-CA-C 114.972 1.471 . . . . 0.0 114.972 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.0 m -84.92 -1.38 6.64 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 N-CA-C 115.294 1.59 . . . . 0.0 115.294 -169.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 30.2 m -73.4 -13.42 61.08 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 115.71 1.745 . . . . 0.0 115.71 -168.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -79.24 149.36 31.9 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -176.708 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 86.59 134.51 3.86 Favored Glycine 0 CA--C 1.538 1.476 0 C-N-CA 125.693 1.616 . . . . 0.0 114.341 175.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -151.78 67.26 7.15 Favored Pre-proline 0 CA--C 1.556 1.177 0 C-N-CA 125.099 1.36 . . . . 0.0 112.152 -179.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -70.32 146.65 57.35 Favored 'Trans proline' 0 CA--C 1.543 0.948 0 C-N-CA 123.369 2.712 . . . . 0.0 112.725 179.56 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 67.3 m -139.47 62.43 24.01 Favored Pre-proline 0 N--CA 1.479 1.014 0 C-N-CA 124.933 1.293 . . . . 0.0 112.637 -177.618 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -67.77 132.15 26.03 Favored 'Trans proline' 0 CA--C 1.542 0.923 0 C-N-CA 123.169 2.579 . . . . 0.0 112.095 179.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.3 tt -153.92 115.56 4.2 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.901 1.28 . . . . 0.0 110.341 179.067 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 76.2 p -155.41 148.48 24.61 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.787 1.235 . . . . 0.0 112.304 172.028 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.9 t -159.69 128.72 5.17 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.682 1.193 . . . . 0.0 111.269 172.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -155.97 124.59 5.93 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.981 1.312 . . . . 0.0 110.353 172.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 11.0 t -160.44 151.77 19.36 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.425 1.09 . . . . 0.0 112.426 177.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 47.54 63.05 2.15 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.634 1.974 . . . . 0.0 114.364 170.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -76.54 43.02 0.3 Allowed 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 124.914 1.285 . . . . 0.0 112.27 172.218 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 . . . . . 0 CA--C 1.548 0.892 0 C-N-CA 126.918 2.087 . . . . 0.0 113.575 -168.307 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.579 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -92.41 150.96 20.49 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.612 1.165 . . . . 0.0 111.681 168.844 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 99.5 mt -131.34 157.49 43.21 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.678 1.591 . . . . 0.0 111.28 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -79.23 143.37 35.38 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.809 0.843 . . . . 0.0 109.91 166.552 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -106.83 -9.01 16.51 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 -172.002 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -148.39 165.7 30.31 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.85 1.26 . . . . 0.0 112.924 -174.802 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 69.53 -161.16 52.68 Favored Glycine 0 CA--C 1.541 1.701 0 C-N-CA 123.942 0.782 . . . . 0.0 113.9 -179.33 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -68.07 -16.03 44.17 Favored 'Trans proline' 0 CA--C 1.541 0.851 0 C-N-CA 123.191 2.594 . . . . 0.0 113.72 -177.059 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.1 mt -92.91 4.28 54.2 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 124.813 1.245 . . . . 0.0 113.971 175.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.39 113.94 2.2 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-N 121.107 1.776 . . . . 0.0 112.088 -178.099 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 92.55 4.27 66.0 Favored Glycine 0 CA--C 1.544 1.864 0 C-N-CA 125.642 1.591 . . . . 0.0 115.704 -173.631 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 5.9 mp -105.45 154.77 38.83 Favored Pre-proline 0 CA--C 1.555 1.173 0 C-N-CA 126.831 2.052 . . . . 0.0 111.435 179.848 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -71.56 162.55 41.84 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 124.98 3.786 . . . . 0.0 113.859 -167.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 14.7 t -105.27 -32.88 2.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 O-C-N 121.441 -0.787 . . . . 0.0 113.09 -179.122 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 25.1 p -123.93 172.75 8.69 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 124.914 1.285 . . . . 0.0 113.988 179.364 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 41.5 mtp-105 -61.68 -40.5 95.21 Favored 'General case' 0 N--CA 1.482 1.156 0 O-C-N 121.378 -0.827 . . . . 0.0 110.562 175.054 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 31.3 m -61.67 -44.61 96.63 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 124.353 1.061 . . . . 0.0 111.237 173.321 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -61.16 -47.29 86.88 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 118.885 0.766 . . . . 0.0 111.233 175.116 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.21 -39.58 90.75 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.616 -0.677 . . . . 0.0 112.216 179.698 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 75.3 ttt180 -65.21 -42.07 93.86 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 121.422 -0.798 . . . . 0.0 112.354 174.14 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 68.1 t -63.07 -48.54 87.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 CA-C-N 118.786 0.721 . . . . 0.0 111.223 175.021 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -60.63 -45.11 95.29 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 118.628 -0.701 . . . . 0.0 111.952 178.178 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 52.9 mt -53.59 -51.69 40.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-N 118.736 0.698 . . . . 0.0 110.33 170.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -64.15 -46.5 83.79 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 -176.298 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -70.71 -44.99 65.78 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.033 0.933 . . . . 0.0 112.353 -176.517 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -65.71 -44.01 87.37 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 118.766 -0.635 . . . . 0.0 111.091 176.091 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.426 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 68.3 t90 -60.02 -45.48 92.64 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-O 117.572 -1.204 . . . . 0.0 111.59 171.589 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -54.93 -48.68 72.81 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 120.836 1.653 . . . . 0.0 112.492 178.667 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -65.29 -51.5 60.3 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 119.68 1.127 . . . . 0.0 112.232 177.207 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 38.2 mmt180 -58.54 -46.25 87.22 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 122.99 0.516 . . . . 0.0 110.845 -178.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 3.5 tmtm? -69.27 -30.32 68.4 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 126.043 1.737 . . . . 0.0 113.509 178.661 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 90.8 mttt -65.83 -28.23 68.83 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 119.993 1.27 . . . . 0.0 111.98 166.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 68.5 m -82.9 -22.65 33.88 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 115.173 1.546 . . . . 0.0 115.173 163.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -140.44 75.83 26.48 Favored Pre-proline 0 N--CA 1.477 0.903 0 C-N-CA 127.105 2.162 . . . . 0.0 111.363 -167.332 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -58.63 -16.84 32.29 Favored 'Trans proline' 0 CA--C 1.542 0.907 0 C-N-CA 123.379 2.719 . . . . 0.0 116.039 -165.393 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 39.1 p90 -79.08 -9.78 59.64 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 126.611 1.964 . . . . 0.0 115.463 177.181 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 18.2 tp -64.05 135.42 56.39 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 120.098 1.317 . . . . 0.0 114.35 -167.069 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 7.5 tpm_? -77.9 146.65 35.46 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.939 1.696 . . . . 0.0 112.721 178.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.426 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.4 tm? -128.36 133.89 48.74 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 126.886 2.074 . . . . 0.0 109.847 179.533 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -149.62 134.3 17.69 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.901 0.881 . . . . 0.0 111.084 176.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 63.6 mtt -130.24 1.79 4.67 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.052 1.341 . . . . 0.0 114.288 -171.653 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 69.6 m -63.78 147.34 52.0 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.022 0.828 . . . . 0.0 111.067 173.097 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -58.52 -27.64 64.69 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 114.888 1.44 . . . . 0.0 114.888 -166.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -56.85 -37.37 71.2 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 119.035 0.834 . . . . 0.0 112.802 172.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.06 -37.1 86.2 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.661 0.784 . . . . 0.0 112.065 174.162 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.6 mp -73.65 -46.4 47.94 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 C-N-CA 124.104 0.962 . . . . 0.0 109.327 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 13.9 m-30 -56.17 -45.81 79.56 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 119.006 0.821 . . . . 0.0 112.334 174.391 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.46 -38.97 62.8 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 124.277 1.031 . . . . 0.0 112.283 -173.943 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 39.7 ttm105 -78.99 -34.78 43.79 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.836 0.854 . . . . 0.0 112.948 176.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 -128.21 78.16 75.86 Favored Pre-proline 0 CA--C 1.546 0.827 0 C-N-CA 126.396 1.879 . . . . 0.0 110.757 -174.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -66.16 -16.04 50.59 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 123.091 2.527 . . . . 0.0 114.231 -173.4 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 12.9 p-80 -73.99 -24.01 59.53 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.138 0.975 . . . . 0.0 113.444 172.48 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -82.18 -27.31 32.71 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 125.858 1.663 . . . . 0.0 112.252 -171.442 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 59.6 ttp180 . . . . . 0 C--O 1.254 1.311 0 C-N-CA 125.169 1.388 . . . . 0.0 112.291 175.994 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.6 t . . . . . 0 N--CA 1.477 0.906 0 N-CA-C 115.35 1.611 . . . . 0.0 115.35 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 15.1 m -143.33 152.83 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 126.831 2.053 . . . . 0.0 111.819 -174.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 26.4 m -73.66 -34.44 64.93 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 113.322 0.86 . . . . 0.0 113.322 -179.074 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 7.3 t80 52.09 37.18 20.81 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 126.289 1.836 . . . . 0.0 114.956 172.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -69.84 144.61 40.29 Favored Glycine 0 CA--C 1.537 1.46 0 O-C-N 121.247 -0.908 . . . . 0.0 113.747 -178.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -146.22 66.59 11.42 Favored Pre-proline 0 CA--C 1.554 1.124 0 C-N-CA 125.036 1.334 . . . . 0.0 111.878 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_endo -69.35 150.47 70.74 Favored 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 123.677 2.918 . . . . 0.0 113.094 -177.343 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.9 p -148.31 53.53 1.5 Allowed Pre-proline 0 CA--C 1.553 1.07 0 C-N-CA 125.094 1.357 . . . . 0.0 113.472 -179.458 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -66.02 144.77 77.39 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 123.413 2.742 . . . . 0.0 113.358 -176.176 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.4 mt -140.82 153.7 45.9 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.637 1.975 . . . . 0.0 110.939 176.571 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 81.9 p -152.26 161.46 42.57 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.783 1.233 . . . . 0.0 113.171 -179.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 63.0 m -137.61 148.67 46.02 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.904 1.682 . . . . 0.0 111.393 178.232 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -150.7 138.09 19.54 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.498 1.119 . . . . 0.0 112.121 -177.211 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 69.0 m -142.02 132.69 25.51 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 125.523 1.529 . . . . 0.0 111.132 177.435 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -146.72 -1.56 0.68 Allowed 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 115.396 1.628 . . . . 0.0 115.396 -177.451 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -70.26 -13.48 62.19 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 115.727 1.751 . . . . 0.0 115.727 -165.698 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 . . . . . 0 CA--C 1.548 0.898 0 C-N-CA 125.371 1.469 . . . . 0.0 113.033 173.061 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.546 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -89.25 159.57 17.36 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.792 1.237 . . . . 0.0 111.275 164.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 96.5 mt -135.52 156.17 49.32 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.047 1.339 . . . . 0.0 112.178 -176.059 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 87.3 m-70 -81.67 141.87 33.24 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.731 0.812 . . . . 0.0 109.479 162.12 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -104.82 -16.76 14.81 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 -172.415 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -139.58 162.67 34.53 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.155 1.382 . . . . 0.0 112.373 -173.061 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.84 -161.23 53.97 Favored Glycine 0 CA--C 1.541 1.671 0 C-N-CA 124.075 0.845 . . . . 0.0 113.99 179.065 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -67.81 -16.38 45.86 Favored 'Trans proline' 0 CA--C 1.542 0.902 0 C-N-CA 123.241 2.628 . . . . 0.0 113.835 -176.162 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 98.9 mt -92.82 4.28 54.13 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.697 1.199 . . . . 0.0 113.865 175.245 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.41 113.74 2.12 Favored 'General case' 0 CA--C 1.548 0.896 0 CA-C-N 121.097 1.771 . . . . 0.0 111.999 -179.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.93 6.16 65.53 Favored Glycine 0 CA--C 1.543 1.787 0 C-N-CA 125.453 1.501 . . . . 0.0 115.737 -173.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 6.0 mp -106.44 157.3 35.32 Favored Pre-proline 0 CA--C 1.558 1.267 0 C-N-CA 126.986 2.114 . . . . 0.0 111.318 178.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -71.36 163.9 37.53 Favored 'Trans proline' 0 C--N 1.355 0.882 0 C-N-CA 124.65 3.567 . . . . 0.0 113.833 -168.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 11.0 t -107.05 -27.88 2.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 123.658 0.783 . . . . 0.0 112.084 176.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 29.1 p -126.89 170.38 12.29 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 125.021 1.328 . . . . 0.0 114.471 -179.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 71.8 ttt180 -64.65 -39.36 93.56 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 124.618 1.167 . . . . 0.0 111.116 176.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 11.8 p -65.9 -40.58 91.66 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.275 1.03 . . . . 0.0 111.987 170.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 85.6 m-20 -58.82 -48.86 79.82 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 120.01 1.277 . . . . 0.0 110.846 172.297 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.22 -40.74 91.24 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 121.573 -0.704 . . . . 0.0 112.504 179.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 38.4 mmm-85 -61.55 -46.8 88.37 Favored 'General case' 0 N--CA 1.485 1.292 0 O-C-N 121.38 -0.825 . . . . 0.0 112.778 172.3 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 55.4 t -61.67 -46.07 97.33 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 C-N-CA 123.662 0.785 . . . . 0.0 111.058 177.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 56.5 mt -63.11 -43.49 98.28 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 117.839 -1.077 . . . . 0.0 112.107 178.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 54.5 mt -53.98 -52.6 34.82 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 CA-C-N 119.591 1.087 . . . . 0.0 110.146 171.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -63.33 -46.83 84.79 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 -177.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -69.91 -44.8 68.92 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 119.043 0.838 . . . . 0.0 112.233 -177.114 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -54.42 -54.85 35.15 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.951 0.9 . . . . 0.0 109.992 172.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.436 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 66.2 t90 -62.39 -42.76 99.67 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-O 117.771 -1.109 . . . . 0.0 112.436 178.805 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -57.56 -46.59 83.74 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 120.723 1.602 . . . . 0.0 112.513 178.408 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -66.65 -49.31 66.64 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 119.347 0.976 . . . . 0.0 112.036 176.399 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 6.1 mmp_? -53.9 -53.88 46.53 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.56 0.744 . . . . 0.0 110.053 177.487 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 45.7 tptt -64.04 -34.26 77.61 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 126.1 1.76 . . . . 0.0 113.374 -178.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt -59.7 -37.23 78.29 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.324 0.966 . . . . 0.0 111.086 169.453 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 70.7 m -81.71 -21.97 37.67 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 115.414 1.635 . . . . 0.0 115.414 169.116 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -143.52 84.82 9.78 Favored Pre-proline 0 N--CA 1.477 0.909 0 C-N-CA 125.913 1.685 . . . . 0.0 112.132 -161.063 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -60.45 -12.66 21.51 Favored 'Trans proline' 0 CA--C 1.544 1.019 0 C-N-CA 123.009 2.473 . . . . 0.0 115.288 -172.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 40.4 p90 -81.91 -8.07 59.65 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 115.509 1.67 . . . . 0.0 115.509 176.661 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.47 137.74 58.32 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 120.394 1.452 . . . . 0.0 113.444 -176.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 84.2 mtp180 -99.99 153.44 19.19 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 125.951 1.7 . . . . 0.0 112.277 175.021 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.436 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.4 tm? -128.4 130.99 48.48 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.769 1.628 . . . . 0.0 110.029 -174.29 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -142.01 131.08 23.23 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.244 1.018 . . . . 0.0 111.049 176.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 61.1 mtt -128.32 -0.37 5.7 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.737 1.384 . . . . 0.0 114.737 -171.824 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 63.6 m -65.77 150.86 47.84 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 118.769 0.713 . . . . 0.0 110.467 172.635 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 27.4 m-20 -59.86 -24.45 64.24 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 114.652 1.352 . . . . 0.0 114.652 -165.558 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -55.56 -36.76 67.17 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.678 0.791 . . . . 0.0 112.416 171.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.61 -39.31 90.77 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 118.868 0.758 . . . . 0.0 112.101 174.195 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.6 mp -73.14 -47.15 48.51 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 C-N-CA 124.341 1.056 . . . . 0.0 109.071 -179.307 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 11.3 m-30 -57.11 -44.41 83.22 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 118.669 0.668 . . . . 0.0 112.296 176.351 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.3 tmt_? -77.66 -38.29 48.05 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 124.656 1.182 . . . . 0.0 112.595 -173.246 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 46.8 mtt-85 -69.02 -41.92 77.1 Favored 'General case' 0 N--CA 1.483 1.181 0 CA-C-N 118.912 0.778 . . . . 0.0 112.506 169.473 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -130.35 71.15 82.38 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 125.43 1.492 . . . . 0.0 111.544 -164.145 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -66.33 -12.68 36.64 Favored 'Trans proline' 0 CA--C 1.54 0.813 0 C-N-CA 123.171 2.58 . . . . 0.0 113.739 -177.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 15.9 p-80 -72.83 -23.86 60.82 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.308 1.043 . . . . 0.0 113.442 172.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -80.79 -45.25 17.26 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.193 0.997 . . . . 0.0 112.528 -161.069 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 3.7 tmt_? . . . . . 0 C--O 1.253 1.278 0 C-N-CA 125.968 1.707 . . . . 0.0 110.752 -178.042 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 71.1 m . . . . . 0 N--CA 1.477 0.918 0 N-CA-C 111.529 0.196 . . . . 0.0 111.529 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 62.0 t -133.58 114.96 21.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 C-N-CA 125.179 1.391 . . . . 0.0 109.371 174.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.0 m -137.89 15.29 2.88 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 -171.389 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 36.2 p90 -112.54 163.04 14.97 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.512 1.525 . . . . 0.0 113.322 -173.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 130.86 89.68 0.51 Allowed Glycine 0 CA--C 1.533 1.163 0 C-N-CA 125.693 1.616 . . . . 0.0 112.236 177.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -144.36 64.23 11.97 Favored Pre-proline 0 CA--C 1.556 1.179 0 C-N-CA 124.702 1.201 . . . . 0.0 112.351 -178.475 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -69.52 157.54 60.49 Favored 'Trans proline' 0 CA--C 1.543 0.955 0 C-N-CA 123.65 2.9 . . . . 0.0 112.884 179.388 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 75.4 p -150.3 151.57 31.64 Favored Pre-proline 0 N--CA 1.476 0.844 0 C-N-CA 125.004 1.321 . . . . 0.0 112.732 178.167 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -74.97 156.07 43.11 Favored 'Trans proline' 0 CA--C 1.542 0.919 0 C-N-CA 123.61 2.873 . . . . 0.0 112.721 177.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.1 pp -151.19 165.63 33.33 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.142 1.377 . . . . 0.0 112.871 176.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.3 t 60.41 178.55 0.1 Allowed 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 126.604 1.962 . . . . 0.0 115.678 177.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 61.39 8.4 2.14 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 127.907 2.483 . . . . 0.0 116.566 179.441 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -63.0 -30.97 72.01 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 120.447 -1.408 . . . . 0.0 113.764 -168.565 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 76.7 p -99.22 0.55 43.46 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.368 1.467 . . . . 0.0 114.743 -176.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -136.75 -5.81 1.94 Allowed 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 116.215 1.931 . . . . 0.0 116.215 -169.565 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -58.74 -23.57 60.07 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 115.137 1.532 . . . . 0.0 115.137 -173.083 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.546 0.826 0 C-N-CA 126.915 2.086 . . . . 0.0 114.407 177.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.573 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -97.15 154.02 17.62 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.312 1.445 . . . . 0.0 111.987 171.194 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 98.2 mt -130.67 157.36 43.0 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 125.64 1.576 . . . . 0.0 111.186 178.518 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 83.2 m-70 -77.87 141.09 39.32 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.587 0.755 . . . . 0.0 109.82 165.425 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -102.89 -16.75 15.79 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 -174.396 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -139.87 163.0 33.81 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.264 1.425 . . . . 0.0 112.373 -173.093 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.86 -162.71 54.43 Favored Glycine 0 CA--C 1.541 1.686 0 C-N-CA 123.978 0.799 . . . . 0.0 114.159 179.02 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -68.0 -17.02 46.11 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 123.279 2.653 . . . . 0.0 113.887 -175.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 81.7 mt -92.25 4.88 52.35 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.741 1.216 . . . . 0.0 113.837 174.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.88 114.96 2.55 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 121.142 1.792 . . . . 0.0 112.061 -178.313 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 92.12 3.55 67.58 Favored Glycine 0 CA--C 1.543 1.792 0 C-N-CA 125.704 1.621 . . . . 0.0 115.592 -173.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 5.6 mp -105.09 155.36 37.81 Favored Pre-proline 0 CA--C 1.555 1.147 0 C-N-CA 126.841 2.056 . . . . 0.0 111.26 178.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -68.4 162.22 41.55 Favored 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 124.71 3.606 . . . . 0.0 113.459 -170.423 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 14.9 t -102.15 -33.72 3.49 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 O-C-N 121.428 -0.795 . . . . 0.0 112.706 178.329 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 27.1 p -123.98 173.87 7.96 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 125.053 1.341 . . . . 0.0 114.165 -178.618 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 55.4 ttt85 -61.28 -42.1 98.08 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.128 0.971 . . . . 0.0 110.914 173.054 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 32.9 m -61.16 -45.03 96.29 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.908 0.883 . . . . 0.0 110.941 173.353 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 78.2 m-20 -61.11 -47.02 88.19 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 118.644 0.657 . . . . 0.0 111.273 175.595 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.36 -41.24 88.79 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.458 -0.776 . . . . 0.0 112.708 179.461 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.7 tmt_? -65.38 -45.44 84.06 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 118.661 0.664 . . . . 0.0 111.818 174.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 76.6 t -62.21 -46.01 97.43 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 CA-C-N 118.712 0.687 . . . . 0.0 111.38 177.787 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -63.84 -44.93 91.71 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 118.099 -0.953 . . . . 0.0 112.375 177.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 50.2 mt -53.94 -51.78 42.28 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 CA-C-N 119.684 1.129 . . . . 0.0 109.819 171.319 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -60.65 -52.41 65.27 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.09 0.556 . . . . 0.0 112.196 -176.561 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -78.63 -34.71 46.31 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -171.641 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -63.32 -44.22 95.56 Favored 'General case' 0 N--CA 1.467 0.377 0 O-C-N 121.807 -0.558 . . . . 0.0 110.051 169.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.426 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 68.2 t90 -59.41 -48.72 80.55 Favored 'General case' 0 C--O 1.216 -0.7 0 CA-C-O 116.834 -1.555 . . . . 0.0 111.753 170.658 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -51.59 -47.94 63.37 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 121.756 2.071 . . . . 0.0 112.606 179.394 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -68.12 -50.14 56.64 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 118.941 0.791 . . . . 0.0 112.432 178.705 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 90.0 mmt-85 -59.23 -45.14 91.93 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 121.471 -0.768 . . . . 0.0 110.474 178.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 47.1 tptt -61.31 -36.27 79.67 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 127.108 2.163 . . . . 0.0 113.078 174.833 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -61.33 -35.34 77.12 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.531 1.06 . . . . 0.0 111.145 169.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 60.6 m -80.31 -19.83 45.71 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 115.472 1.656 . . . . 0.0 115.472 167.096 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -142.07 78.71 16.92 Favored Pre-proline 0 N--CA 1.477 0.892 0 C-N-CA 127.004 2.122 . . . . 0.0 111.88 -166.151 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_endo -59.0 -15.81 29.45 Favored 'Trans proline' 0 CA--C 1.545 1.035 0 C-N-CA 123.121 2.547 . . . . 0.0 114.977 -173.487 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 39.4 p90 -78.89 -10.03 59.68 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.932 1.693 . . . . 0.0 115.3 174.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 14.6 tp -67.36 134.24 51.13 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 120.389 1.45 . . . . 0.0 113.849 -169.211 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 80.1 ttt180 -86.45 152.68 22.48 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 126.12 1.768 . . . . 0.0 112.494 178.171 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.426 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -131.4 131.49 43.66 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.824 2.05 . . . . 0.0 109.692 -177.05 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -143.49 135.26 26.48 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.945 0.898 . . . . 0.0 111.006 176.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 63.2 mtt -130.37 21.89 5.19 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.08 1.352 . . . . 0.0 112.782 -176.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 32.4 t -63.86 152.53 39.43 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.626 0.771 . . . . 0.0 111.173 173.315 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -52.02 -39.46 59.52 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.964 0.906 . . . . 0.0 112.329 179.349 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -59.32 -37.54 78.01 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.794 1.238 . . . . 0.0 112.78 176.426 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.3 -42.05 99.03 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 118.767 0.712 . . . . 0.0 111.638 176.388 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.26 -46.98 62.68 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 C-N-CA 123.384 0.674 . . . . 0.0 109.735 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 16.6 m-30 -56.11 -45.75 79.37 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 176.457 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.99 -38.31 37.11 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 124.417 1.087 . . . . 0.0 112.631 -172.098 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 56.0 ttt85 -75.7 -36.88 59.9 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.117 0.967 . . . . 0.0 112.631 175.265 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 38.4 m-85 -124.04 80.49 57.67 Favored Pre-proline 0 CA--C 1.545 0.773 0 C-N-CA 125.683 1.593 . . . . 0.0 110.929 -175.439 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -67.75 -9.54 25.86 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 123.326 2.684 . . . . 0.0 114.442 -173.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 10.7 p-80 -80.62 -18.54 47.85 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.343 1.057 . . . . 0.0 113.619 170.383 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.58 -10.8 26.4 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 126.666 1.986 . . . . 0.0 113.546 -172.512 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 6.5 ppt_? . . . . . 0 C--O 1.253 1.255 0 C-N-CA 124.621 1.168 . . . . 0.0 113.48 174.531 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 99.5 mtp . . . . . 0 N--CA 1.498 1.958 0 CA-C-O 119.743 -0.17 . . . . 0.0 110.643 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.32 169.28 22.35 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 124.961 1.305 . . . . 0.0 113.308 177.504 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 115.93 113.4 2.83 Favored Glycine 0 CA--C 1.533 1.215 0 C-N-CA 125.57 1.557 . . . . 0.0 113.559 170.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 78.0 p -157.38 154.33 28.72 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 126.096 1.758 . . . . 0.0 111.395 173.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 55.6 t-80 -153.77 136.75 15.46 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.392 1.077 . . . . 0.0 112.045 176.524 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 13.8 p80 -157.35 143.27 17.62 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.914 1.286 . . . . 0.0 111.666 165.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -160.81 142.86 12.44 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.118 1.367 . . . . 0.0 111.163 165.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -156.91 142.9 17.91 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.494 1.118 . . . . 0.0 112.13 167.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 48.7 p-80 -152.11 149.75 29.14 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.301 1.44 . . . . 0.0 111.36 164.192 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 44.1 p-80 -156.4 163.53 39.35 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.448 1.099 . . . . 0.0 113.339 176.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 81.49 154.92 12.86 Favored Glycine 0 CA--C 1.538 1.514 0 C-N-CA 125.232 1.396 . . . . 0.0 116.365 166.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 23.3 t -157.86 146.57 19.28 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 126.484 1.914 . . . . 0.0 110.31 172.161 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 22.2 m -140.19 152.92 21.95 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 125.124 1.37 . . . . 0.0 112.884 -176.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.6 m -140.97 155.82 46.17 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 125.967 1.707 . . . . 0.0 111.534 178.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 60.2 t80 -138.14 76.9 1.6 Allowed 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.645 1.178 . . . . 0.0 111.286 179.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -79.47 43.99 2.63 Favored Glycine 0 CA--C 1.537 1.46 0 C-N-CA 125.518 1.532 . . . . 0.0 114.589 -178.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -130.88 67.31 80.59 Favored Pre-proline 0 CA--C 1.553 1.084 0 C-N-CA 125.23 1.412 . . . . 0.0 112.953 -172.294 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -71.21 165.76 31.39 Favored 'Trans proline' 0 CA--C 1.544 1.017 0 C-N-CA 123.703 2.936 . . . . 0.0 112.617 174.232 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 61.8 m -129.42 66.41 76.8 Favored Pre-proline 0 N--CA 1.478 0.93 0 C-N-CA 124.93 1.292 . . . . 0.0 112.308 -178.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -70.4 159.24 53.6 Favored 'Trans proline' 0 CA--C 1.543 0.927 0 C-N-CA 123.559 2.839 . . . . 0.0 112.799 178.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 58.6 tp -146.05 130.55 17.79 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.033 1.333 . . . . 0.0 111.356 176.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 77.7 p -143.13 18.37 1.93 Allowed 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 125.089 1.356 . . . . 0.0 113.964 -177.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.0 t -90.11 2.39 55.32 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 114.633 1.345 . . . . 0.0 114.633 -167.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -137.4 127.3 25.69 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.832 1.253 . . . . 0.0 111.939 -176.418 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 69.3 m -136.88 62.48 1.6 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.976 2.11 . . . . 0.0 110.338 178.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 61.84 21.28 12.13 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.778 2.031 . . . . 0.0 115.237 -177.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -64.06 -25.78 68.26 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 115.106 1.521 . . . . 0.0 115.106 -171.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -126.58 5.41 6.82 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.632 1.573 . . . . 0.0 113.217 -179.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 47.8 mm -75.18 -31.82 25.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 O-C-N 120.956 -1.09 . . . . 0.0 111.534 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 45.9 m-20 57.23 -169.93 0.1 Allowed 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 126.465 1.906 . . . . 0.0 113.708 175.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 15.7 t80 56.11 32.62 20.44 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 125.697 1.599 . . . . 0.0 114.421 176.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 60.2 ttp -78.94 -40.95 30.55 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 121.297 -0.877 . . . . 0.0 112.359 -177.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 19.5 p -138.61 57.56 12.01 Favored Pre-proline 0 N--CA 1.481 1.102 0 C-N-CA 125.729 1.612 . . . . 0.0 112.187 -175.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -64.18 146.97 91.28 Favored 'Trans proline' 0 CA--C 1.549 1.263 0 C-N-CA 123.117 2.545 . . . . 0.0 112.579 -178.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -76.92 104.63 1.94 Allowed 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 123.5 2.8 . . . . 0.0 111.686 -178.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -141.12 149.82 42.04 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 125.468 1.507 . . . . 0.0 111.721 179.608 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -134.58 8.74 3.63 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 114.512 1.301 . . . . 0.0 114.512 178.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -147.14 160.7 42.12 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 126.218 1.807 . . . . 0.0 110.543 177.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -139.81 4.3 2.1 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.626 1.57 . . . . 0.0 114.397 -179.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -146.67 71.16 12.65 Favored Pre-proline 0 CA--C 1.546 0.795 0 C-N-CA 125.3 1.44 . . . . 0.0 108.794 173.694 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -79.69 138.18 13.28 Favored 'Trans proline' 0 CA--C 1.543 0.954 0 C-N-CA 122.896 2.397 . . . . 0.0 111.505 -176.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 77.53 115.88 0.17 Allowed Glycine 0 CA--C 1.537 1.437 0 C-N-CA 124.764 1.173 . . . . 0.0 112.675 -171.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -154.81 162.47 41.1 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.948 1.299 . . . . 0.0 112.226 -176.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.2 pp -130.22 167.95 17.61 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.593 1.957 . . . . 0.0 111.683 173.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -130.97 126.25 35.53 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.13 0.972 . . . . 0.0 111.883 174.255 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -83.67 143.95 29.73 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.348 1.059 . . . . 0.0 110.908 169.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 59.0 mt -128.08 157.66 40.1 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.336 1.054 . . . . 0.0 112.65 -169.496 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -79.2 138.82 38.0 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.22 1.008 . . . . 0.0 110.193 166.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -95.85 -15.3 22.57 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 114.658 1.355 . . . . 0.0 114.658 -173.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -150.28 169.4 21.45 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.721 1.209 . . . . 0.0 113.105 -172.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 72.49 -163.67 54.68 Favored Glycine 0 CA--C 1.54 1.65 0 C-N-CA 124.169 0.89 . . . . 0.0 114.041 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -67.63 -16.94 47.82 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 123.173 2.582 . . . . 0.0 113.713 -176.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.3 mt -94.01 5.88 50.28 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.723 1.209 . . . . 0.0 113.931 175.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.12 123.33 13.31 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 120.91 1.687 . . . . 0.0 112.387 -177.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 81.78 3.58 90.56 Favored Glycine 0 CA--C 1.54 1.641 0 C-N-CA 125.523 1.535 . . . . 0.0 115.323 -175.015 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 16.4 mt -101.46 162.1 21.53 Favored Pre-proline 0 CA--C 1.556 1.208 0 C-N-CA 126.145 1.778 . . . . 0.0 110.926 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -76.8 159.35 34.83 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 124.269 3.312 . . . . 0.0 113.562 -164.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 42.4 t -96.55 -33.85 4.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 CA-C-O 118.621 -0.704 . . . . 0.0 112.743 174.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 16.2 p -124.5 172.18 9.4 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 114.707 1.373 . . . . 0.0 114.707 -178.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 13.6 ptp180 -63.65 -35.03 79.19 Favored 'General case' 0 N--CA 1.482 1.125 0 O-C-N 121.358 -0.839 . . . . 0.0 112.052 174.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.0 t -64.98 -46.58 80.86 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.427 0.691 . . . . 0.0 110.411 171.134 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -59.78 -42.64 93.81 Favored 'General case' 0 CA--C 1.539 0.538 0 O-C-N 121.658 -0.651 . . . . 0.0 111.616 177.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.01 -43.66 94.98 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 123.957 0.903 . . . . 0.0 113.035 177.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.6 tmt_? -64.49 -43.61 93.6 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 119.311 0.959 . . . . 0.0 111.668 176.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 77.5 t -63.13 -44.34 99.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 123.605 0.762 . . . . 0.0 110.983 176.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 20.4 mt -57.89 -51.26 70.34 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 118.113 -0.946 . . . . 0.0 112.103 173.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 65.7 mt -54.37 -50.12 59.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 CA-C-N 119.25 0.932 . . . . 0.0 110.365 177.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -64.19 -47.8 78.36 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 -178.104 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -70.45 -42.84 70.98 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 119.131 0.878 . . . . 0.0 112.466 -177.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -56.22 -54.79 41.06 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 124.286 1.034 . . . . 0.0 110.073 172.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.423 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 68.4 t90 -61.07 -45.37 95.03 Favored 'General case' 0 C--O 1.219 -0.505 0 CA-C-O 117.755 -1.117 . . . . 0.0 111.934 177.674 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -55.49 -47.69 75.76 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 120.562 1.528 . . . . 0.0 112.433 178.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -70.65 -48.44 54.92 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 119.524 1.056 . . . . 0.0 112.521 178.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.5 mmp_? -55.34 -49.8 71.3 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.063 0.545 . . . . 0.0 110.48 177.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.8 tmtt? -69.79 -29.23 66.49 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.882 1.673 . . . . 0.0 113.637 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 34.0 ttpt -58.92 -37.1 75.89 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.965 1.257 . . . . 0.0 110.851 165.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 68.3 m -81.89 -22.57 36.79 Favored 'General case' 0 N--CA 1.481 1.106 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 168.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -139.92 73.06 33.9 Favored Pre-proline 0 N--CA 1.477 0.916 0 C-N-CA 126.669 1.988 . . . . 0.0 111.534 -164.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -62.05 -6.68 8.34 Favored 'Trans proline' 0 CA--C 1.546 1.099 0 C-N-CA 124.095 3.196 . . . . 0.0 116.5 -165.168 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 37.7 p90 -83.9 -11.58 56.71 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 126.458 1.903 . . . . 0.0 114.875 175.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.5 tp -65.54 136.55 56.54 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 -167.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 27.2 mmm180 -84.23 156.07 22.18 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 124.886 1.275 . . . . 0.0 112.798 179.39 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.423 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -138.75 127.46 23.45 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 126.224 1.81 . . . . 0.0 110.1 -175.636 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -150.17 139.66 21.49 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.604 1.161 . . . . 0.0 111.772 177.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 62.6 mtt -135.01 11.04 3.6 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 114.098 1.148 . . . . 0.0 114.098 -167.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 29.8 m -63.02 155.02 28.8 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.117 0.967 . . . . 0.0 111.541 177.039 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -55.23 -36.31 65.86 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 121.09 -1.007 . . . . 0.0 113.448 -171.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -60.86 -34.16 74.18 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.964 0.905 . . . . 0.0 112.841 175.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.05 -41.84 98.55 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 119.071 0.851 . . . . 0.0 111.56 174.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.6 mp -71.34 -45.94 67.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 C-N-CA 123.855 0.862 . . . . 0.0 109.413 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 15.5 m-30 -56.21 -47.02 79.22 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 118.746 0.703 . . . . 0.0 112.693 174.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.9 tmt_? -76.0 -38.18 57.64 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.582 1.153 . . . . 0.0 112.366 -172.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 6.1 ttm180 -75.18 -41.28 58.32 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.675 0.79 . . . . 0.0 112.249 173.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 38.7 m-85 -124.6 81.43 60.3 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 126.028 1.731 . . . . 0.0 111.027 -173.009 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -66.28 -17.48 54.25 Favored 'Trans proline' 0 CA--C 1.539 0.75 0 C-N-CA 123.114 2.543 . . . . 0.0 114.499 -171.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 10.2 p-80 -74.25 -22.89 59.12 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.875 0.87 . . . . 0.0 113.299 173.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -84.32 -15.04 47.99 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 125.819 1.648 . . . . 0.0 113.162 -175.748 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 57.8 ttp180 . . . . . 0 C--O 1.254 1.299 0 C-N-CA 124.501 1.12 . . . . 0.0 111.985 174.018 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 99.0 mtp . . . . . 0 N--CA 1.497 1.921 0 N-CA-C 110.852 -0.055 . . . . 0.0 110.852 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 17.9 tpt180 -146.91 149.63 33.6 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 125.086 1.354 . . . . 0.0 111.494 179.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 76.65 177.84 45.13 Favored Glycine 0 CA--C 1.54 1.601 0 C-N-CA 124.615 1.102 . . . . 0.0 114.728 179.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 71.3 p -81.38 155.02 26.14 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.027 1.331 . . . . 0.0 113.239 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 32.4 p80 -138.48 6.97 2.55 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 114.987 1.477 . . . . 0.0 114.987 -173.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 56.2 t-80 -130.32 136.81 49.52 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.907 1.283 . . . . 0.0 112.214 -177.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 63.6 m80 -145.24 154.79 42.75 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.971 1.708 . . . . 0.0 111.358 -177.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 58.1 t-80 -148.31 142.2 25.77 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.586 1.154 . . . . 0.0 112.157 177.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 77.7 t60 -156.75 147.86 22.04 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.859 1.264 . . . . 0.0 112.647 177.462 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 24.9 m170 -139.13 132.39 29.91 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.964 1.706 . . . . 0.0 110.209 164.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -113.37 -1.14 24.9 Favored Glycine 0 CA--C 1.538 1.469 0 N-CA-C 116.613 1.405 . . . . 0.0 116.613 -171.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 78.8 p -146.49 153.1 40.03 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 119.401 1.6 . . . . 0.0 114.153 -172.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.8 p -156.4 148.11 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 126.263 1.825 . . . . 0.0 110.718 175.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 79.2 p -150.87 151.69 32.59 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.81 1.244 . . . . 0.0 112.552 174.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 38.6 t80 -153.9 155.87 36.5 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.082 1.353 . . . . 0.0 111.739 176.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -77.1 172.83 55.08 Favored Glycine 0 CA--C 1.539 1.568 0 C-N-CA 124.411 1.005 . . . . 0.0 114.801 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -148.13 148.42 29.41 Favored Pre-proline 0 CA--C 1.551 1.007 0 C-N-CA 125.076 1.35 . . . . 0.0 111.826 174.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -74.53 118.33 5.29 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 123.247 2.632 . . . . 0.0 111.708 178.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 68.6 m -139.2 61.63 21.67 Favored Pre-proline 0 N--CA 1.476 0.856 0 C-N-CA 125.068 1.347 . . . . 0.0 111.92 -179.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -66.22 126.39 15.63 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 123.2 2.6 . . . . 0.0 111.904 -178.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 21.9 tp -141.58 -3.35 1.16 Allowed 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 124.524 1.13 . . . . 0.0 113.963 -175.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 21.4 m -64.59 138.35 58.35 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.482 1.113 . . . . 0.0 113.202 -173.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 65.4 p -90.94 -16.56 27.87 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -178.565 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.1 pp20? -77.82 160.84 28.07 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 124.499 1.12 . . . . 0.0 113.6 179.198 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 81.4 p -122.05 20.73 10.68 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 125.816 1.646 . . . . 0.0 114.074 -170.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 60.64 -7.92 0.07 Allowed 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 127.805 2.442 . . . . 0.0 116.391 -170.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -64.19 -25.49 68.1 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 120.858 -1.151 . . . . 0.0 113.998 -177.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -92.67 -11.16 34.83 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.229 1.412 . . . . 0.0 114.604 176.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 44.7 mm -83.7 96.93 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 124.305 1.042 . . . . 0.0 110.031 -173.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 26.9 m-80 -106.37 -18.56 13.95 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.733 1.213 . . . . 0.0 113.724 -177.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 89.5 m-85 -140.86 157.85 44.8 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.746 1.618 . . . . 0.0 111.417 -177.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 44.2 tpp -144.84 -42.83 0.24 Allowed 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 177.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 21.1 p -130.46 59.26 44.38 Favored Pre-proline 0 N--CA 1.481 1.078 0 C-N-CA 125.23 1.412 . . . . 0.0 112.719 -177.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_endo -64.92 156.44 62.28 Favored 'Trans proline' 0 CA--C 1.55 1.308 0 C-N-CA 123.108 2.539 . . . . 0.0 112.515 176.331 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -69.13 149.13 70.57 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 123.481 2.787 . . . . 0.0 113.041 -178.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -140.0 13.5 2.45 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 114.394 1.257 . . . . 0.0 114.394 -175.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 61.1 tt0 -63.67 -29.63 70.84 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 120.899 -1.126 . . . . 0.0 113.782 -168.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -86.78 -10.77 52.81 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.204 1.001 . . . . 0.0 113.366 179.079 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -81.62 40.77 0.6 Allowed 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.344 1.458 . . . . 0.0 113.635 -172.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -148.28 69.34 10.57 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 125.449 1.5 . . . . 0.0 110.096 -177.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -81.03 -17.27 9.48 Favored 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 122.899 2.399 . . . . 0.0 114.198 -170.12 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 69.93 22.18 76.99 Favored Glycine 0 CA--C 1.537 1.443 0 N-CA-C 115.348 0.899 . . . . 0.0 115.348 173.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -142.92 154.2 43.85 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.301 1.44 . . . . 0.0 112.326 -176.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -122.99 170.5 10.07 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 127.082 2.153 . . . . 0.0 112.324 179.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -131.44 139.5 49.4 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.343 1.057 . . . . 0.0 113.217 178.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -91.24 163.47 14.23 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.642 1.577 . . . . 0.0 111.408 165.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 96.7 mt -136.64 157.18 47.38 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 125.147 1.379 . . . . 0.0 112.18 -176.337 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 84.8 m-70 -80.82 144.13 32.28 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.681 0.792 . . . . 0.0 109.906 162.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -109.01 -6.11 15.79 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.631 1.345 . . . . 0.0 114.631 -173.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -147.54 164.59 32.94 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.904 1.282 . . . . 0.0 112.917 -175.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 69.23 -161.77 52.07 Favored Glycine 0 CA--C 1.541 1.681 0 C-N-CA 123.888 0.756 . . . . 0.0 113.892 -179.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -68.09 -15.93 43.89 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 123.212 2.608 . . . . 0.0 113.752 -177.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 81.3 mt -92.49 4.2 53.98 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.815 1.246 . . . . 0.0 113.924 175.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.27 113.27 1.87 Allowed 'General case' 0 CA--C 1.548 0.893 0 CA-C-N 121.048 1.749 . . . . 0.0 111.807 -179.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.32 9.76 62.95 Favored Glycine 0 CA--C 1.542 1.743 0 C-N-CA 125.179 1.371 . . . . 0.0 115.676 -173.263 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 5.3 mp -111.84 156.56 41.46 Favored Pre-proline 0 CA--C 1.556 1.19 0 C-N-CA 126.911 2.084 . . . . 0.0 111.545 178.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -63.17 162.21 27.38 Favored 'Trans proline' 0 C--N 1.356 0.921 0 C-N-CA 125.056 3.837 . . . . 0.0 114.33 -172.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 8.2 t -105.5 -30.04 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 123.666 0.786 . . . . 0.0 111.824 172.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 26.6 p -126.9 170.71 11.96 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 125.087 1.355 . . . . 0.0 114.237 -178.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 42.9 ttm-85 -60.37 -41.4 93.65 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.011 0.924 . . . . 0.0 110.848 172.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 28.4 m -60.47 -45.45 93.69 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.903 0.881 . . . . 0.0 111.017 173.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -59.78 -49.32 78.19 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 118.443 0.565 . . . . 0.0 110.9 175.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.03 -43.73 98.46 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.633 0.773 . . . . 0.0 112.637 -177.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 73.0 ttt180 -68.91 -40.94 78.8 Favored 'General case' 0 N--CA 1.478 0.935 0 O-C-N 121.213 -0.929 . . . . 0.0 112.497 178.1 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 77.3 t -64.76 -42.22 94.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 CA-C-N 118.365 0.529 . . . . 0.0 111.192 175.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 87.4 mt -65.54 -41.56 92.9 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 118.179 -0.915 . . . . 0.0 112.541 176.267 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 47.7 mt -53.65 -50.89 47.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 CA-C-N 119.368 0.986 . . . . 0.0 109.729 169.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -64.19 -46.63 83.1 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 113.255 0.835 . . . . 0.0 113.255 -178.241 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -69.96 -44.41 69.56 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.136 0.975 . . . . 0.0 112.598 -176.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -61.04 -52.11 66.36 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 118.554 -0.736 . . . . 0.0 110.117 172.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.411 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 61.7 t90 -56.06 -46.44 78.93 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-N 119.452 1.024 . . . . 0.0 112.126 177.004 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -51.75 -55.36 20.13 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 119.72 1.145 . . . . 0.0 112.459 176.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -74.25 -42.97 58.81 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 121.137 -0.977 . . . . 0.0 112.822 -175.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 35.7 mmt180 -57.29 -45.34 84.21 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.296 0.638 . . . . 0.0 109.835 174.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.9 tmtt? -69.72 -32.18 70.6 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.106 0.962 . . . . 0.0 113.516 178.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 66.4 mttt -61.89 -31.14 71.4 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 119.761 1.164 . . . . 0.0 111.715 167.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 70.6 m -81.82 -24.21 36.01 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 115.14 1.533 . . . . 0.0 115.14 165.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -142.49 78.97 15.86 Favored Pre-proline 0 CA--C 1.55 0.949 0 C-N-CA 126.819 2.048 . . . . 0.0 111.561 -166.136 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -62.21 -5.08 5.97 Favored 'Trans proline' 0 CA--C 1.547 1.161 0 C-N-CA 123.707 2.938 . . . . 0.0 116.566 -167.005 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 39.5 p90 -88.04 -3.53 58.89 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.815 2.046 . . . . 0.0 115.065 175.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.84 141.82 43.3 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-N 119.96 1.255 . . . . 0.0 113.447 -177.634 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 1.9 mpp_? -103.24 153.82 19.99 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 125.255 1.422 . . . . 0.0 112.412 174.301 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.411 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.3 tm? -127.37 128.11 45.32 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.837 1.655 . . . . 0.0 110.264 -173.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 58.4 t0 -143.25 128.7 19.01 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.355 1.062 . . . . 0.0 110.956 179.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 65.3 mtt -127.47 10.76 6.75 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.459 1.504 . . . . 0.0 113.127 -177.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 72.6 m -68.14 152.44 45.48 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 121.42 -0.8 . . . . 0.0 111.383 172.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -57.21 -34.58 68.68 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -166.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 33.7 mmtp -59.12 -37.28 76.83 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.002 0.921 . . . . 0.0 112.484 177.03 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.38 -37.25 82.7 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.546 0.739 . . . . 0.0 111.844 173.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 2.5 mm -75.18 -44.0 43.69 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 C-N-CA 123.374 0.67 . . . . 0.0 109.396 -175.31 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 10.2 m-30 -60.86 -45.39 94.72 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 123.088 0.555 . . . . 0.0 112.106 174.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 6.5 tmm_? -74.15 -35.14 64.05 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.126 0.971 . . . . 0.0 112.52 -173.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 73.4 mtp85 -74.78 -40.61 61.07 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.702 0.801 . . . . 0.0 112.564 170.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 34.3 m-85 -130.3 77.38 76.29 Favored Pre-proline 0 CA--C 1.545 0.785 0 C-N-CA 125.594 1.558 . . . . 0.0 111.266 -169.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -66.51 -16.85 52.31 Favored 'Trans proline' 0 CA--C 1.539 0.767 0 C-N-CA 123.077 2.518 . . . . 0.0 113.979 -173.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 12.1 p-80 -74.05 -22.39 59.56 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.278 1.031 . . . . 0.0 113.495 172.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.47 -19.57 27.8 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 125.986 1.715 . . . . 0.0 112.753 -172.584 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 . . . . . 0 C--O 1.256 1.411 0 C-N-CA 124.625 1.17 . . . . 0.0 112.202 174.738 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 59.8 ttm . . . . . 0 N--CA 1.496 1.833 0 CA-C-O 119.793 -0.146 . . . . 0.0 110.741 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 39.2 ptt85 -135.19 146.74 49.0 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 125.187 1.395 . . . . 0.0 112.487 175.533 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -82.86 -21.66 59.1 Favored Glycine 0 CA--C 1.536 1.373 0 C-N-CA 124.243 0.925 . . . . 0.0 113.958 173.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 45.1 m -82.71 119.37 24.24 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.611 1.164 . . . . 0.0 112.319 -177.01 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 14.0 p80 -154.54 155.76 35.39 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.89 1.676 . . . . 0.0 111.198 168.385 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 71.7 m80 -87.81 67.8 9.21 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.854 1.262 . . . . 0.0 112.11 -172.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 55.9 t-80 -64.79 138.73 58.56 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.876 0.87 . . . . 0.0 112.756 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 6.8 p80 -153.64 161.94 41.7 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.041 1.736 . . . . 0.0 110.846 173.149 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 21.3 p80 -69.16 145.72 53.05 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -178.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 41.7 t60 -140.17 34.46 1.91 Allowed 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.323 1.049 . . . . 0.0 112.803 -172.118 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -67.76 151.96 52.34 Favored Glycine 0 CA--C 1.538 1.471 0 C-N-CA 124.087 0.851 . . . . 0.0 113.55 178.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 88.6 p -147.67 158.79 44.17 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.183 1.393 . . . . 0.0 112.79 -179.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.3 p -150.89 148.51 14.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 125.391 1.476 . . . . 0.0 111.027 178.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.2 t -148.18 141.74 25.44 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.623 1.169 . . . . 0.0 111.668 175.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -152.3 154.51 35.83 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.713 1.605 . . . . 0.0 110.912 176.416 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 173.62 -154.81 20.84 Favored Glycine 0 CA--C 1.534 1.276 0 C-N-CA 123.702 0.668 . . . . 0.0 114.148 -178.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . 50.71 56.43 17.23 Favored Pre-proline 0 CA--C 1.557 1.243 0 C-N-CA 126.323 1.849 . . . . 0.0 114.981 -179.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -66.75 159.44 51.26 Favored 'Trans proline' 0 CA--C 1.544 0.981 0 C-N-CA 123.242 2.628 . . . . 0.0 112.328 174.346 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 37.3 p -136.57 56.78 14.33 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 124.835 1.254 . . . . 0.0 113.863 -173.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -64.67 143.29 80.44 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 123.208 2.605 . . . . 0.0 112.233 177.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 58.2 tp -153.34 142.65 21.55 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.86 1.264 . . . . 0.0 111.715 -177.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 66.5 p -145.57 140.69 27.6 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.201 1.4 . . . . 0.0 111.354 168.125 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.4 m -141.02 13.22 2.24 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 -169.045 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -148.1 156.35 42.51 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.672 1.189 . . . . 0.0 113.466 -170.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 19.4 t -154.55 148.39 25.54 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.471 1.508 . . . . 0.0 111.156 175.014 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 56.95 24.25 9.19 Favored 'General case' 0 CA--C 1.552 1.019 0 C-N-CA 125.676 1.59 . . . . 0.0 114.712 178.114 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -75.7 -24.8 56.26 Favored 'General case' 0 N--CA 1.475 0.799 0 O-C-N 120.816 -1.177 . . . . 0.0 113.918 -174.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -130.93 6.0 4.6 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.624 1.57 . . . . 0.0 114.693 -175.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 53.8 mt -81.27 103.94 9.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 O-C-N 121.278 -0.889 . . . . 0.0 109.746 -176.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 59.5 t-20 -150.15 130.34 13.62 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.582 1.553 . . . . 0.0 110.486 177.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 35.1 t80 -104.42 -5.49 21.62 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.024 1.33 . . . . 0.0 113.851 -179.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 93.7 mtp -80.65 -3.93 52.36 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 114.684 1.365 . . . . 0.0 114.684 -170.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.5 t -120.08 111.63 35.35 Favored Pre-proline 0 N--CA 1.476 0.869 0 C-N-CA 124.849 1.26 . . . . 0.0 111.616 -179.302 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -85.12 162.2 11.55 Favored 'Trans proline' 0 CA--C 1.549 1.252 0 C-N-CA 123.703 2.935 . . . . 0.0 112.851 -179.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -82.74 14.67 2.25 Favored 'Trans proline' 0 CA--C 1.548 1.214 0 C-N-CA 124.443 3.429 . . . . 0.0 114.788 -175.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -68.21 -23.9 64.88 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 114.76 1.393 . . . . 0.0 114.76 -169.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -152.13 145.22 24.56 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.412 1.485 . . . . 0.0 111.238 177.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 31.0 mp0 -68.89 -46.19 68.99 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.088 0.955 . . . . 0.0 112.343 -178.317 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 50.07 37.72 15.0 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 126.013 1.725 . . . . 0.0 115.08 170.034 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 61.7 tt0 -154.65 75.65 5.62 Favored Pre-proline 0 CA--C 1.547 0.837 0 C-N-CA 124.758 1.223 . . . . 0.0 109.697 -173.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -81.16 -16.58 9.68 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 122.585 2.19 . . . . 0.0 114.147 -167.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 66.75 32.57 81.65 Favored Glycine 0 CA--C 1.537 1.407 0 N-CA-C 115.42 0.928 . . . . 0.0 115.42 167.106 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -134.16 152.69 51.95 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.211 1.404 . . . . 0.0 112.474 -175.208 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -96.87 168.45 10.48 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 126.383 1.873 . . . . 0.0 112.323 172.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -118.17 123.66 46.07 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.332 1.053 . . . . 0.0 112.032 173.376 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -84.61 144.05 28.86 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.437 1.095 . . . . 0.0 110.7 166.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.4 mt -128.05 157.55 40.38 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.408 1.083 . . . . 0.0 112.441 -169.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -78.07 138.72 38.91 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.896 0.879 . . . . 0.0 110.044 166.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -94.09 -22.75 18.3 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 114.321 1.23 . . . . 0.0 114.321 -175.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -140.68 165.91 26.19 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.99 1.316 . . . . 0.0 112.855 -170.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.37 -163.14 54.81 Favored Glycine 0 CA--C 1.54 1.599 0 C-N-CA 124.247 0.927 . . . . 0.0 114.201 177.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -67.49 -17.08 48.62 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 123.314 2.676 . . . . 0.0 113.754 -176.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.5 mt -93.94 5.0 53.1 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.662 1.185 . . . . 0.0 113.782 175.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.32 123.69 14.64 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 120.936 1.698 . . . . 0.0 112.282 -177.06 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 82.58 3.04 90.68 Favored Glycine 0 CA--C 1.541 1.664 0 C-N-CA 125.631 1.586 . . . . 0.0 115.321 -174.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 18.0 mt -102.1 161.63 22.8 Favored Pre-proline 0 CA--C 1.556 1.184 0 C-N-CA 126.057 1.743 . . . . 0.0 111.087 -179.214 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -77.06 156.65 34.05 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 124.208 3.272 . . . . 0.0 113.837 -164.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 39.2 t -94.73 -35.73 6.37 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 O-C-N 121.569 -0.707 . . . . 0.0 112.82 176.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 19.9 p -123.44 172.67 8.53 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 125.229 1.412 . . . . 0.0 114.017 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 47.7 ttp180 -64.7 -36.43 84.26 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 121.11 -0.994 . . . . 0.0 110.97 174.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 30.4 m -60.53 -44.27 96.25 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.476 0.71 . . . . 0.0 110.937 170.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 -63.19 -43.67 97.56 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.48 -0.762 . . . . 0.0 111.74 176.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.6 -41.45 96.22 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 118.79 0.723 . . . . 0.0 112.743 177.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 22.9 tpp85 -61.75 -45.89 91.98 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.096 1.359 . . . . 0.0 111.762 175.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 73.4 t -65.08 -44.14 95.76 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 123.705 0.802 . . . . 0.0 111.11 177.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 17.9 mt -56.46 -49.71 73.81 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 118.603 -0.713 . . . . 0.0 111.997 173.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 51.8 mt -54.24 -52.05 42.02 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 CA-C-N 118.573 0.624 . . . . 0.0 110.322 176.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 22.5 t80 -66.6 -47.19 73.45 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -177.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -68.33 -45.47 72.82 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 118.722 0.692 . . . . 0.0 112.244 -177.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 58.1 mm-40 -60.51 -51.4 69.62 Favored 'General case' 0 C--N 1.342 0.248 0 CA-C-O 118.38 -0.819 . . . . 0.0 109.926 174.278 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.418 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 67.5 t90 -56.6 -43.61 80.3 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 119.797 1.18 . . . . 0.0 112.598 177.63 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -59.04 -49.64 77.1 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 119.849 1.204 . . . . 0.0 113.109 177.009 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -71.56 -46.31 59.78 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 119.673 1.124 . . . . 0.0 112.471 -179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 33.4 mmt180 -58.8 -44.6 90.83 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.752 0.821 . . . . 0.0 109.721 176.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 74.5 tttt -70.8 -29.41 65.59 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 176.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -59.47 -35.2 73.64 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 119.922 1.237 . . . . 0.0 110.857 166.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 8.4 t -78.22 -32.9 50.12 Favored 'General case' 0 CA--C 1.553 1.088 0 N-CA-C 114.617 1.34 . . . . 0.0 114.617 167.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -132.97 77.82 67.22 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 127.196 2.198 . . . . 0.0 112.198 -166.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -63.9 5.79 0.34 Allowed 'Trans proline' 0 CA--C 1.549 1.247 0 C-N-CA 124.697 3.598 . . . . 0.0 117.532 -165.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 31.2 p90 -99.78 -6.01 27.67 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 127.306 2.242 . . . . 0.0 114.806 177.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 13.1 tp -65.77 139.51 58.35 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 115.224 1.565 . . . . 0.0 115.224 -167.011 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 11.6 ptp85 -90.02 157.74 17.67 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 125.834 1.653 . . . . 0.0 113.788 176.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.418 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.4 tm? -137.95 130.95 30.13 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 126.935 2.094 . . . . 0.0 109.924 -172.348 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -142.03 136.65 30.45 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.288 1.035 . . . . 0.0 110.632 172.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 61.9 mtt -123.61 5.76 8.89 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.912 1.285 . . . . 0.0 114.268 -172.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 35.0 t -63.74 148.22 49.7 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 119.011 0.823 . . . . 0.0 111.557 178.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -53.82 -31.86 50.76 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 121.202 -0.937 . . . . 0.0 112.813 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 53.8 tptt -54.93 -41.24 70.78 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.956 1.302 . . . . 0.0 112.623 172.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.68 -36.41 83.77 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.159 0.983 . . . . 0.0 112.263 176.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.9 mp -74.35 -46.51 43.6 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 C-N-CA 124.185 0.994 . . . . 0.0 109.458 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -56.43 -44.74 80.69 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 119.076 0.853 . . . . 0.0 112.132 174.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.3 tmt_? -72.4 -40.55 67.12 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 124.576 1.15 . . . . 0.0 112.26 -174.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 73.4 mtt85 -72.04 -38.75 69.46 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 173.091 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -131.48 79.39 69.54 Favored Pre-proline 0 CA--C 1.545 0.753 0 C-N-CA 125.584 1.553 . . . . 0.0 110.822 -166.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -66.85 -16.05 48.88 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 123.064 2.509 . . . . 0.0 113.986 -173.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 12.1 p-80 -73.49 -23.94 60.11 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.052 0.941 . . . . 0.0 113.134 172.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.44 -27.99 37.83 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.579 1.552 . . . . 0.0 112.3 -173.201 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 51.8 ttt85 . . . . . 0 C--O 1.255 1.359 0 C-N-CA 124.69 1.196 . . . . 0.0 112.288 175.357 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.9 ptt? . . . . . 0 N--CA 1.498 1.96 0 CA-C-O 121.043 0.449 . . . . 0.0 111.786 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -150.67 164.18 36.73 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.944 1.298 . . . . 0.0 112.883 178.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 83.01 154.57 16.52 Favored Glycine 0 CA--C 1.537 1.434 0 C-N-CA 125.24 1.4 . . . . 0.0 114.412 179.094 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 66.5 m -145.15 160.96 40.62 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 125.798 1.639 . . . . 0.0 112.15 -175.046 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 63.9 m80 -128.57 152.45 48.3 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.531 1.532 . . . . 0.0 111.352 175.233 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 34.6 p-80 -136.62 175.86 9.22 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.388 1.475 . . . . 0.0 113.402 -168.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 45.3 t60 55.87 48.46 18.01 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 125.849 1.66 . . . . 0.0 113.842 177.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 93.4 m-70 -77.76 -20.66 53.03 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.27 1.028 . . . . 0.0 113.642 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 51.3 m80 -78.11 140.32 39.05 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.104 1.362 . . . . 0.0 113.055 -170.487 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 21.4 p80 -153.89 160.62 42.22 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.445 1.498 . . . . 0.0 111.565 174.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 162.48 164.5 17.6 Favored Glycine 0 CA--C 1.535 1.297 0 C-N-CA 124.069 0.842 . . . . 0.0 114.123 176.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.6 t -152.89 154.66 35.52 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 125.507 1.523 . . . . 0.0 111.088 174.131 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 9.7 p -83.73 143.77 11.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 124.444 1.098 . . . . 0.0 112.02 -178.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 50.4 m -79.44 152.94 30.02 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.04 0.936 . . . . 0.0 112.379 175.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -124.55 146.8 48.81 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.937 1.295 . . . . 0.0 111.566 176.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 72.56 177.19 30.65 Favored Glycine 0 CA--C 1.539 1.546 0 C-N-CA 123.993 0.806 . . . . 0.0 113.73 -169.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -149.27 151.32 33.66 Favored Pre-proline 0 CA--C 1.55 0.952 0 C-N-CA 125.033 1.333 . . . . 0.0 111.929 179.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.48 149.33 68.54 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 123.209 2.606 . . . . 0.0 112.219 175.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 49.8 m -75.01 147.58 83.76 Favored Pre-proline 0 N--CA 1.474 0.728 0 C-N-CA 123.921 0.888 . . . . 0.0 112.791 -178.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -71.06 164.82 34.43 Favored 'Trans proline' 0 CA--C 1.543 0.95 0 C-N-CA 123.522 2.815 . . . . 0.0 112.322 172.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.3 tt -136.34 127.71 28.4 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.975 1.31 . . . . 0.0 110.836 178.159 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 31.2 m -139.8 29.71 2.1 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.286 1.435 . . . . 0.0 112.591 -173.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.5 m -74.39 -10.07 59.21 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 115.921 1.823 . . . . 0.0 115.921 -164.076 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -129.08 136.09 49.78 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.939 1.296 . . . . 0.0 111.884 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 81.7 p -158.54 166.66 31.61 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.425 1.49 . . . . 0.0 112.575 -177.361 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 61.12 21.35 11.76 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 115.35 1.611 . . . . 0.0 115.35 172.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -74.45 -19.61 60.33 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 120.769 -1.207 . . . . 0.0 114.158 -175.009 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -137.89 13.37 2.9 Favored 'General case' 0 CA--C 1.553 1.058 0 C-N-CA 125.416 1.486 . . . . 0.0 113.41 -177.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 44.8 mm -100.03 136.77 29.93 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.816 1.247 . . . . 0.0 111.796 -171.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 54.3 t30 58.15 49.06 11.94 Favored 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 126.207 1.803 . . . . 0.0 114.679 174.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -114.55 29.35 8.09 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.295 1.438 . . . . 0.0 113.169 175.168 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 1.5 pmm? -130.1 153.15 48.78 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 126.064 1.746 . . . . 0.0 112.607 -179.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 18.3 p -137.57 65.35 47.5 Favored Pre-proline 0 N--CA 1.481 1.104 0 C-N-CA 125.173 1.389 . . . . 0.0 112.685 -170.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -63.66 156.14 59.04 Favored 'Trans proline' 0 CA--C 1.549 1.274 0 C-N-CA 123.039 2.492 . . . . 0.0 112.646 174.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -74.18 119.39 5.79 Favored 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 123.27 2.647 . . . . 0.0 112.304 -176.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -138.45 144.82 40.28 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.656 1.582 . . . . 0.0 111.55 179.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 82.6 mt-30 -131.25 15.23 5.09 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 124.819 1.248 . . . . 0.0 113.488 -178.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 55.52 29.89 14.2 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 125.544 1.538 . . . . 0.0 113.895 -175.44 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -130.38 69.59 1.45 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.11 1.764 . . . . 0.0 110.709 -174.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -146.25 73.66 13.09 Favored Pre-proline 0 CA--C 1.545 0.778 0 C-N-CA 125.254 1.422 . . . . 0.0 109.129 -178.127 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -81.28 73.93 5.7 Favored 'Trans proline' 0 CA--C 1.542 0.912 0 C-N-CA 123.973 3.116 . . . . 0.0 110.8 -171.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 92.58 151.63 27.91 Favored Glycine 0 CA--C 1.538 1.491 0 C-N-CA 125.423 1.487 . . . . 0.0 112.253 -163.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -125.46 21.71 7.81 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.971 1.308 . . . . 0.0 113.894 -169.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -72.79 154.9 40.44 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.997 1.319 . . . . 0.0 111.348 176.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -143.16 151.51 40.74 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.406 1.483 . . . . 0.0 112.804 175.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -95.23 150.52 20.14 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.981 1.312 . . . . 0.0 112.137 173.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 91.5 mt -130.43 157.62 42.11 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.623 1.569 . . . . 0.0 111.675 -179.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -79.06 141.26 37.55 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.102 0.961 . . . . 0.0 110.463 168.004 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -100.25 -11.85 20.02 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 -173.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -149.41 167.83 25.08 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.791 1.236 . . . . 0.0 113.233 -172.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.41 -163.62 54.11 Favored Glycine 0 CA--C 1.54 1.647 0 C-N-CA 124.16 0.886 . . . . 0.0 114.014 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -67.64 -16.56 46.97 Favored 'Trans proline' 0 CA--C 1.542 0.882 0 C-N-CA 123.262 2.642 . . . . 0.0 113.686 -177.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.0 mt -92.89 4.66 53.51 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.702 1.201 . . . . 0.0 113.873 175.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.63 122.62 11.76 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 120.874 1.67 . . . . 0.0 112.016 -177.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.2 5.06 89.35 Favored Glycine 0 CA--C 1.541 1.704 0 C-N-CA 125.399 1.476 . . . . 0.0 115.404 -174.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 18.7 mt -104.74 159.07 30.55 Favored Pre-proline 0 CA--C 1.556 1.177 0 C-N-CA 126.227 1.811 . . . . 0.0 111.263 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -79.38 160.12 25.89 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 124.523 3.482 . . . . 0.0 113.805 -164.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 19.1 t -102.36 -33.15 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 N-CA-C 113.381 0.882 . . . . 0.0 113.381 -175.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 19.7 p -123.44 171.28 9.59 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 114.3 1.222 . . . . 0.0 114.3 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 46.3 ttt180 -61.83 -40.14 94.24 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 124.356 1.063 . . . . 0.0 110.767 177.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 31.4 m -63.6 -44.42 94.06 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 124.683 1.193 . . . . 0.0 111.552 171.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 78.5 m-20 -60.1 -47.0 87.72 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.007 0.821 . . . . 0.0 110.993 174.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.66 -39.56 91.82 Favored 'General case' 0 CA--C 1.541 0.596 0 O-C-N 121.405 -0.81 . . . . 0.0 112.575 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 78.9 ttt180 -64.49 -43.66 93.46 Favored 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 119.24 0.927 . . . . 0.0 112.344 172.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 54.9 t -60.62 -49.24 85.25 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 CA-C-N 118.797 0.726 . . . . 0.0 111.182 175.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -62.64 -42.66 99.73 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 118.22 -0.895 . . . . 0.0 112.15 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 56.0 mt -55.86 -51.37 61.1 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 CA-C-N 119.408 1.004 . . . . 0.0 110.471 170.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 20.2 t80 -63.67 -47.63 80.44 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -175.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 12.3 t30 -68.99 -44.07 73.57 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 118.913 0.779 . . . . 0.0 112.169 -179.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -56.21 -53.5 56.46 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 122.701 0.401 . . . . 0.0 110.059 174.285 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.42 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 62.6 t90 -59.37 -46.8 87.64 Favored 'General case' 0 C--O 1.218 -0.587 0 CA-C-O 117.415 -1.278 . . . . 0.0 111.793 177.226 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -55.91 -48.76 75.09 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 120.928 1.694 . . . . 0.0 113.306 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -69.01 -47.4 65.59 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.171 0.896 . . . . 0.0 111.982 179.279 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 38.8 mmm-85 -59.16 -47.63 84.59 Favored 'General case' 0 C--O 1.216 -0.67 0 O-C-N 121.645 -0.659 . . . . 0.0 110.699 177.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 18.9 tptm -62.42 -35.09 78.15 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 126.07 1.748 . . . . 0.0 113.043 176.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 14.9 tmtt? -59.44 -36.82 76.65 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 119.603 1.092 . . . . 0.0 111.126 168.458 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 66.5 m -81.7 -18.34 44.73 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 115.926 1.824 . . . . 0.0 115.926 168.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -140.13 84.07 15.19 Favored Pre-proline 0 N--CA 1.477 0.903 0 C-N-CA 126.603 1.961 . . . . 0.0 111.88 -165.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -62.04 -0.92 1.91 Allowed 'Trans proline' 0 CA--C 1.549 1.256 0 C-N-CA 124.274 3.316 . . . . 0.0 116.598 -171.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 31.3 p90 -98.25 -10.96 23.17 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.667 1.987 . . . . 0.0 115.161 177.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 11.1 tp -66.82 137.73 56.82 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 114.671 1.36 . . . . 0.0 114.671 -166.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 18.6 mmt85 -99.37 159.25 15.15 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 126.05 1.74 . . . . 0.0 112.44 -179.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.42 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.4 tm? -137.07 133.51 35.5 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.573 1.949 . . . . 0.0 109.958 -169.556 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 54.0 t0 -141.43 130.53 23.34 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.186 0.994 . . . . 0.0 111.079 176.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 65.4 mtt -124.47 6.88 8.3 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.259 1.423 . . . . 0.0 113.409 -179.002 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 68.7 m -64.18 147.25 52.76 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 121.496 -0.753 . . . . 0.0 110.547 168.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.4 -26.23 67.71 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 113.526 0.935 . . . . 0.0 113.526 -166.009 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 61.0 mtpt -56.95 -34.79 68.37 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.76 1.224 . . . . 0.0 113.248 172.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.92 -39.69 92.93 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 118.914 0.779 . . . . 0.0 111.613 173.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.6 mp -73.62 -46.13 48.94 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 C-N-CA 124.299 1.039 . . . . 0.0 109.24 -179.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.4 m-30 -55.87 -46.13 78.34 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 119.152 0.887 . . . . 0.0 112.464 175.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.72 -41.59 44.53 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.387 1.075 . . . . 0.0 112.532 -173.087 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 6.9 ttm180 -75.27 -39.81 59.4 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.642 0.777 . . . . 0.0 112.447 176.563 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -124.73 74.58 64.19 Favored Pre-proline 0 CA--C 1.547 0.854 0 C-N-CA 125.999 1.72 . . . . 0.0 111.214 -172.521 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -67.09 -10.25 27.91 Favored 'Trans proline' 0 CA--C 1.538 0.694 0 C-N-CA 123.521 2.814 . . . . 0.0 114.626 -173.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 14.7 p-80 -77.98 -24.55 47.99 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.341 1.056 . . . . 0.0 113.407 172.079 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -77.76 -48.84 15.64 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.292 1.037 . . . . 0.0 112.057 -161.447 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 10.7 mmt180 . . . . . 0 C--O 1.254 1.301 0 C-N-CA 126.442 1.897 . . . . 0.0 112.923 179.633 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 99.5 mtp . . . . . 0 N--CA 1.497 1.921 0 N-CA-C 110.888 -0.041 . . . . 0.0 110.888 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -146.42 160.8 41.6 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 125.165 1.386 . . . . 0.0 113.427 177.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -160.08 16.49 0.21 Allowed Glycine 0 CA--C 1.539 1.557 0 C-N-CA 124.528 1.061 . . . . 0.0 115.461 176.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 79.4 p -83.67 158.51 21.81 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.011 1.325 . . . . 0.0 113.85 -175.072 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 46.8 p-80 -137.95 160.51 39.13 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.557 1.543 . . . . 0.0 111.596 172.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 20.9 t60 -142.98 82.86 1.78 Allowed 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.209 1.004 . . . . 0.0 111.418 -178.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 57.3 t-80 -151.96 144.16 23.95 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.848 1.259 . . . . 0.0 111.665 175.107 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 48.1 p-80 -151.62 146.57 25.92 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.248 1.419 . . . . 0.0 111.51 173.003 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 66.9 t60 -156.91 155.46 31.42 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.237 1.415 . . . . 0.0 111.687 177.097 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 46.7 t-80 -147.47 141.22 25.68 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.975 1.31 . . . . 0.0 111.688 170.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -172.25 31.27 0.12 Allowed Glycine 0 CA--C 1.537 1.425 0 N-CA-C 115.218 0.847 . . . . 0.0 115.218 178.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.2 t -148.51 142.66 26.03 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 118.642 1.221 . . . . 0.0 113.021 -176.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 13.1 p -153.75 142.94 14.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 126.0 1.72 . . . . 0.0 110.271 174.236 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 82.1 p -155.62 159.95 40.04 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.331 1.053 . . . . 0.0 113.366 -178.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 90.7 t80 -148.08 151.37 35.54 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.458 1.503 . . . . 0.0 111.252 170.016 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -179.71 47.33 0.08 OUTLIER Glycine 0 CA--C 1.532 1.156 0 C-N-CA 123.848 0.737 . . . . 0.0 113.772 177.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -129.09 62.11 60.63 Favored Pre-proline 0 CA--C 1.554 1.117 0 C-N-CA 124.429 1.092 . . . . 0.0 113.944 -171.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -69.97 168.74 20.95 Favored 'Trans proline' 0 CA--C 1.545 1.054 0 C-N-CA 123.379 2.72 . . . . 0.0 112.163 169.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 14.8 t -134.88 83.8 39.76 Favored Pre-proline 0 N--CA 1.474 0.764 0 C-N-CA 124.465 1.106 . . . . 0.0 111.316 176.093 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -80.22 64.03 8.82 Favored 'Trans proline' 0 CA--C 1.546 1.115 0 C-N-CA 124.454 3.436 . . . . 0.0 111.475 -179.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -75.77 -6.61 51.45 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 115.784 1.772 . . . . 0.0 115.784 -170.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.2 m -64.11 139.67 58.79 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.633 1.173 . . . . 0.0 113.132 -175.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 77.9 p -133.41 15.05 4.11 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 125.19 1.396 . . . . 0.0 114.291 -171.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -64.03 -27.92 69.45 Favored 'General case' 0 N--CA 1.476 0.871 0 O-C-N 120.901 -1.125 . . . . 0.0 113.691 -171.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 31.1 p -79.84 -45.89 17.89 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.579 1.151 . . . . 0.0 112.214 171.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 57.8 mt-10 -60.21 -27.0 66.82 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.78 1.232 . . . . 0.0 112.868 179.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -67.37 -14.18 62.69 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.018 1.327 . . . . 0.0 114.239 175.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -135.54 -3.28 2.37 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 115.624 1.713 . . . . 0.0 115.624 179.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 91.8 mt -123.4 115.29 45.01 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 125.987 1.715 . . . . 0.0 109.642 176.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -87.48 51.15 2.15 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 124.831 1.252 . . . . 0.0 111.188 177.77 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 56.26 24.4 8.15 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 126.55 1.94 . . . . 0.0 115.779 177.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 14.5 ttt -136.02 20.36 3.24 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.761 1.225 . . . . 0.0 113.722 -170.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 16.7 m -128.46 80.8 71.84 Favored Pre-proline 0 N--CA 1.482 1.147 0 C-N-CA 124.209 1.003 . . . . 0.0 110.899 -176.06 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -71.53 159.56 50.91 Favored 'Trans proline' 0 CA--C 1.548 1.185 0 C-N-CA 123.391 2.727 . . . . 0.0 112.374 175.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -69.35 153.82 70.24 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 123.434 2.756 . . . . 0.0 112.755 176.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -132.29 10.98 4.53 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 114.537 1.31 . . . . 0.0 114.537 -175.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 31.0 tt0 -77.89 -27.88 49.75 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 113.547 0.943 . . . . 0.0 113.547 -174.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 60.78 -28.25 0.05 OUTLIER 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 128.838 2.855 . . . . 0.0 117.095 -177.071 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 52.75 37.6 24.21 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 126.782 2.033 . . . . 0.0 115.296 172.092 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -143.86 51.02 1.43 Allowed Pre-proline 0 CA--C 1.555 1.136 0 C-N-CA 124.888 1.275 . . . . 0.0 113.383 -178.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -76.88 164.82 29.43 Favored 'Trans proline' 0 CA--C 1.544 0.984 0 C-N-CA 123.699 2.933 . . . . 0.0 114.4 -170.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 87.76 148.18 14.41 Favored Glycine 0 CA--C 1.538 1.478 0 C-N-CA 125.545 1.545 . . . . 0.0 115.906 168.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -150.6 143.3 24.54 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.145 1.778 . . . . 0.0 110.989 173.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -124.55 158.03 33.96 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 125.575 1.55 . . . . 0.0 111.597 -177.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -128.16 124.54 37.11 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.006 1.322 . . . . 0.0 111.34 168.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -84.36 143.71 29.3 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.318 1.047 . . . . 0.0 111.22 170.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 58.3 mt -126.88 157.46 39.3 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.718 1.207 . . . . 0.0 112.629 -170.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -79.41 137.47 37.28 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.01 0.924 . . . . 0.0 110.24 166.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -93.74 -16.9 23.74 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 -174.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -150.65 170.31 19.49 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.772 1.229 . . . . 0.0 113.005 -172.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.59 -163.99 54.79 Favored Glycine 0 CA--C 1.54 1.655 0 C-N-CA 124.155 0.883 . . . . 0.0 114.049 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -67.58 -17.11 48.2 Favored 'Trans proline' 0 CA--C 1.542 0.882 0 C-N-CA 123.265 2.643 . . . . 0.0 113.752 -176.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.7 mt -95.32 6.89 47.8 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.699 1.199 . . . . 0.0 113.834 175.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -54.7 123.46 13.34 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 120.853 1.66 . . . . 0.0 112.442 -176.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 81.63 3.0 90.72 Favored Glycine 0 CA--C 1.54 1.625 0 C-N-CA 125.577 1.561 . . . . 0.0 115.387 -175.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 19.0 mt -100.57 161.21 24.68 Favored Pre-proline 0 CA--C 1.555 1.144 0 C-N-CA 126.062 1.745 . . . . 0.0 111.0 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -75.24 157.24 41.87 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 124.197 3.265 . . . . 0.0 113.63 -165.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 52.0 t -92.5 -36.27 7.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 O-C-N 121.434 -0.791 . . . . 0.0 112.719 175.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 16.4 p -122.41 172.36 8.39 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 124.999 1.319 . . . . 0.0 114.496 -178.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 34.6 ptt-85 -63.48 -34.4 77.69 Favored 'General case' 0 N--CA 1.483 1.193 0 O-C-N 121.298 -0.876 . . . . 0.0 112.26 172.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 17.7 t -66.4 -44.96 81.57 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.16 0.584 . . . . 0.0 110.605 171.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -60.4 -43.16 96.94 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.619 -0.676 . . . . 0.0 111.397 175.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.47 -43.97 97.53 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.775 0.83 . . . . 0.0 112.78 176.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 60.3 ttp180 -65.34 -41.75 93.6 Favored 'General case' 0 N--CA 1.477 0.917 0 O-C-N 121.341 -0.849 . . . . 0.0 112.233 177.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 71.0 t -63.73 -45.0 98.52 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 C-N-CA 123.65 0.78 . . . . 0.0 111.073 175.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 21.4 mt -58.61 -48.96 79.22 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 118.56 -0.733 . . . . 0.0 112.335 174.148 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 57.2 mt -54.2 -51.12 50.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-N 118.598 0.636 . . . . 0.0 109.915 176.232 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -64.17 -50.65 67.33 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.856 0.687 . . . . 0.0 112.856 -177.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -66.46 -45.79 78.58 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 119.193 0.906 . . . . 0.0 112.395 -177.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -62.2 -45.83 91.6 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 119.135 -0.459 . . . . 0.0 110.505 178.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 68.6 t90 -60.09 -46.58 89.12 Favored 'General case' 0 C--O 1.217 -0.617 0 CA-C-O 117.506 -1.235 . . . . 0.0 111.953 172.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -57.35 -45.15 84.64 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 121.149 1.795 . . . . 0.0 113.042 179.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -69.53 -50.02 48.94 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 119.559 1.072 . . . . 0.0 112.187 178.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -56.64 -49.74 74.11 Favored 'General case' 0 C--O 1.216 -0.672 0 O-C-N 121.789 -0.569 . . . . 0.0 110.602 176.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.9 tmtt? -66.44 -30.92 71.38 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.664 1.586 . . . . 0.0 113.634 179.271 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 2.4 tmpt? -58.73 -37.92 77.22 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 120.015 1.279 . . . . 0.0 110.756 165.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 51.5 m -83.03 -16.94 45.07 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 115.575 1.694 . . . . 0.0 115.575 169.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -142.91 72.11 18.99 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 127.328 2.251 . . . . 0.0 111.194 -166.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -61.56 -6.26 6.87 Favored 'Trans proline' 0 CA--C 1.548 1.185 0 C-N-CA 123.921 3.081 . . . . 0.0 116.545 -165.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 38.9 p90 -86.13 -9.78 56.02 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 126.76 2.024 . . . . 0.0 115.032 174.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.6 tp -65.76 138.06 57.68 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 114.762 1.393 . . . . 0.0 114.762 -165.463 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 82.0 mtp180 -84.26 155.23 22.55 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 125.737 1.615 . . . . 0.0 112.997 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -138.52 129.87 27.34 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 126.608 1.963 . . . . 0.0 109.947 -173.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 50.8 t0 -147.4 131.54 17.35 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.084 0.954 . . . . 0.0 111.439 -179.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 65.6 mtt -132.3 6.03 4.14 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 114.526 1.306 . . . . 0.0 114.526 -171.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 66.6 m -63.44 155.87 27.83 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 121.313 -0.867 . . . . 0.0 111.591 174.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 24.1 p-10 -48.62 -43.41 36.28 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.288 1.218 . . . . 0.0 114.288 -176.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 62.1 mtpt -55.5 -38.02 68.64 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.858 1.263 . . . . 0.0 113.52 173.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.87 -40.73 96.39 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 119.26 0.936 . . . . 0.0 111.931 176.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -73.75 -45.96 48.64 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 C-N-CA 124.617 1.167 . . . . 0.0 109.73 -179.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 14.9 m-30 -56.93 -45.13 82.96 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 118.806 0.73 . . . . 0.0 112.61 175.094 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -74.51 -36.4 63.2 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.44 1.096 . . . . 0.0 111.99 -174.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 72.1 mtt85 -70.16 -40.28 74.83 Favored 'General case' 0 N--CA 1.484 1.229 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 169.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 35.3 m-85 -132.22 88.41 40.4 Favored Pre-proline 0 CA--C 1.546 0.792 0 C-N-CA 125.398 1.479 . . . . 0.0 110.87 -167.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -68.05 -19.96 44.88 Favored 'Trans proline' 0 CA--C 1.538 0.711 0 C-N-CA 122.795 2.33 . . . . 0.0 114.013 -170.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 8.4 p-80 -71.94 -23.63 61.49 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 123.619 0.767 . . . . 0.0 112.919 173.01 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -85.31 1.93 46.27 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 126.56 1.944 . . . . 0.0 113.593 -179.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? . . . . . 0 C--O 1.253 1.256 0 C-N-CA 125.715 1.606 . . . . 0.0 110.84 172.404 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.4 mtt . . . . . 0 N--CA 1.498 1.958 0 CA-C-O 120.148 0.023 . . . . 0.0 110.969 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 94.8 mtt-85 -129.69 165.5 21.71 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 125.886 1.674 . . . . 0.0 112.392 -179.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 92.98 142.2 11.38 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 125.751 1.643 . . . . 0.0 113.737 178.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 13.6 t -155.45 156.76 35.87 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.939 1.695 . . . . 0.0 110.947 178.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -135.31 154.7 51.44 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.202 1.401 . . . . 0.0 112.654 -175.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 33.1 t-80 -143.94 158.9 43.4 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.723 1.609 . . . . 0.0 111.387 179.444 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 25.4 p80 -141.34 161.57 37.57 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 125.03 1.332 . . . . 0.0 113.046 -175.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 62.3 m80 -135.74 153.69 51.48 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.096 1.359 . . . . 0.0 112.367 -172.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -147.78 146.93 29.37 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.129 1.372 . . . . 0.0 111.384 174.071 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 34.0 t-80 -148.49 136.16 20.66 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.823 1.249 . . . . 0.0 111.155 175.026 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -88.13 146.71 19.84 Favored Glycine 0 CA--C 1.538 1.486 0 C-N-CA 124.341 0.972 . . . . 0.0 113.985 -179.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 69.9 m -133.01 144.64 50.22 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.497 1.519 . . . . 0.0 111.748 179.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.6 p -152.2 146.3 15.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 C-N-CA 124.751 1.221 . . . . 0.0 111.803 179.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.1 p -148.01 149.92 33.03 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.74 1.616 . . . . 0.0 111.292 171.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -154.63 164.33 38.9 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.41 1.084 . . . . 0.0 112.756 -175.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 101.74 132.82 7.86 Favored Glycine 0 CA--C 1.535 1.317 0 C-N-CA 125.673 1.606 . . . . 0.0 113.908 173.347 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -155.24 154.65 28.94 Favored Pre-proline 0 CA--C 1.552 1.034 0 C-N-CA 126.321 1.849 . . . . 0.0 111.137 178.363 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo -69.9 153.1 68.67 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 123.142 2.562 . . . . 0.0 112.343 174.171 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 67.8 m -134.53 66.17 69.23 Favored Pre-proline 0 N--CA 1.477 0.894 0 C-N-CA 124.709 1.204 . . . . 0.0 112.445 -175.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -66.97 135.68 38.57 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 123.102 2.535 . . . . 0.0 111.567 175.301 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 90.0 mt -142.85 152.47 42.2 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.474 1.509 . . . . 0.0 112.158 -176.249 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 54.7 p -80.41 161.2 25.07 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.204 1.402 . . . . 0.0 112.353 169.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 88.6 p -145.96 -4.73 0.63 Allowed 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.565 1.32 . . . . 0.0 114.565 -178.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -121.6 -3.14 9.32 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 126.322 1.849 . . . . 0.0 114.765 -171.507 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 42.3 m -73.17 141.32 47.4 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.059 0.944 . . . . 0.0 113.481 -173.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 60.42 10.04 2.28 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 116.859 2.17 . . . . 0.0 116.859 171.453 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -69.46 -20.58 63.75 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 114.789 1.403 . . . . 0.0 114.789 -174.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -142.39 11.99 1.93 Allowed 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 124.991 1.317 . . . . 0.0 114.532 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 19.1 mt -137.85 127.22 34.45 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 124.797 1.239 . . . . 0.0 110.918 -172.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 15.1 t-20 41.91 50.17 4.11 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 126.697 1.999 . . . . 0.0 114.165 167.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 65.3 t80 -56.57 -51.61 67.97 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -161.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 40.7 ttp -157.87 52.25 0.45 Allowed 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.654 1.182 . . . . 0.0 111.005 176.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 19.7 p -125.3 51.85 5.84 Favored Pre-proline 0 N--CA 1.484 1.235 0 N-CA-C 115.203 1.557 . . . . 0.0 115.203 -168.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -73.73 162.0 40.55 Favored 'Trans proline' 0 CA--C 1.551 1.337 0 C-N-CA 123.218 2.612 . . . . 0.0 112.583 170.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -72.22 167.03 27.98 Favored 'Trans proline' 0 CA--C 1.546 1.097 0 C-N-CA 123.628 2.886 . . . . 0.0 112.475 170.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -141.13 150.06 42.33 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.835 1.254 . . . . 0.0 112.895 176.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -166.12 167.18 16.54 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 126.315 1.846 . . . . 0.0 111.452 174.041 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -134.46 162.39 32.38 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 126.305 1.842 . . . . 0.0 110.711 175.167 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 51.76 55.91 8.62 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 125.937 1.695 . . . . 0.0 114.015 175.395 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -135.25 46.78 1.91 Allowed Pre-proline 0 CA--C 1.553 1.091 0 C-N-CA 124.884 1.274 . . . . 0.0 113.036 178.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -72.4 158.51 51.23 Favored 'Trans proline' 0 CA--C 1.542 0.891 0 C-N-CA 123.048 2.499 . . . . 0.0 112.909 -172.642 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 70.86 23.77 77.65 Favored Glycine 0 CA--C 1.539 1.555 0 C-N-CA 123.732 0.682 . . . . 0.0 114.795 177.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.16 113.94 5.51 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.72 1.208 . . . . 0.0 111.881 -177.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 97.1 mt -133.8 164.7 26.67 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 127.187 2.195 . . . . 0.0 110.83 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -121.33 122.25 39.45 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.328 1.051 . . . . 0.0 112.142 176.062 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -82.78 146.35 29.02 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.218 1.007 . . . . 0.0 110.898 167.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 61.5 mt -128.9 157.78 40.63 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.57 1.148 . . . . 0.0 112.712 -169.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 -80.8 141.62 34.53 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.074 0.95 . . . . 0.0 110.206 166.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -100.16 -13.1 19.08 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 114.811 1.411 . . . . 0.0 114.811 -171.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -149.56 167.74 25.46 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.586 1.154 . . . . 0.0 113.221 -172.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.69 -162.03 53.72 Favored Glycine 0 CA--C 1.541 1.704 0 C-N-CA 124.17 0.891 . . . . 0.0 113.916 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -67.52 -16.44 47.25 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 123.194 2.596 . . . . 0.0 113.649 -177.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 97.2 mt -92.68 4.22 54.12 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.756 1.222 . . . . 0.0 113.915 175.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.1 122.21 11.17 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 120.941 1.7 . . . . 0.0 112.139 -177.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 82.64 4.62 90.02 Favored Glycine 0 CA--C 1.539 1.593 0 C-N-CA 125.457 1.503 . . . . 0.0 115.372 -174.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 16.5 mt -102.1 159.86 28.12 Favored Pre-proline 0 CA--C 1.555 1.14 0 C-N-CA 126.15 1.78 . . . . 0.0 111.271 -179.172 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.78 160.45 37.56 Favored 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 124.317 3.344 . . . . 0.0 113.884 -165.296 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 29.6 t -103.24 -32.01 2.99 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 178.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 18.1 p -124.51 170.42 10.91 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 125.181 1.393 . . . . 0.0 113.898 177.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 39.3 ttm180 -66.03 -34.58 78.42 Favored 'General case' 0 N--CA 1.48 1.046 0 O-C-N 121.019 -1.05 . . . . 0.0 111.113 178.359 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 34.2 m -61.51 -46.54 89.54 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.028 0.931 . . . . 0.0 111.255 168.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -60.22 -44.51 95.13 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 119.14 0.882 . . . . 0.0 111.426 176.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.39 -41.1 96.84 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.439 0.696 . . . . 0.0 112.538 178.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 20.7 ttp180 -67.88 -40.51 83.53 Favored 'General case' 0 N--CA 1.479 1.005 0 O-C-N 121.114 -0.991 . . . . 0.0 112.344 176.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 72.2 t -62.74 -45.18 99.47 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 C-N-CA 123.486 0.715 . . . . 0.0 110.799 175.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 23.7 mt -58.27 -49.05 78.5 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 118.389 -0.815 . . . . 0.0 112.193 173.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 51.9 mt -52.76 -52.12 30.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 CA-C-N 118.796 0.726 . . . . 0.0 110.043 176.012 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -65.95 -50.83 63.0 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 -176.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -68.57 -43.03 77.44 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 118.933 0.788 . . . . 0.0 112.511 -175.259 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -64.85 -45.88 84.23 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 118.639 -0.696 . . . . 0.0 110.48 175.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 68.1 t90 -58.98 -47.35 85.47 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-O 117.08 -1.438 . . . . 0.0 111.579 173.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -55.15 -49.32 72.11 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 121.329 1.877 . . . . 0.0 112.771 178.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -64.47 -51.73 61.57 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 121.124 -0.985 . . . . 0.0 112.427 179.015 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 10.3 mmm180 -58.22 -47.47 83.4 Favored 'General case' 0 C--O 1.213 -0.829 0 C-N-CA 123.114 0.566 . . . . 0.0 110.51 177.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 18.8 tptp -60.17 -37.33 79.85 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 125.936 1.695 . . . . 0.0 113.143 177.414 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 61.1 mtpt -62.89 -31.16 72.16 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 119.194 0.906 . . . . 0.0 111.866 170.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 68.7 m -83.15 -20.06 35.45 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 115.922 1.823 . . . . 0.0 115.922 165.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -145.16 77.81 12.72 Favored Pre-proline 0 N--CA 1.479 0.988 0 C-N-CA 127.06 2.144 . . . . 0.0 111.254 -162.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -56.77 -24.25 54.48 Favored 'Trans proline' 0 CA--C 1.546 1.077 0 C-N-CA 122.624 2.216 . . . . 0.0 114.756 -170.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 44.8 p90 -71.85 -6.55 42.54 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 116.043 1.868 . . . . 0.0 116.043 177.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 14.0 tp -70.58 131.83 44.57 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 120.981 1.719 . . . . 0.0 114.101 -170.444 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 41.4 ptt180 -87.79 160.07 18.18 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 124.904 1.282 . . . . 0.0 113.735 176.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -139.17 129.83 25.99 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.741 2.016 . . . . 0.0 109.995 -169.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -147.87 135.04 20.43 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.287 1.035 . . . . 0.0 111.332 178.147 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 63.8 mtt -129.82 1.48 4.87 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 114.731 1.382 . . . . 0.0 114.731 -169.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 66.2 m -62.36 151.1 37.74 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 119.057 0.844 . . . . 0.0 111.613 175.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 43.2 p-10 -50.74 -37.81 44.0 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 114.65 1.352 . . . . 0.0 114.65 -174.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt -52.97 -40.05 63.42 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.408 1.483 . . . . 0.0 113.167 173.317 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.5 -39.01 89.41 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 123.625 0.77 . . . . 0.0 112.042 176.226 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.6 mp -73.83 -45.19 50.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 C-N-CA 123.391 0.677 . . . . 0.0 109.3 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 9.9 m-30 -55.94 -44.51 78.45 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 118.779 0.718 . . . . 0.0 112.214 175.199 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.0 -39.72 55.19 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.975 1.31 . . . . 0.0 112.49 -174.497 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 94.5 mtt-85 -74.89 -36.52 62.24 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.888 0.875 . . . . 0.0 112.704 175.268 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 48.3 m-85 -131.68 75.92 75.56 Favored Pre-proline 0 CA--C 1.546 0.816 0 C-N-CA 125.958 1.703 . . . . 0.0 110.834 -170.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -66.12 -14.92 46.55 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.083 2.522 . . . . 0.0 114.031 -175.303 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 13.2 p-80 -73.52 -24.39 60.14 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.198 0.999 . . . . 0.0 113.279 171.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.71 -53.71 5.99 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.861 1.265 . . . . 0.0 112.061 -162.591 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 65.7 ttt-85 . . . . . 0 C--O 1.253 1.28 0 C-N-CA 126.635 1.974 . . . . 0.0 112.737 -176.181 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.497 1.903 0 N-CA-C 110.625 -0.139 . . . . 0.0 110.625 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 53.9 ptt85 -144.29 159.92 41.89 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 125.262 1.425 . . . . 0.0 112.946 179.271 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 139.75 133.45 3.01 Favored Glycine 0 CA--C 1.536 1.353 0 C-N-CA 125.623 1.582 . . . . 0.0 112.811 175.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 65.7 m -144.18 146.48 32.74 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.425 1.49 . . . . 0.0 111.766 -177.125 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 20.3 p80 -151.54 152.89 33.55 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.028 1.331 . . . . 0.0 112.093 174.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 54.8 t-80 -157.16 145.46 19.43 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.074 1.349 . . . . 0.0 111.602 175.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 51.9 p-80 -151.06 144.71 25.02 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.959 1.304 . . . . 0.0 111.482 168.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 38.0 t-80 -156.4 151.33 26.16 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.05 1.34 . . . . 0.0 111.285 174.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 24.8 p80 -153.21 166.31 32.95 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.538 1.135 . . . . 0.0 113.175 -178.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 60.1 m80 -133.73 149.33 51.48 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.842 1.657 . . . . 0.0 111.267 172.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 158.26 125.61 0.84 Allowed Glycine 0 CA--C 1.534 1.23 0 C-N-CA 124.119 0.866 . . . . 0.0 113.358 172.391 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 21.5 t -158.01 145.78 18.49 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.238 1.415 . . . . 0.0 111.256 174.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 48.3 t -138.98 130.23 34.85 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 C-N-CA 125.469 1.507 . . . . 0.0 109.777 177.112 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 68.4 m -140.26 135.87 32.73 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.024 1.329 . . . . 0.0 111.427 178.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -154.04 155.32 35.28 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.135 1.374 . . . . 0.0 111.69 176.281 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -172.41 130.1 1.85 Allowed Glycine 0 CA--C 1.533 1.216 0 C-N-CA 124.345 0.974 . . . . 0.0 112.421 171.067 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -146.65 61.32 6.7 Favored Pre-proline 0 CA--C 1.553 1.092 0 C-N-CA 124.91 1.284 . . . . 0.0 111.757 178.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -67.75 150.18 78.94 Favored 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 123.371 2.714 . . . . 0.0 112.834 -177.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 75.1 p -153.23 153.78 29.91 Favored Pre-proline 0 N--CA 1.474 0.757 0 C-N-CA 125.324 1.449 . . . . 0.0 112.131 178.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.11 152.08 67.35 Favored 'Trans proline' 0 CA--C 1.54 0.82 0 C-N-CA 123.106 2.537 . . . . 0.0 112.178 175.047 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 60.5 tp -146.82 134.78 21.41 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.747 1.219 . . . . 0.0 111.529 -179.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.8 t -151.47 146.2 25.75 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.981 1.312 . . . . 0.0 110.996 169.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 78.9 p -141.92 9.13 1.92 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.144 1.378 . . . . 0.0 113.987 -176.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -112.43 120.46 41.73 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.799 1.24 . . . . 0.0 112.34 -172.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 40.4 m -124.23 3.85 8.52 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.942 1.297 . . . . 0.0 113.755 176.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 58.09 17.03 4.19 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 126.452 1.901 . . . . 0.0 115.539 -178.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -76.12 -24.14 54.93 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 114.036 1.125 . . . . 0.0 114.036 -174.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -118.29 -0.22 11.55 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.702 1.601 . . . . 0.0 114.472 -179.218 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 13.3 mt -90.73 57.42 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 C-N-CA 124.78 1.232 . . . . 0.0 109.728 -173.23 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -91.68 -26.94 18.4 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.008 1.323 . . . . 0.0 113.484 -175.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 95.0 m-85 -93.67 133.69 36.76 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.161 0.984 . . . . 0.0 113.072 -171.129 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 40.3 tpp -149.78 34.93 0.68 Allowed 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.932 1.693 . . . . 0.0 110.097 171.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 3.4 p -140.04 68.78 35.09 Favored Pre-proline 0 N--CA 1.477 0.898 0 C-N-CA 125.033 1.333 . . . . 0.0 112.357 -153.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -65.94 158.63 53.09 Favored 'Trans proline' 0 CA--C 1.549 1.235 0 C-N-CA 123.204 2.603 . . . . 0.0 112.367 173.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -70.01 151.37 67.59 Favored 'Trans proline' 0 CA--C 1.542 0.88 0 C-N-CA 123.51 2.807 . . . . 0.0 113.036 179.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 -125.61 21.1 7.81 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 125.348 1.459 . . . . 0.0 112.809 -177.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 23.0 mm-40 -134.02 157.38 46.24 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.903 1.681 . . . . 0.0 111.746 -179.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -117.22 39.08 3.35 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.276 1.43 . . . . 0.0 111.909 -175.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 52.13 40.09 27.98 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 126.202 1.801 . . . . 0.0 114.766 175.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -144.1 49.14 1.0 Allowed Pre-proline 0 CA--C 1.552 1.038 0 C-N-CA 124.897 1.279 . . . . 0.0 112.839 -178.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -71.03 159.09 53.5 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 123.306 2.671 . . . . 0.0 112.823 -173.494 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 70.03 28.43 71.72 Favored Glycine 0 CA--C 1.537 1.463 0 C-N-CA 123.619 0.628 . . . . 0.0 114.233 179.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.35 119.94 11.27 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.933 1.293 . . . . 0.0 112.21 -176.025 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 94.3 mt -133.66 168.5 18.57 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 127.565 2.346 . . . . 0.0 110.64 177.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -128.66 142.13 51.12 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.285 1.034 . . . . 0.0 113.411 177.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -88.48 154.89 19.99 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.757 1.223 . . . . 0.0 111.114 164.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 91.6 mt -132.59 157.55 44.45 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.952 1.301 . . . . 0.0 112.112 -175.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -81.24 138.61 35.76 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.468 0.707 . . . . 0.0 109.974 163.218 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -97.26 -20.57 17.8 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 -174.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -140.66 165.47 27.4 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.211 1.405 . . . . 0.0 112.428 -171.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.17 -163.27 54.89 Favored Glycine 0 CA--C 1.54 1.648 0 C-N-CA 124.246 0.927 . . . . 0.0 114.13 178.115 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -67.74 -17.14 47.42 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 123.267 2.645 . . . . 0.0 113.833 -175.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.2 mt -94.08 5.95 50.09 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 124.612 1.165 . . . . 0.0 113.935 175.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.42 122.37 11.05 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 120.875 1.67 . . . . 0.0 112.123 -177.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.25 5.66 88.68 Favored Glycine 0 CA--C 1.541 1.718 0 C-N-CA 125.568 1.556 . . . . 0.0 115.469 -175.104 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 20.3 mt -104.02 160.71 25.2 Favored Pre-proline 0 CA--C 1.557 1.228 0 C-N-CA 126.348 1.859 . . . . 0.0 111.295 -179.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -71.36 164.95 34.01 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 124.318 3.346 . . . . 0.0 113.408 -169.165 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.9 t -107.53 -29.58 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 O-C-N 121.324 -0.86 . . . . 0.0 112.468 175.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 22.1 p -125.73 172.12 10.07 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 125.31 1.444 . . . . 0.0 114.056 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 34.6 ptt-85 -63.42 -35.6 80.97 Favored 'General case' 0 N--CA 1.48 1.071 0 O-C-N 121.284 -0.885 . . . . 0.0 111.92 173.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 37.2 m -65.39 -44.08 88.62 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.971 0.909 . . . . 0.0 110.95 172.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 76.3 m-20 -60.52 -46.42 90.19 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 118.522 0.601 . . . . 0.0 111.066 175.043 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.94 -42.3 98.95 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.61 0.764 . . . . 0.0 112.611 179.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 62.8 ttp85 -64.55 -42.84 95.43 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 118.962 0.801 . . . . 0.0 112.234 175.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 54.5 t -62.39 -47.87 91.01 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 123.752 0.821 . . . . 0.0 111.078 176.128 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.2 mp -58.95 -48.63 80.82 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 118.519 -0.753 . . . . 0.0 112.791 175.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 55.2 mt -55.49 -51.03 61.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 CA-C-N 118.775 0.716 . . . . 0.0 110.173 176.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -65.62 -49.19 69.62 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -177.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -66.72 -46.61 74.97 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 118.986 0.812 . . . . 0.0 112.299 -177.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -60.31 -49.71 76.51 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 118.458 -0.782 . . . . 0.0 110.25 175.044 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 64.3 t90 -56.44 -47.12 79.78 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-O 117.719 -1.134 . . . . 0.0 112.116 176.385 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -57.15 -48.26 79.13 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 120.792 1.633 . . . . 0.0 113.078 178.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -68.92 -48.52 63.08 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 119.902 1.228 . . . . 0.0 112.399 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 34.2 mmt180 -60.54 -39.62 88.57 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.673 0.789 . . . . 0.0 110.175 178.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -72.64 -30.13 64.04 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 125.057 1.343 . . . . 0.0 113.581 176.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.7 mmtp -62.29 -31.46 72.06 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 120.135 1.334 . . . . 0.0 111.412 165.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 60.2 m -80.0 -25.76 40.16 Favored 'General case' 0 N--CA 1.483 1.193 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 165.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -139.85 78.58 24.87 Favored Pre-proline 0 N--CA 1.478 0.961 0 C-N-CA 126.775 2.03 . . . . 0.0 111.667 -168.41 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -59.93 -11.78 16.43 Favored 'Trans proline' 0 CA--C 1.546 1.121 0 C-N-CA 123.539 2.826 . . . . 0.0 116.495 -166.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 40.6 p90 -85.08 -7.11 59.24 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 126.778 2.031 . . . . 0.0 115.21 176.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.4 tp -62.32 137.73 58.31 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 114.515 1.302 . . . . 0.0 114.515 -167.56 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 30.1 mmm180 -83.83 154.74 23.33 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 125.258 1.423 . . . . 0.0 113.113 179.107 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -137.62 130.35 29.98 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.826 2.05 . . . . 0.0 109.671 -175.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 59.2 t0 -143.74 129.61 19.43 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.011 0.924 . . . . 0.0 111.004 176.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 66.1 mtt -124.98 13.54 8.45 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.476 1.511 . . . . 0.0 112.952 -179.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 38.8 t -59.9 148.45 34.91 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.568 -0.707 . . . . 0.0 110.906 170.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -54.66 -35.25 63.33 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.21 -0.931 . . . . 0.0 112.437 -178.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -60.3 -36.19 77.33 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.369 1.067 . . . . 0.0 113.039 175.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.49 -41.06 98.55 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 118.95 0.795 . . . . 0.0 111.429 174.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.79 -46.91 59.16 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 C-N-CA 123.791 0.837 . . . . 0.0 109.758 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 16.9 m-30 -55.08 -46.42 75.44 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 118.89 0.768 . . . . 0.0 112.575 175.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.7 tmt_? -76.71 -38.47 54.27 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.508 1.123 . . . . 0.0 112.332 -172.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 19.9 ttm180 -75.9 -37.13 59.12 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.804 0.842 . . . . 0.0 112.646 175.328 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 34.9 m-85 -128.1 82.81 67.73 Favored Pre-proline 0 CA--C 1.547 0.864 0 C-N-CA 126.13 1.772 . . . . 0.0 110.648 -173.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -66.01 -19.68 57.63 Favored 'Trans proline' 0 CA--C 1.539 0.738 0 C-N-CA 122.971 2.447 . . . . 0.0 114.174 -172.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 8.1 p-80 -72.09 -20.6 61.62 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.917 0.887 . . . . 0.0 113.294 172.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -91.88 -0.91 57.52 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 127.015 2.126 . . . . 0.0 113.578 -178.531 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.231 0 C-N-CA 124.769 1.228 . . . . 0.0 111.211 170.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.0 ttt . . . . . 0 N--CA 1.495 1.803 0 N-CA-C 110.66 -0.126 . . . . 0.0 110.66 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 16.2 ptm180 -88.13 162.98 16.43 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 124.528 1.131 . . . . 0.0 113.636 -179.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 85.16 148.06 9.79 Favored Glycine 0 CA--C 1.537 1.447 0 C-N-CA 125.462 1.506 . . . . 0.0 114.379 177.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.6 t -157.58 166.62 32.41 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.079 1.752 . . . . 0.0 110.883 177.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 52.4 p-80 -141.19 151.38 43.77 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.271 1.428 . . . . 0.0 112.548 179.254 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 63.6 m80 -143.11 157.43 44.53 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.441 1.496 . . . . 0.0 111.915 -174.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 21.5 p80 -147.01 160.02 42.87 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.998 1.319 . . . . 0.0 111.878 173.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 65.1 m80 -140.02 153.02 46.7 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.198 1.399 . . . . 0.0 111.807 -176.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 55.3 p-80 -148.51 165.51 30.99 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.17 1.388 . . . . 0.0 112.548 -179.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 54.5 p-80 -145.54 163.61 34.21 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.767 1.627 . . . . 0.0 111.76 178.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 175.37 -175.28 47.17 Favored Glycine 0 CA--C 1.537 1.414 0 C-N-CA 123.958 0.789 . . . . 0.0 114.337 179.306 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 64.1 m -133.36 161.06 35.53 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.923 1.689 . . . . 0.0 111.784 -178.498 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 27.0 m -126.7 155.38 37.28 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 125.221 1.408 . . . . 0.0 112.547 -178.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 79.8 p -145.02 155.7 43.51 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.689 1.595 . . . . 0.0 111.988 177.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 51.1 p90 -153.54 165.58 35.42 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.057 1.343 . . . . 0.0 112.535 -175.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 81.94 162.53 30.41 Favored Glycine 0 CA--C 1.538 1.507 0 C-N-CA 124.992 1.282 . . . . 0.0 114.742 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -152.34 154.15 31.71 Favored Pre-proline 0 CA--C 1.55 0.97 0 C-N-CA 125.852 1.661 . . . . 0.0 111.723 -179.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -69.44 160.35 50.13 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 123.353 2.702 . . . . 0.0 112.447 174.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 37.2 p -132.62 56.43 22.62 Favored Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 125.158 1.383 . . . . 0.0 113.98 -173.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -68.03 156.09 67.14 Favored 'Trans proline' 0 CA--C 1.542 0.925 0 C-N-CA 123.368 2.712 . . . . 0.0 112.891 178.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.5 pp -146.12 157.53 43.85 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.548 1.539 . . . . 0.0 111.784 173.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 83.5 p -140.0 -11.3 1.13 Allowed 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 115.876 1.806 . . . . 0.0 115.876 -173.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.2 t -152.92 154.1 34.36 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.409 1.084 . . . . 0.0 112.616 -178.187 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -129.95 9.42 5.34 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 127.233 2.213 . . . . 0.0 113.257 179.443 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 6.9 t -142.77 -178.53 5.84 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.272 1.429 . . . . 0.0 113.067 -172.136 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 56.23 50.02 14.22 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 126.315 1.846 . . . . 0.0 113.3 -179.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 25.8 m-20 -76.69 56.34 1.14 Allowed 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.536 1.535 . . . . 0.0 111.702 174.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 57.06 29.84 17.19 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 126.57 1.948 . . . . 0.0 114.16 -176.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 1.4 pp -68.66 -3.05 2.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 N-CA-C 116.0 1.852 . . . . 0.0 116.0 -169.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 -84.69 2.03 43.69 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 124.907 1.283 . . . . 0.0 113.982 175.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 37.3 p90 -55.13 -26.8 40.85 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 115.46 1.652 . . . . 0.0 115.46 -174.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 25.6 ptp -76.42 -2.83 33.91 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 115.769 1.766 . . . . 0.0 115.769 -167.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.0 t -137.04 75.48 47.71 Favored Pre-proline 0 N--CA 1.478 0.949 0 C-N-CA 124.165 0.986 . . . . 0.0 112.745 -176.226 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -71.19 152.34 61.72 Favored 'Trans proline' 0 CA--C 1.549 1.264 0 C-N-CA 123.193 2.595 . . . . 0.0 112.086 173.365 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -77.14 140.03 19.52 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 123.243 2.629 . . . . 0.0 112.881 -177.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -147.94 1.75 0.67 Allowed 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -105.33 6.61 32.86 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 114.609 1.337 . . . . 0.0 114.609 -160.167 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -133.91 134.83 43.11 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.908 1.283 . . . . 0.0 111.434 -178.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 49.77 44.16 24.83 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 125.982 1.713 . . . . 0.0 114.039 177.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -144.69 55.24 3.05 Favored Pre-proline 0 CA--C 1.551 0.987 0 C-N-CA 124.365 1.066 . . . . 0.0 111.88 -172.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -75.55 131.11 13.33 Favored 'Trans proline' 0 CA--C 1.542 0.877 0 C-N-CA 122.871 2.381 . . . . 0.0 112.099 -171.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 61.55 -158.94 31.22 Favored Glycine 0 CA--C 1.54 1.627 0 C-N-CA 124.043 0.83 . . . . 0.0 113.872 -175.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -141.49 93.04 2.52 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.23 1.012 . . . . 0.0 111.52 172.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 5.1 mp -134.35 150.39 50.92 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 126.524 1.929 . . . . 0.0 110.386 176.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -140.45 130.19 24.39 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.928 0.891 . . . . 0.0 112.266 173.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -85.32 159.13 20.1 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.774 1.23 . . . . 0.0 111.294 167.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 95.1 mt -133.94 157.02 47.07 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.871 1.269 . . . . 0.0 112.529 -174.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 -82.09 140.31 33.92 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 123.908 0.883 . . . . 0.0 109.944 163.205 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -98.19 -20.3 17.36 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 -174.423 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -140.45 165.13 28.28 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.124 1.369 . . . . 0.0 112.492 -171.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 72.92 -162.93 54.9 Favored Glycine 0 CA--C 1.541 1.674 0 C-N-CA 124.2 0.905 . . . . 0.0 114.074 178.4 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -67.54 -17.0 48.36 Favored 'Trans proline' 0 CA--C 1.541 0.865 0 C-N-CA 123.325 2.683 . . . . 0.0 113.763 -176.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.0 mt -93.85 5.66 50.93 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.701 1.2 . . . . 0.0 113.915 175.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.86 121.53 9.46 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 120.823 1.647 . . . . 0.0 111.909 -178.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.37 8.09 85.61 Favored Glycine 0 CA--C 1.54 1.631 0 C-N-CA 125.358 1.456 . . . . 0.0 115.5 -174.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 18.3 mt -107.84 159.51 30.19 Favored Pre-proline 0 CA--C 1.558 1.258 0 C-N-CA 126.42 1.888 . . . . 0.0 111.469 -179.176 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -71.75 166.27 30.0 Favored 'Trans proline' 0 C--N 1.354 0.853 0 C-N-CA 124.655 3.57 . . . . 0.0 113.968 -169.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 5.7 t -111.58 -26.35 3.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 123.856 0.862 . . . . 0.0 112.486 177.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 29.8 p -127.87 172.6 10.72 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 125.296 1.439 . . . . 0.0 114.236 179.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -68.51 -36.93 79.57 Favored 'General case' 0 N--CA 1.482 1.157 0 O-C-N 121.167 -0.958 . . . . 0.0 111.358 176.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 10.2 p -63.56 -42.6 98.34 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 118.492 -0.765 . . . . 0.0 111.761 169.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 84.5 m-20 -58.37 -50.98 71.73 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 119.582 1.083 . . . . 0.0 110.809 173.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.01 -41.19 97.8 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.565 0.746 . . . . 0.0 112.531 -178.229 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 33.6 ttt85 -65.58 -43.58 89.3 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.08 0.952 . . . . 0.0 112.063 177.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 70.4 t -64.47 -45.79 94.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 C-N-CA 123.756 0.822 . . . . 0.0 111.227 175.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 54.6 mt -61.28 -43.92 98.09 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 118.309 -0.853 . . . . 0.0 112.406 176.414 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 47.7 mt -55.5 -51.57 56.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 CA-C-N 119.143 0.883 . . . . 0.0 109.949 173.28 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -63.3 -46.97 84.25 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -178.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 55.4 m-20 -68.91 -45.9 69.67 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.84 0.856 . . . . 0.0 112.189 -177.131 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -63.62 -46.45 85.66 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 119.131 -0.461 . . . . 0.0 110.793 177.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.413 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 66.8 t90 -60.03 -46.04 90.83 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-O 117.657 -1.163 . . . . 0.0 111.658 172.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -56.19 -45.72 79.68 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 120.873 1.67 . . . . 0.0 112.877 179.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -67.75 -52.06 41.89 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 119.644 1.111 . . . . 0.0 112.401 177.103 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 13.1 mmm180 -56.84 -48.41 78.12 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 121.759 -0.588 . . . . 0.0 110.626 178.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.9 tmtt? -67.21 -30.14 69.99 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.593 1.557 . . . . 0.0 113.562 178.435 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -60.77 -36.52 79.15 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 120.293 1.406 . . . . 0.0 111.096 166.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 64.9 m -79.95 -20.69 45.03 Favored 'General case' 0 N--CA 1.482 1.166 0 N-CA-C 115.343 1.609 . . . . 0.0 115.343 167.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -141.5 73.34 24.82 Favored Pre-proline 0 CA--C 1.548 0.894 0 C-N-CA 127.084 2.153 . . . . 0.0 111.469 -166.078 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -61.31 -7.98 9.52 Favored 'Trans proline' 0 CA--C 1.546 1.084 0 C-N-CA 123.744 2.963 . . . . 0.0 116.325 -166.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 41.2 p90 -84.64 -10.17 57.58 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.586 1.954 . . . . 0.0 114.88 174.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 16.5 tp -65.48 135.47 55.21 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 119.862 1.21 . . . . 0.0 113.952 -167.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -83.57 156.08 22.95 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.761 1.225 . . . . 0.0 113.021 178.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.413 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -137.23 130.98 31.75 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 127.027 2.131 . . . . 0.0 109.228 -174.23 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -137.81 129.66 28.57 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.233 1.013 . . . . 0.0 110.829 178.062 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 63.8 mtt -126.72 16.21 7.5 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.469 1.508 . . . . 0.0 113.53 -178.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 47.6 t -63.3 148.97 46.81 Favored 'General case' 0 N--CA 1.47 0.575 0 O-C-N 121.573 -0.704 . . . . 0.0 110.615 165.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -56.51 -32.02 64.67 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 121.118 -0.989 . . . . 0.0 112.329 178.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 60.3 mtpt -59.78 -33.43 71.69 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.31 1.044 . . . . 0.0 112.997 174.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.27 -40.81 97.46 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 119.161 0.891 . . . . 0.0 111.486 173.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.87 -46.99 58.21 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 C-N-CA 123.814 0.846 . . . . 0.0 109.405 179.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.7 m-30 -56.24 -45.54 79.94 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 118.759 0.708 . . . . 0.0 112.568 176.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.09 -38.55 52.13 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 124.409 1.084 . . . . 0.0 112.121 -173.589 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 62.1 ttm-85 -75.61 -35.57 60.49 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.934 0.893 . . . . 0.0 112.494 175.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 46.7 m-85 -128.53 82.93 67.61 Favored Pre-proline 0 CA--C 1.546 0.795 0 C-N-CA 126.088 1.755 . . . . 0.0 110.724 -174.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -66.03 -18.54 57.06 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 123.088 2.526 . . . . 0.0 114.092 -172.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 7.8 p-80 -73.83 -21.63 60.06 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.022 0.929 . . . . 0.0 113.333 173.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -90.17 -8.36 51.38 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 126.113 1.765 . . . . 0.0 113.86 -173.163 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? . . . . . 0 C--O 1.254 1.311 0 C-N-CA 125.109 1.363 . . . . 0.0 110.977 175.418 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.3 mtt . . . . . 0 N--CA 1.499 1.986 0 N-CA-C 110.414 -0.217 . . . . 0.0 110.414 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 74.7 ttt180 -148.96 151.23 34.24 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 125.074 1.35 . . . . 0.0 111.981 -178.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 87.86 151.38 21.83 Favored Glycine 0 CA--C 1.537 1.425 0 C-N-CA 125.378 1.466 . . . . 0.0 114.378 176.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 77.4 p -157.01 163.54 38.98 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 125.908 1.683 . . . . 0.0 112.285 -177.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -145.6 134.97 23.06 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.001 1.32 . . . . 0.0 111.243 177.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 50.8 m80 -138.78 1.12 2.07 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.604 1.162 . . . . 0.0 114.103 -176.293 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 46.8 m80 -75.19 139.6 42.75 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.474 1.11 . . . . 0.0 112.748 -167.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 15.8 t60 -151.22 166.44 30.87 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.124 1.37 . . . . 0.0 111.982 -175.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 20.2 p80 -140.23 154.16 46.79 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.535 1.534 . . . . 0.0 112.348 178.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 28.8 p80 -150.16 167.04 28.02 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.829 1.251 . . . . 0.0 112.923 -175.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 83.19 159.93 28.46 Favored Glycine 0 CA--C 1.538 1.48 0 C-N-CA 124.985 1.279 . . . . 0.0 114.667 179.539 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 12.3 t -155.16 158.33 38.78 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.579 1.552 . . . . 0.0 111.458 179.08 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.1 p -149.11 146.67 17.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 125.308 1.443 . . . . 0.0 111.503 178.1 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.1 m -132.08 132.74 43.6 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.17 1.388 . . . . 0.0 111.013 177.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 54.6 p90 -154.93 162.86 40.96 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.084 1.354 . . . . 0.0 112.445 -177.141 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 173.6 147.66 6.06 Favored Glycine 0 CA--C 1.536 1.383 0 C-N-CA 124.693 1.14 . . . . 0.0 113.171 174.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -147.29 60.58 5.71 Favored Pre-proline 0 CA--C 1.554 1.122 0 C-N-CA 124.712 1.205 . . . . 0.0 112.534 -179.459 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -67.82 152.22 77.66 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 123.356 2.704 . . . . 0.0 112.586 179.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 9.3 t -147.3 73.52 11.88 Favored Pre-proline 0 N--CA 1.475 0.802 0 C-N-CA 124.548 1.139 . . . . 0.0 111.379 177.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -73.17 155.3 52.06 Favored 'Trans proline' 0 CA--C 1.542 0.896 0 C-N-CA 123.621 2.881 . . . . 0.0 112.824 -179.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -150.27 154.73 38.4 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.496 1.518 . . . . 0.0 112.307 174.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 32.9 m -127.24 -4.3 6.17 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 115.088 1.514 . . . . 0.0 115.088 -173.158 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 49.5 m -142.24 150.94 41.58 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.859 1.264 . . . . 0.0 112.606 -172.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -151.41 137.8 18.55 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.11 1.364 . . . . 0.0 111.467 177.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 75.6 p -111.25 -7.17 14.45 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 125.415 1.486 . . . . 0.0 114.801 -178.224 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -67.71 -12.3 60.21 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 -173.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -68.68 -21.81 64.41 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.683 1.193 . . . . 0.0 113.543 172.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -119.54 -14.85 9.08 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.511 1.524 . . . . 0.0 113.605 177.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 33.0 mt -120.04 77.78 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 126.516 1.926 . . . . 0.0 108.697 -179.615 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -111.37 -6.18 14.53 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 114.698 1.37 . . . . 0.0 114.698 -168.076 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 56.8 t80 -138.79 134.25 33.18 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.473 1.509 . . . . 0.0 112.118 -178.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 10.4 tpt -155.86 35.65 0.35 Allowed 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.101 1.361 . . . . 0.0 111.67 172.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 13.4 p -129.65 65.02 73.83 Favored Pre-proline 0 N--CA 1.482 1.162 0 C-N-CA 124.486 1.114 . . . . 0.0 113.974 -163.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -66.27 161.52 40.17 Favored 'Trans proline' 0 CA--C 1.551 1.331 0 C-N-CA 123.44 2.76 . . . . 0.0 112.52 171.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -67.22 148.72 81.0 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 123.472 2.782 . . . . 0.0 112.991 178.448 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -106.68 -5.5 18.55 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 114.516 1.302 . . . . 0.0 114.516 -171.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -138.23 128.78 26.4 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.565 1.146 . . . . 0.0 112.155 -175.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -159.46 165.58 32.79 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 126.446 1.899 . . . . 0.0 111.148 174.217 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 50.77 50.04 19.8 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 125.706 1.602 . . . . 0.0 115.015 168.056 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 7.2 tp-100 -139.6 66.65 35.68 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 124.766 1.227 . . . . 0.0 110.416 178.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -83.22 157.57 14.98 Favored 'Trans proline' 0 CA--C 1.542 0.92 0 C-N-CA 123.531 2.82 . . . . 0.0 113.778 -167.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 76.35 163.49 15.83 Favored Glycine 0 CA--C 1.539 1.564 0 C-N-CA 125.243 1.401 . . . . 0.0 115.308 176.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -151.55 141.64 22.19 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.235 1.414 . . . . 0.0 111.707 176.133 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 5.0 mp -136.74 157.24 47.21 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.978 1.711 . . . . 0.0 110.902 176.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -132.19 128.31 37.71 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.419 1.087 . . . . 0.0 111.885 169.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -85.04 156.89 20.91 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.539 1.136 . . . . 0.0 111.443 168.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 98.2 mt -131.97 156.27 46.49 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.028 1.331 . . . . 0.0 112.381 -175.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 84.9 m-70 -83.04 142.82 31.04 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.057 0.943 . . . . 0.0 109.755 163.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -103.14 -18.17 15.05 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 114.695 1.368 . . . . 0.0 114.695 -172.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -139.8 163.05 33.65 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.114 1.365 . . . . 0.0 112.459 -172.369 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.05 -160.91 54.12 Favored Glycine 0 CA--C 1.539 1.572 0 C-N-CA 124.137 0.875 . . . . 0.0 114.001 178.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -67.63 -16.4 46.7 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 123.339 2.693 . . . . 0.0 113.763 -176.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 98.6 mt -92.95 4.87 53.2 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.647 1.179 . . . . 0.0 113.807 174.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.84 114.0 2.33 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 121.233 1.833 . . . . 0.0 111.91 -179.081 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.68 5.86 68.41 Favored Glycine 0 CA--C 1.543 1.785 0 C-N-CA 125.322 1.439 . . . . 0.0 115.57 -173.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 6.0 mp -104.97 156.24 36.35 Favored Pre-proline 0 CA--C 1.556 1.191 0 C-N-CA 126.807 2.043 . . . . 0.0 111.63 178.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -67.87 163.29 36.09 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 124.912 3.741 . . . . 0.0 113.987 -170.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.8 t -105.42 -30.18 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 O-C-N 121.373 -0.829 . . . . 0.0 112.319 175.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 17.8 p -125.87 170.05 12.03 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 125.235 1.414 . . . . 0.0 114.266 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 37.5 ttt180 -62.07 -39.13 91.36 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.593 1.157 . . . . 0.0 111.084 174.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 18.5 t -62.62 -46.71 87.01 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.843 0.857 . . . . 0.0 111.101 171.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 78.5 m-20 -57.99 -48.94 78.51 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 118.852 0.751 . . . . 0.0 111.069 176.284 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.58 -42.87 97.56 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -179.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 70.2 ttp85 -67.07 -41.99 85.46 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 121.199 -0.938 . . . . 0.0 112.597 176.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 78.5 t -63.84 -43.4 97.84 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.034 0 C-N-CA 123.603 0.761 . . . . 0.0 111.14 175.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 55.1 mt -60.49 -47.19 87.21 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 118.169 -0.92 . . . . 0.0 112.102 175.062 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 60.6 mt -53.4 -50.28 49.2 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 CA-C-N 119.064 0.847 . . . . 0.0 110.111 173.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 12.3 t80 -62.89 -51.16 68.06 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 112.916 0.709 . . . . 0.0 112.916 -178.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -70.87 -41.44 71.37 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -174.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 57.4 mm-40 -58.7 -53.52 57.41 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 118.574 -0.727 . . . . 0.0 110.057 169.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.404 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 61.4 t90 -55.9 -44.58 78.35 Favored 'General case' 0 C--O 1.218 -0.577 0 CA-C-O 117.444 -1.265 . . . . 0.0 112.081 178.124 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -56.33 -51.05 69.66 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 120.755 1.616 . . . . 0.0 112.856 176.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -68.13 -45.29 74.02 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 119.879 1.218 . . . . 0.0 112.618 179.469 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 31.4 mmt180 -59.79 -44.48 93.92 Favored 'General case' 0 C--O 1.218 -0.583 0 C-N-CA 123.773 0.829 . . . . 0.0 109.952 177.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -63.69 -36.55 84.21 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 126.055 1.742 . . . . 0.0 112.819 175.329 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -62.3 -30.82 71.41 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 119.381 0.992 . . . . 0.0 111.845 170.012 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 68.4 m -82.91 -20.97 34.38 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 115.44 1.644 . . . . 0.0 115.44 166.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -140.53 79.0 20.86 Favored Pre-proline 0 CA--C 1.547 0.86 0 C-N-CA 127.077 2.151 . . . . 0.0 111.419 -167.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -63.81 6.03 0.31 Allowed 'Trans proline' 0 CA--C 1.55 1.311 0 C-N-CA 124.252 3.301 . . . . 0.0 116.878 -169.184 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 40.5 p90 -103.55 -6.76 21.4 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 127.402 2.281 . . . . 0.0 114.668 175.425 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 13.7 tp -64.82 135.5 55.85 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 -165.381 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 85.0 mtp180 -86.21 156.57 20.25 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.593 1.557 . . . . 0.0 113.063 178.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.404 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -138.38 131.49 30.02 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.726 2.01 . . . . 0.0 110.043 -173.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 33.3 t0 -146.6 135.96 22.83 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.066 0.946 . . . . 0.0 111.432 177.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 66.3 mtt -133.3 3.41 3.64 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 114.467 1.284 . . . . 0.0 114.467 -173.503 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 72.5 m -60.6 145.05 50.33 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 119.166 0.894 . . . . 0.0 110.96 173.082 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -61.82 -25.39 67.47 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 114.813 1.412 . . . . 0.0 114.813 -163.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -56.11 -38.38 70.69 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.091 0.956 . . . . 0.0 112.719 171.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.77 -35.75 75.28 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 123.8 0.84 . . . . 0.0 112.05 172.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 4.8 mm -78.35 -43.61 26.88 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 C-N-CA 123.85 0.86 . . . . 0.0 109.544 -175.052 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -59.5 -43.53 93.33 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.255 0.622 . . . . 0.0 111.932 173.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.72 -39.27 57.63 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.52 1.128 . . . . 0.0 112.774 -174.52 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 88.2 mtt-85 -69.63 -40.3 76.62 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.749 0.82 . . . . 0.0 112.478 172.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -127.67 77.89 75.57 Favored Pre-proline 0 CA--C 1.544 0.748 0 C-N-CA 125.094 1.358 . . . . 0.0 111.142 -168.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -68.02 -10.1 27.82 Favored 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 123.389 2.726 . . . . 0.0 114.097 -175.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 14.2 p-80 -78.9 -21.9 46.7 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.144 0.977 . . . . 0.0 113.469 169.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -89.7 -32.52 16.99 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.774 1.63 . . . . 0.0 112.462 -168.844 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 . . . . . 0 C--O 1.254 1.335 0 C-N-CA 124.723 1.209 . . . . 0.0 113.715 174.811 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.5 mpp? . . . . . 0 N--CA 1.497 1.91 0 CA-C-O 120.7 0.286 . . . . 0.0 111.486 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 14.0 ptt180 -69.19 152.47 45.05 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 125.314 1.445 . . . . 0.0 113.657 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 171.46 116.48 0.39 Allowed Glycine 0 CA--C 1.534 1.232 0 C-N-CA 125.018 1.294 . . . . 0.0 112.26 176.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 78.7 p -110.94 -0.29 16.82 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 125.48 1.512 . . . . 0.0 114.601 -173.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -120.75 148.39 44.04 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.628 1.571 . . . . 0.0 112.344 -177.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 53.6 p-80 -148.38 160.5 42.95 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.97 1.708 . . . . 0.0 111.683 178.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 39.8 t-80 -143.45 152.68 41.82 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.552 1.141 . . . . 0.0 111.723 175.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 46.2 p-80 -87.92 -18.74 28.49 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 115.003 1.483 . . . . 0.0 115.003 -172.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 58.0 t-80 -95.9 135.65 37.37 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 119.169 0.895 . . . . 0.0 113.261 -173.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 64.5 t60 -155.58 150.21 26.19 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.598 1.559 . . . . 0.0 111.132 169.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 158.44 160.34 10.23 Favored Glycine 0 CA--C 1.535 1.322 0 C-N-CA 124.503 1.049 . . . . 0.0 114.264 173.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.7 t -153.63 145.03 23.11 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.065 1.346 . . . . 0.0 111.816 173.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.9 m -131.47 11.47 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 C-N-CA 125.809 1.644 . . . . 0.0 112.99 178.252 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 40.0 m -82.37 54.24 2.52 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 125.678 1.591 . . . . 0.0 113.276 -169.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 82.4 m-85 -133.72 166.13 23.33 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.907 1.683 . . . . 0.0 112.99 -172.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 104.87 107.38 3.21 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 125.732 1.635 . . . . 0.0 112.77 178.409 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -153.39 153.06 28.75 Favored Pre-proline 0 CA--C 1.552 1.037 0 C-N-CA 126.157 1.783 . . . . 0.0 111.049 177.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -71.17 140.94 38.48 Favored 'Trans proline' 0 CA--C 1.543 0.957 0 C-N-CA 123.148 2.565 . . . . 0.0 112.373 177.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 71.2 m -138.82 63.57 32.31 Favored Pre-proline 0 N--CA 1.477 0.888 0 C-N-CA 125.193 1.397 . . . . 0.0 111.847 -179.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -67.78 131.7 24.88 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 C-N-CA 123.337 2.691 . . . . 0.0 112.387 -177.071 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 62.3 tp -155.76 134.2 11.67 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.309 1.443 . . . . 0.0 111.051 178.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 31.6 t -154.83 131.35 10.54 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.648 1.179 . . . . 0.0 111.22 170.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.3 t -158.99 82.52 0.79 Allowed 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.849 1.259 . . . . 0.0 110.416 175.166 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -140.62 -11.81 1.02 Allowed 'General case' 0 N--CA 1.479 1.016 0 N-CA-C 115.797 1.777 . . . . 0.0 115.797 -174.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 21.3 t -65.39 111.98 3.31 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 119.516 1.053 . . . . 0.0 111.407 -171.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 53.63 20.46 2.17 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 125.867 1.667 . . . . 0.0 114.583 -173.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -75.3 -27.45 59.34 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 -169.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -137.82 12.22 2.91 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 125.893 1.677 . . . . 0.0 113.898 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 23.2 mm -87.93 67.64 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 124.495 1.118 . . . . 0.0 110.484 -170.519 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 64.4 t-20 -146.74 127.63 14.46 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.585 1.554 . . . . 0.0 110.73 177.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 21.0 t80 -133.87 14.29 3.97 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.898 1.279 . . . . 0.0 113.292 177.075 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 23.7 ptp -104.63 3.03 31.2 Favored 'General case' 0 N--CA 1.48 1.028 0 N-CA-C 115.041 1.497 . . . . 0.0 115.041 -171.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.9 t -142.0 74.25 21.88 Favored Pre-proline 0 N--CA 1.477 0.891 0 C-N-CA 124.433 1.093 . . . . 0.0 111.675 179.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -70.97 156.84 59.47 Favored 'Trans proline' 0 CA--C 1.55 1.281 0 C-N-CA 123.39 2.727 . . . . 0.0 112.488 177.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -71.09 153.55 62.71 Favored 'Trans proline' 0 CA--C 1.542 0.916 0 C-N-CA 123.588 2.858 . . . . 0.0 112.869 178.372 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -126.49 9.46 7.17 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 124.555 1.142 . . . . 0.0 113.957 -176.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 18.9 mm100 -131.59 151.73 51.36 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.732 1.613 . . . . 0.0 112.054 -179.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -150.72 165.21 34.15 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.707 2.003 . . . . 0.0 110.883 174.3 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 51.72 41.53 29.11 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 125.503 1.521 . . . . 0.0 114.646 176.363 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -141.96 58.5 8.14 Favored Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 125.44 1.496 . . . . 0.0 109.692 179.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -72.34 151.9 54.63 Favored 'Trans proline' 0 CA--C 1.542 0.897 0 C-N-CA 123.245 2.63 . . . . 0.0 112.433 -170.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 74.71 -39.39 1.1 Allowed Glycine 0 CA--C 1.539 1.539 0 C-N-CA 125.808 1.671 . . . . 0.0 114.791 -176.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . 58.64 25.88 13.82 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 126.718 2.007 . . . . 0.0 115.87 176.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 11.0 mp -73.21 153.3 40.73 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.749 1.22 . . . . 0.0 111.643 171.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -146.43 153.09 40.06 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.894 1.678 . . . . 0.0 112.661 173.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -96.7 149.07 22.22 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.064 1.346 . . . . 0.0 112.401 174.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 89.5 mt -128.29 157.39 41.07 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.694 1.597 . . . . 0.0 111.741 -179.293 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -77.46 140.02 39.75 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.898 0.879 . . . . 0.0 110.479 167.195 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -99.1 -12.39 20.55 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 -174.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -149.49 168.16 24.24 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.786 1.235 . . . . 0.0 113.211 -172.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.78 -164.47 54.14 Favored Glycine 0 CA--C 1.54 1.615 0 C-N-CA 124.151 0.882 . . . . 0.0 114.094 179.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -67.72 -16.82 47.14 Favored 'Trans proline' 0 CA--C 1.542 0.925 0 C-N-CA 123.254 2.636 . . . . 0.0 113.674 -177.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.1 mt -92.49 4.42 53.55 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.784 1.234 . . . . 0.0 113.877 175.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.01 122.9 11.93 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 120.922 1.692 . . . . 0.0 112.088 -177.342 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.23 4.45 89.65 Favored Glycine 0 CA--C 1.54 1.612 0 C-N-CA 125.418 1.485 . . . . 0.0 115.384 -174.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 21.5 mt -103.85 160.05 27.33 Favored Pre-proline 0 CA--C 1.555 1.141 0 C-N-CA 126.204 1.802 . . . . 0.0 111.174 179.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -80.23 156.69 22.8 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 124.12 3.213 . . . . 0.0 113.664 -163.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 24.1 t -95.52 -36.32 6.59 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -177.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 22.2 p -123.52 174.24 7.52 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 124.965 1.306 . . . . 0.0 114.413 -178.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -64.12 -39.52 94.22 Favored 'General case' 0 N--CA 1.483 1.184 0 O-C-N 121.176 -0.953 . . . . 0.0 110.83 176.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 35.1 m -61.42 -45.1 95.74 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.196 0.998 . . . . 0.0 111.283 171.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -61.35 -46.92 88.22 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 118.842 0.746 . . . . 0.0 111.16 175.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.16 -38.69 89.99 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.467 -0.77 . . . . 0.0 112.313 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 69.4 ttt180 -67.3 -41.56 85.18 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 119.202 0.91 . . . . 0.0 112.622 173.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 59.7 t -61.12 -49.98 82.43 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 CA-C-N 118.713 0.688 . . . . 0.0 110.972 173.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -62.61 -40.75 97.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 118.319 -0.848 . . . . 0.0 112.464 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 48.8 mt -56.36 -50.72 70.6 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 CA-C-N 119.17 0.895 . . . . 0.0 110.31 170.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -64.29 -45.44 87.98 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -178.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 55.4 t30 -68.39 -46.58 69.63 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.918 0.887 . . . . 0.0 111.948 -177.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 55.6 mm-40 -60.19 -51.75 68.26 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 118.488 -0.767 . . . . 0.0 110.55 172.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.426 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 60.4 t90 -56.26 -47.17 79.06 Favored 'General case' 0 C--O 1.222 -0.358 0 CA-C-N 119.526 1.057 . . . . 0.0 111.929 177.673 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -58.39 -45.5 88.22 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 120.46 1.482 . . . . 0.0 113.027 178.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -69.46 -49.72 52.26 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-N 120.001 1.273 . . . . 0.0 112.747 178.126 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 32.6 mmt180 -59.0 -41.05 86.76 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.93 0.892 . . . . 0.0 109.839 178.066 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 21.5 ttpt -69.7 -31.86 70.13 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.088 1.355 . . . . 0.0 113.447 174.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -59.52 -33.22 71.1 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 120.022 1.283 . . . . 0.0 110.777 167.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 53.1 m -81.02 -24.32 37.99 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 115.453 1.649 . . . . 0.0 115.453 165.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -140.02 78.89 23.47 Favored Pre-proline 0 CA--C 1.552 1.024 0 C-N-CA 127.004 2.122 . . . . 0.0 112.251 -168.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -61.66 -5.81 6.34 Favored 'Trans proline' 0 CA--C 1.549 1.231 0 C-N-CA 123.859 3.039 . . . . 0.0 116.653 -168.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 41.4 p90 -90.89 -6.37 54.26 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.795 2.038 . . . . 0.0 114.887 175.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.3 tp -62.77 135.5 57.38 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 119.702 1.137 . . . . 0.0 113.776 -168.089 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 54.3 mmt-85 -86.06 157.36 20.08 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.61 1.164 . . . . 0.0 112.761 179.199 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.426 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -136.72 131.82 34.01 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 126.714 2.005 . . . . 0.0 110.04 -172.612 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 54.9 t0 -142.89 131.09 21.98 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.186 0.994 . . . . 0.0 111.12 176.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 64.7 mtt -127.71 6.75 6.18 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.359 1.464 . . . . 0.0 113.56 -177.277 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 71.3 m -63.21 147.48 50.81 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 118.884 0.766 . . . . 0.0 110.39 169.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -61.27 -28.33 69.11 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -163.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -57.11 -34.34 68.26 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.459 1.104 . . . . 0.0 113.41 172.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.7 -40.21 96.42 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 119.075 0.852 . . . . 0.0 111.704 173.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.63 -45.71 65.85 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 C-N-CA 124.406 1.083 . . . . 0.0 109.212 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 8.4 m-30 -56.92 -46.43 82.0 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 118.716 0.689 . . . . 0.0 112.279 175.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.72 -38.49 62.3 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.68 1.192 . . . . 0.0 112.57 -173.03 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 75.1 mtp85 -72.37 -38.85 68.42 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 172.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 27.3 m-85 -130.23 83.37 63.19 Favored Pre-proline 0 CA--C 1.548 0.866 0 C-N-CA 125.256 1.423 . . . . 0.0 110.902 -168.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -66.99 -16.79 50.5 Favored 'Trans proline' 0 CA--C 1.541 0.832 0 C-N-CA 123.04 2.493 . . . . 0.0 114.252 -171.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 12.4 p-80 -74.86 -23.45 58.42 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.153 0.981 . . . . 0.0 113.257 173.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -82.65 -24.36 33.81 Favored 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 125.719 1.608 . . . . 0.0 112.723 -171.708 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 8.3 tmm_? . . . . . 0 C--O 1.254 1.292 0 C-N-CA 125.162 1.385 . . . . 0.0 111.918 178.445 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.9 mtt . . . . . 0 N--CA 1.498 1.951 0 CA-C-O 119.826 -0.13 . . . . 0.0 111.185 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -142.2 148.89 38.93 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 126.12 1.768 . . . . 0.0 110.232 166.014 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 163.86 41.93 0.02 OUTLIER Glycine 0 N--CA 1.475 1.272 0 N-CA-C 114.761 0.664 . . . . 0.0 114.761 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 40.4 m -66.31 124.89 23.93 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.123 0.969 . . . . 0.0 112.856 -172.077 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 5.0 t-80 -138.27 14.53 2.81 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.975 1.31 . . . . 0.0 113.279 -178.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 11.5 p80 -80.64 -7.07 59.17 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 114.983 1.475 . . . . 0.0 114.983 -171.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 77.3 t60 -67.69 -22.91 65.25 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.434 1.094 . . . . 0.0 113.86 -177.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 86.2 m-70 -80.94 44.6 0.76 Allowed 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.704 1.602 . . . . 0.0 113.894 -171.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 78.6 t60 -68.39 144.06 54.88 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.756 1.222 . . . . 0.0 112.54 177.574 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 56.0 t-80 -153.79 148.61 26.52 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.763 1.625 . . . . 0.0 111.196 178.187 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -150.28 7.48 0.73 Allowed Glycine 0 CA--C 1.537 1.434 0 N-CA-C 116.533 1.373 . . . . 0.0 116.533 -178.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 21.7 m -78.66 141.6 37.84 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 119.36 1.58 . . . . 0.0 112.382 -178.203 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.5 p -150.65 152.76 11.14 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 125.197 1.399 . . . . 0.0 111.359 -179.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 33.2 t -140.37 149.62 42.9 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.955 1.302 . . . . 0.0 112.039 176.537 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 22.4 t80 -134.98 28.94 3.47 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.887 1.675 . . . . 0.0 111.319 175.431 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 74.79 -156.98 50.04 Favored Glycine 0 CA--C 1.536 1.403 0 C-N-CA 124.282 0.944 . . . . 0.0 112.78 -168.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -130.77 63.15 69.02 Favored Pre-proline 0 CA--C 1.554 1.121 0 C-N-CA 124.837 1.255 . . . . 0.0 112.517 -178.539 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_endo -67.52 151.87 79.23 Favored 'Trans proline' 0 CA--C 1.542 0.919 0 C-N-CA 123.318 2.679 . . . . 0.0 112.523 177.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 78.6 p -152.11 155.97 33.66 Favored Pre-proline 0 N--CA 1.476 0.854 0 C-N-CA 125.358 1.463 . . . . 0.0 112.007 179.136 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -74.63 133.66 17.47 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 123.017 2.478 . . . . 0.0 112.009 177.295 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.3 mp -122.06 151.97 40.31 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.869 1.668 . . . . 0.0 111.018 175.298 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 78.1 p -147.62 149.02 31.74 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.24 1.416 . . . . 0.0 111.764 172.129 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.5 m -135.77 9.35 3.34 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 -170.039 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -146.78 140.18 25.64 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.788 1.235 . . . . 0.0 111.937 -175.495 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 15.4 t -154.09 152.31 30.3 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.339 1.456 . . . . 0.0 111.196 174.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 52.91 40.93 31.77 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 125.493 1.517 . . . . 0.0 113.953 177.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -74.23 82.69 1.84 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.505 1.122 . . . . 0.0 111.549 179.511 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 56.28 31.33 18.32 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 125.861 1.664 . . . . 0.0 113.701 -171.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 55.5 mt -88.52 104.58 14.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 C-N-CA 124.222 1.009 . . . . 0.0 109.394 178.175 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -152.96 156.15 38.33 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.152 1.381 . . . . 0.0 111.865 174.13 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 98.2 m-85 -137.61 152.08 49.0 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.482 1.513 . . . . 0.0 111.351 179.661 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 98.0 mtp -78.24 -31.25 49.14 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.469 0.915 . . . . 0.0 113.469 -174.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 24.8 p -144.46 153.54 55.52 Favored Pre-proline 0 N--CA 1.478 0.971 0 C-N-CA 125.552 1.541 . . . . 0.0 112.255 -175.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -71.02 159.09 53.52 Favored 'Trans proline' 0 CA--C 1.549 1.268 0 C-N-CA 123.216 2.611 . . . . 0.0 112.103 171.471 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -66.99 147.03 79.39 Favored 'Trans proline' 0 CA--C 1.539 0.755 0 C-N-CA 123.31 2.673 . . . . 0.0 112.57 177.228 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -94.12 -14.79 25.33 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.261 1.424 . . . . 0.0 113.761 178.119 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -134.93 129.06 33.72 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 126.098 1.759 . . . . 0.0 110.321 176.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -132.55 10.02 4.35 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.662 1.185 . . . . 0.0 113.37 -175.432 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -134.66 72.0 1.45 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.22 1.408 . . . . 0.0 111.861 -170.779 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -145.49 66.78 12.45 Favored Pre-proline 0 CA--C 1.548 0.877 0 C-N-CA 125.008 1.323 . . . . 0.0 109.218 172.53 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -72.46 152.88 55.08 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 123.232 2.621 . . . . 0.0 112.85 -167.541 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 75.23 -45.95 1.81 Allowed Glycine 0 CA--C 1.539 1.582 0 C-N-CA 125.588 1.566 . . . . 0.0 114.295 -175.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . 52.77 71.47 0.48 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 127.059 2.143 . . . . 0.0 114.356 179.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -101.0 151.62 21.56 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.0 1.72 . . . . 0.0 111.55 176.383 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -135.98 146.39 47.18 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.627 1.571 . . . . 0.0 112.425 176.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -87.62 158.79 18.78 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.756 1.223 . . . . 0.0 111.562 167.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 95.8 mt -135.83 157.03 47.86 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 125.34 1.456 . . . . 0.0 111.812 -177.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -82.2 139.97 33.99 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.535 0.734 . . . . 0.0 109.463 162.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -101.28 -19.07 15.82 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -173.359 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -140.1 164.12 30.9 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 125.323 1.449 . . . . 0.0 112.145 -173.129 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 72.37 -161.37 54.33 Favored Glycine 0 CA--C 1.542 1.727 0 C-N-CA 124.105 0.86 . . . . 0.0 113.992 179.269 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -67.9 -16.8 46.23 Favored 'Trans proline' 0 CA--C 1.541 0.872 0 C-N-CA 123.325 2.684 . . . . 0.0 113.895 -174.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 89.5 mt -95.24 6.78 48.09 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.81 1.244 . . . . 0.0 113.829 175.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.2 113.52 1.97 Allowed 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 121.067 1.758 . . . . 0.0 112.018 -178.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.63 7.68 64.62 Favored Glycine 0 CA--C 1.542 1.779 0 C-N-CA 125.418 1.485 . . . . 0.0 115.672 -173.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 5.7 mp -108.61 155.73 40.02 Favored Pre-proline 0 CA--C 1.556 1.211 0 C-N-CA 126.666 1.986 . . . . 0.0 111.877 179.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -64.82 163.35 28.32 Favored 'Trans proline' 0 C--N 1.354 0.817 0 C-N-CA 125.207 3.938 . . . . 0.0 114.235 -172.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 9.1 t -106.96 -30.29 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 123.719 0.808 . . . . 0.0 112.041 174.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 24.2 p -126.88 169.52 13.18 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 125.161 1.385 . . . . 0.0 114.004 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 41.0 ptt180 -61.97 -36.07 80.35 Favored 'General case' 0 N--CA 1.482 1.138 0 O-C-N 121.306 -0.871 . . . . 0.0 111.789 173.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 22.3 m -63.86 -43.3 96.53 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.361 1.065 . . . . 0.0 110.845 172.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -60.81 -49.75 76.23 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 118.688 0.676 . . . . 0.0 111.2 174.494 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.41 -42.97 93.03 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-N 118.721 0.691 . . . . 0.0 112.308 -179.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.94 -49.04 76.34 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.261 1.024 . . . . 0.0 111.895 175.808 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 51.7 t -60.2 -47.59 91.51 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 123.638 0.775 . . . . 0.0 111.234 177.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 88.0 mt -61.6 -42.87 99.48 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 118.277 -0.868 . . . . 0.0 111.968 179.222 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 55.7 mt -56.79 -52.7 51.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 CA-C-N 119.147 0.885 . . . . 0.0 110.156 172.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -64.44 -45.97 85.15 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 -176.361 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 46.2 m-20 -67.2 -49.11 65.82 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.337 1.055 . . . . 0.0 111.811 -178.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -65.33 -43.22 91.63 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 118.927 -0.558 . . . . 0.0 110.972 179.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.413 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 58.2 t90 -57.48 -47.66 81.28 Favored 'General case' 0 C--O 1.217 -0.612 0 CA-C-O 117.217 -1.373 . . . . 0.0 111.315 170.693 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -61.13 -40.79 95.12 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 121.124 1.784 . . . . 0.0 113.519 -178.822 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -65.92 -51.58 57.37 Favored 'General case' 0 N--CA 1.478 0.965 0 CA-C-N 120.212 1.369 . . . . 0.0 111.896 175.253 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -55.28 -48.25 74.33 Favored 'General case' 0 C--O 1.215 -0.715 0 C-N-CA 122.921 0.488 . . . . 0.0 110.491 176.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.24 -33.19 75.19 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 126.772 2.029 . . . . 0.0 113.648 179.125 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 44.6 mttp -61.37 -31.46 71.35 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 120.163 1.347 . . . . 0.0 111.579 166.401 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 5.6 t -81.76 -24.86 35.78 Favored 'General case' 0 N--CA 1.484 1.262 0 N-CA-C 115.04 1.496 . . . . 0.0 115.04 165.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -137.8 72.69 48.23 Favored Pre-proline 0 CA--C 1.552 1.031 0 C-N-CA 127.708 2.403 . . . . 0.0 111.754 -165.42 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -61.52 -9.05 12.21 Favored 'Trans proline' 0 CA--C 1.547 1.13 0 C-N-CA 123.667 2.911 . . . . 0.0 116.296 -166.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 41.3 p90 -82.89 -15.15 52.58 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 126.267 1.827 . . . . 0.0 114.812 174.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 20.6 tp -60.54 134.82 57.45 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 114.514 1.301 . . . . 0.0 114.514 -162.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 6.7 mmp_? -74.92 155.0 37.91 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.753 1.221 . . . . 0.0 112.619 177.222 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.413 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -136.16 126.84 27.19 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 126.374 1.87 . . . . 0.0 109.989 -177.244 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 55.1 t0 -147.47 122.99 10.42 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.726 0.81 . . . . 0.0 110.738 171.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 3.4 ptt? -137.79 31.83 2.49 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.955 1.702 . . . . 0.0 111.707 173.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 27.1 t -62.12 152.62 32.41 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 121.582 -0.699 . . . . 0.0 110.143 161.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -53.82 -37.32 63.45 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 121.027 -1.046 . . . . 0.0 113.525 -169.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -61.32 -33.4 73.53 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.007 0.923 . . . . 0.0 112.729 176.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.4 -39.01 93.03 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 123.505 0.722 . . . . 0.0 111.777 173.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.98 -45.36 64.2 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 123.482 0.713 . . . . 0.0 109.301 179.246 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 10.8 m-30 -55.09 -46.46 75.49 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.032 0.533 . . . . 0.0 112.17 175.025 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.55 -31.02 41.96 Favored 'General case' 0 C--N 1.343 0.306 0 C-N-CA 124.712 1.205 . . . . 0.0 113.771 -172.683 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 86.0 mtt180 -82.78 -32.54 27.71 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.818 0.847 . . . . 0.0 112.854 173.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -126.86 73.93 75.95 Favored Pre-proline 0 CA--C 1.543 0.702 0 C-N-CA 125.723 1.609 . . . . 0.0 110.874 -173.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -66.71 -12.7 36.99 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 123.2 2.6 . . . . 0.0 113.874 -176.413 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 15.0 p-80 -73.65 -23.87 59.91 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.041 0.936 . . . . 0.0 113.258 170.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -85.79 -34.06 21.22 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.814 1.646 . . . . 0.0 112.102 -168.395 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 2.9 tmm_? . . . . . 0 C--O 1.256 1.397 0 C-N-CA 125.71 1.604 . . . . 0.0 111.117 176.681 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.9 ttt . . . . . 0 N--CA 1.495 1.82 0 CA-C-O 120.521 0.201 . . . . 0.0 110.762 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 80.2 mtp180 -142.19 160.99 39.13 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 125.995 1.718 . . . . 0.0 111.961 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 74.68 78.81 0.59 Allowed Glycine 0 CA--C 1.534 1.224 0 C-N-CA 124.992 1.282 . . . . 0.0 114.982 166.448 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.4 t -148.03 130.26 15.56 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.49 1.116 . . . . 0.0 111.541 170.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 52.9 t-80 -154.69 133.97 12.52 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.587 1.555 . . . . 0.0 110.798 176.206 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 87.7 m-70 -143.11 107.73 4.84 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.466 1.106 . . . . 0.0 111.134 -176.2 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 86.0 t60 -155.61 146.03 21.89 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.722 1.209 . . . . 0.0 112.244 173.177 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 78.2 t60 -154.2 143.68 21.5 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.149 1.38 . . . . 0.0 111.543 166.579 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 44.4 p-80 -150.15 152.33 34.54 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.145 1.378 . . . . 0.0 111.302 166.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 54.6 t-80 -154.36 143.63 21.29 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.241 1.016 . . . . 0.0 112.381 177.457 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 77.96 155.92 8.17 Favored Glycine 0 CA--C 1.539 1.536 0 C-N-CA 125.155 1.36 . . . . 0.0 115.605 173.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.3 t -159.13 148.94 18.95 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.961 1.704 . . . . 0.0 110.881 174.121 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.6 p -151.85 141.16 15.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 124.651 1.18 . . . . 0.0 111.877 176.611 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 68.5 m -141.99 140.5 32.7 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.779 1.632 . . . . 0.0 110.82 175.777 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 55.4 p90 -153.47 163.52 39.8 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.67 1.188 . . . . 0.0 112.758 -179.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 85.5 134.3 3.27 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 125.502 1.525 . . . . 0.0 114.156 178.041 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -150.85 65.98 7.16 Favored Pre-proline 0 CA--C 1.554 1.1 0 C-N-CA 125.443 1.497 . . . . 0.0 111.208 178.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -68.23 143.97 60.87 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 123.508 2.805 . . . . 0.0 113.062 -174.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 59.3 p -148.98 47.68 0.52 Allowed Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 125.088 1.355 . . . . 0.0 113.83 178.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -64.24 139.92 68.41 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 123.118 2.545 . . . . 0.0 112.838 -176.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.8 tt -152.15 118.85 5.72 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.171 1.388 . . . . 0.0 110.01 179.432 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 23.2 t -152.02 146.4 25.54 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.477 1.111 . . . . 0.0 111.776 170.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 79.2 p -145.16 12.64 1.4 Allowed 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.476 1.51 . . . . 0.0 113.797 -178.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -111.86 157.77 20.23 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.028 1.331 . . . . 0.0 113.355 -170.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 8.6 t -146.75 165.82 28.49 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.576 1.55 . . . . 0.0 111.436 176.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 61.15 -8.01 0.08 Allowed 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 127.732 2.413 . . . . 0.0 116.998 -179.64 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -68.07 -13.88 62.54 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.066 1.346 . . . . 0.0 114.249 -177.689 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -111.43 1.31 16.92 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.811 1.644 . . . . 0.0 113.107 173.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 27.1 mt -106.39 89.13 1.27 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 124.519 1.128 . . . . 0.0 110.548 -169.686 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -148.98 152.83 37.0 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.178 1.391 . . . . 0.0 110.512 169.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -71.94 162.43 29.47 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.526 0.73 . . . . 0.0 112.161 171.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 26.7 ttt -149.79 144.93 26.33 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.038 1.335 . . . . 0.0 110.55 172.219 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 16.9 p -71.46 151.94 93.98 Favored Pre-proline 0 N--CA 1.477 0.919 0 C-N-CA 124.238 1.015 . . . . 0.0 112.478 176.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -67.94 153.99 73.94 Favored 'Trans proline' 0 CA--C 1.546 1.1 0 C-N-CA 122.912 2.408 . . . . 0.0 112.447 178.064 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -70.6 157.06 59.84 Favored 'Trans proline' 0 CA--C 1.541 0.828 0 C-N-CA 123.422 2.748 . . . . 0.0 112.743 179.16 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 77.9 mm-40 -133.74 152.84 51.98 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.619 1.568 . . . . 0.0 111.498 176.226 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -76.1 139.55 41.4 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.615 0.766 . . . . 0.0 111.765 179.383 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -130.56 17.05 5.35 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 114.178 1.177 . . . . 0.0 114.178 178.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 52.35 51.37 16.37 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 126.554 1.942 . . . . 0.0 113.417 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -144.89 69.96 14.75 Favored Pre-proline 0 CA--C 1.55 0.966 0 C-N-CA 124.924 1.29 . . . . 0.0 110.478 -171.632 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -84.99 174.81 7.06 Favored 'Trans proline' 0 CA--C 1.545 1.031 0 C-N-CA 123.823 3.015 . . . . 0.0 113.632 -168.341 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 95.85 167.78 34.87 Favored Glycine 0 CA--C 1.538 1.531 0 C-N-CA 125.438 1.494 . . . . 0.0 114.818 177.432 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -128.07 16.79 6.72 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.226 1.41 . . . . 0.0 114.42 -172.259 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.4 mp -95.82 156.91 16.13 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.841 1.656 . . . . 0.0 110.739 174.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -135.19 131.49 36.79 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.112 0.965 . . . . 0.0 112.431 174.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -87.43 158.55 18.96 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.156 1.382 . . . . 0.0 111.227 167.204 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 96.6 mt -133.7 156.81 47.27 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.927 1.291 . . . . 0.0 112.379 -175.27 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 -79.41 137.48 37.28 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.438 0.695 . . . . 0.0 110.125 163.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -95.66 -15.11 22.93 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 -174.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -150.04 169.3 21.55 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.888 1.275 . . . . 0.0 112.944 -173.01 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.16 -164.5 54.91 Favored Glycine 0 CA--C 1.54 1.641 0 C-N-CA 124.107 0.861 . . . . 0.0 114.054 179.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -67.71 -17.42 47.66 Favored 'Trans proline' 0 CA--C 1.541 0.83 0 C-N-CA 123.312 2.675 . . . . 0.0 113.827 -176.091 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 98.0 mt -94.31 6.85 47.4 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.553 1.141 . . . . 0.0 113.878 175.225 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -54.67 122.06 9.83 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 120.829 1.649 . . . . 0.0 112.037 -178.262 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 82.3 8.32 86.49 Favored Glycine 0 CA--C 1.541 1.702 0 C-N-CA 125.138 1.351 . . . . 0.0 115.453 -175.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 25.4 mt -106.44 160.62 25.61 Favored Pre-proline 0 CA--C 1.558 1.256 0 C-N-CA 126.557 1.943 . . . . 0.0 111.189 178.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -69.55 163.77 36.84 Favored 'Trans proline' 0 C--N 1.354 0.866 0 C-N-CA 124.386 3.391 . . . . 0.0 113.591 -169.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 11.3 t -105.83 -30.24 2.68 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 O-C-N 121.454 -0.779 . . . . 0.0 112.177 174.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 23.2 p -126.65 171.54 11.05 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 125.184 1.394 . . . . 0.0 114.099 -178.212 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 39.0 ttm180 -61.64 -37.98 86.0 Favored 'General case' 0 N--CA 1.48 1.054 0 O-C-N 121.487 -0.758 . . . . 0.0 110.947 171.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 10.1 t -59.47 -48.74 80.49 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 123.613 0.765 . . . . 0.0 110.331 172.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -60.44 -47.35 86.48 Favored 'General case' 0 CA--C 1.537 0.47 0 O-C-N 122.137 -0.352 . . . . 0.0 111.1 177.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.89 -44.32 97.03 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 118.733 0.697 . . . . 0.0 112.778 -179.592 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 57.8 ttm-85 -62.41 -46.98 86.1 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 119.112 0.869 . . . . 0.0 111.513 176.43 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 54.0 t -63.42 -46.23 95.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.055 0.942 . . . . 0.0 111.489 178.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 52.0 mt -60.66 -45.69 93.16 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 118.194 -0.908 . . . . 0.0 112.003 176.566 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 61.4 mt -54.58 -51.54 49.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 CA-C-N 119.263 0.938 . . . . 0.0 109.975 173.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -62.91 -47.04 84.97 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -178.268 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 57.6 m-20 -69.7 -46.27 66.39 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.947 0.899 . . . . 0.0 112.051 -176.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -63.25 -44.62 94.66 Favored 'General case' 0 N--CA 1.465 0.303 0 O-C-N 121.993 -0.442 . . . . 0.0 111.551 176.343 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.423 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 66.7 t90 -61.11 -47.73 84.9 Favored 'General case' 0 C--O 1.219 -0.517 0 CA-C-O 117.622 -1.18 . . . . 0.0 111.226 172.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -54.48 -44.5 72.66 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 120.907 1.685 . . . . 0.0 112.883 178.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -67.44 -53.87 25.27 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 119.492 1.042 . . . . 0.0 112.632 176.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 77.2 mtm-85 -64.47 -35.0 79.52 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 121.275 -0.89 . . . . 0.0 111.885 -177.546 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.8 tmtt? -74.09 -30.13 62.2 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.359 1.464 . . . . 0.0 113.594 174.543 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -61.75 -35.27 77.63 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 120.051 1.296 . . . . 0.0 110.929 165.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 8.2 t -74.46 -34.27 63.1 Favored 'General case' 0 CA--C 1.553 1.086 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 167.425 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -133.78 80.65 55.0 Favored Pre-proline 0 CA--C 1.549 0.905 0 C-N-CA 127.029 2.132 . . . . 0.0 111.749 -168.212 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -61.8 -6.31 7.34 Favored 'Trans proline' 0 CA--C 1.546 1.091 0 C-N-CA 123.604 2.869 . . . . 0.0 116.345 -168.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 44.1 p90 -88.9 -3.93 58.6 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.694 1.998 . . . . 0.0 114.828 174.534 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.6 tp -66.57 133.38 50.2 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 120.09 1.313 . . . . 0.0 113.255 -173.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 50.9 ttp180 -85.11 152.27 23.52 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.233 1.413 . . . . 0.0 112.723 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.423 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -132.28 130.92 41.49 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.985 2.114 . . . . 0.0 109.826 -174.504 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -143.87 136.04 26.65 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.151 0.98 . . . . 0.0 110.754 176.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 66.4 mtt -132.63 15.71 4.4 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.769 1.228 . . . . 0.0 113.567 -177.193 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 74.7 m -69.37 154.18 42.43 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.457 -0.777 . . . . 0.0 110.925 172.533 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -56.94 -34.54 68.12 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 121.018 -1.051 . . . . 0.0 113.709 -168.572 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -61.64 -32.77 72.94 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 176.235 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.8 -39.72 92.74 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 119.182 0.901 . . . . 0.0 111.665 174.287 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -74.11 -46.57 44.83 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 C-N-CA 124.536 1.134 . . . . 0.0 109.478 179.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 13.8 m-30 -54.94 -45.21 74.83 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 119.064 0.847 . . . . 0.0 112.416 175.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -76.6 -38.3 55.02 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.909 1.284 . . . . 0.0 112.227 -173.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 72.6 mtt85 -70.14 -39.14 75.56 Favored 'General case' 0 N--CA 1.483 1.213 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 171.342 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 29.7 m-85 -130.59 82.81 63.91 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 125.435 1.494 . . . . 0.0 110.988 -165.61 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -69.05 -5.74 16.51 Favored 'Trans proline' 0 CA--C 1.54 0.788 0 C-N-CA 123.728 2.952 . . . . 0.0 114.726 -172.262 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 7.6 p-80 -86.92 -20.51 27.27 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.144 1.378 . . . . 0.0 113.801 170.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -92.39 -14.1 29.14 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 125.881 1.673 . . . . 0.0 113.679 -171.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 14.0 ptt180 . . . . . 0 C--O 1.253 1.261 0 C-N-CA 125.251 1.42 . . . . 0.0 113.515 173.297 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.9 mtp . . . . . 0 N--CA 1.498 1.964 0 N-CA-C 111.094 0.035 . . . . 0.0 111.094 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 54.2 ttp85 51.02 46.65 26.13 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 126.3 1.84 . . . . 0.0 114.191 175.31 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -73.33 95.36 0.76 Allowed Glycine 0 CA--C 1.534 1.238 0 C-N-CA 124.26 0.933 . . . . 0.0 111.773 176.474 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 39.8 m 59.39 171.4 0.07 Allowed 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 126.472 1.909 . . . . 0.0 114.708 -171.39 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 32.8 p80 -77.14 163.19 26.82 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.912 0.885 . . . . 0.0 111.992 171.177 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 50.5 m80 -100.28 -85.45 0.41 Allowed 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.174 0.99 . . . . 0.0 111.873 -174.168 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 95.5 m-70 -144.2 -59.52 0.38 Allowed 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.321 1.449 . . . . 0.0 111.031 175.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 52.7 t-80 -155.24 148.87 25.28 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.885 1.674 . . . . 0.0 111.001 176.326 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -136.7 148.31 47.27 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.306 1.442 . . . . 0.0 111.506 175.22 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 56.4 t-80 -145.3 151.87 39.02 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.905 1.282 . . . . 0.0 112.376 -177.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -175.03 153.4 15.54 Favored Glycine 0 CA--C 1.536 1.386 0 C-N-CA 125.213 1.387 . . . . 0.0 112.493 173.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 66.1 m -138.92 146.99 41.73 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.115 1.366 . . . . 0.0 112.09 -176.75 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 23.9 m -138.29 152.95 26.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 125.636 1.574 . . . . 0.0 111.66 176.027 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 21.3 t -151.4 146.82 26.24 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.075 1.35 . . . . 0.0 110.916 175.083 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -138.96 148.57 43.69 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.888 1.275 . . . . 0.0 112.328 -172.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 81.89 129.93 1.2 Allowed Glycine 0 CA--C 1.538 1.492 0 C-N-CA 125.201 1.381 . . . . 0.0 113.26 -175.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -150.39 73.12 9.14 Favored Pre-proline 0 CA--C 1.553 1.06 0 C-N-CA 124.905 1.282 . . . . 0.0 111.336 -178.007 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -66.54 146.65 80.33 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 123.298 2.665 . . . . 0.0 112.481 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 33.3 p -146.17 60.54 6.39 Favored Pre-proline 0 N--CA 1.477 0.903 0 C-N-CA 124.782 1.233 . . . . 0.0 113.051 -174.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -62.16 142.85 93.41 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 123.17 2.58 . . . . 0.0 112.138 177.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -136.3 12.77 3.28 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 115.448 1.647 . . . . 0.0 115.448 -168.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 37.1 t -146.17 145.25 30.4 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.678 1.191 . . . . 0.0 112.157 178.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.4 t -141.12 19.07 2.27 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.914 1.685 . . . . 0.0 111.601 171.241 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.4 mp0 -105.56 153.21 22.08 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.798 1.639 . . . . 0.0 112.629 -168.218 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 6.7 t -137.07 53.39 1.89 Allowed 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.718 1.607 . . . . 0.0 110.663 179.135 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 58.67 14.18 3.0 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 126.246 1.819 . . . . 0.0 114.882 -174.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -81.01 -14.27 58.07 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.994 1.718 . . . . 0.0 114.959 -173.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -130.98 1.96 4.32 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 125.58 1.552 . . . . 0.0 113.03 176.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 17.4 mm -91.48 60.23 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 124.815 1.246 . . . . 0.0 110.225 -171.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 50.1 t-20 -144.07 107.96 4.7 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.509 1.524 . . . . 0.0 110.092 179.061 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 51.0 p90 -153.85 168.02 27.75 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.336 1.454 . . . . 0.0 112.058 -174.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 38.5 ttm 57.51 48.77 13.88 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.383 1.473 . . . . 0.0 113.119 -177.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 18.7 p -126.56 55.21 13.38 Favored Pre-proline 0 N--CA 1.48 1.058 0 C-N-CA 125.953 1.701 . . . . 0.0 113.112 -178.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -67.42 155.18 71.42 Favored 'Trans proline' 0 CA--C 1.549 1.229 0 C-N-CA 123.118 2.545 . . . . 0.0 112.689 178.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -72.37 151.72 54.23 Favored 'Trans proline' 0 CA--C 1.54 0.824 0 C-N-CA 123.416 2.744 . . . . 0.0 112.718 177.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -96.37 -20.01 18.79 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 179.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -149.79 37.17 0.72 Allowed 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.91 1.284 . . . . 0.0 112.098 -175.559 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -145.13 179.53 7.3 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 125.476 1.51 . . . . 0.0 111.151 -178.364 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 57.38 33.54 23.42 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 125.949 1.699 . . . . 0.0 114.58 -179.423 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -147.14 74.7 11.83 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 125.488 1.515 . . . . 0.0 109.385 176.374 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -82.81 60.9 7.34 Favored 'Trans proline' 0 CA--C 1.546 1.085 0 C-N-CA 124.151 3.234 . . . . 0.0 111.953 -170.098 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 77.9 173.1 40.29 Favored Glycine 0 CA--C 1.538 1.521 0 C-N-CA 125.089 1.328 . . . . 0.0 113.553 -169.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -148.81 133.22 17.57 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.389 1.076 . . . . 0.0 112.271 -179.674 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -127.32 153.91 45.6 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.301 1.84 . . . . 0.0 110.39 175.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -141.72 144.63 34.15 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.455 1.102 . . . . 0.0 113.073 173.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -91.33 155.78 18.26 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.152 1.381 . . . . 0.0 111.466 166.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 88.0 mt -132.5 158.03 43.14 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 125.05 1.34 . . . . 0.0 112.31 -174.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 -85.3 142.28 29.46 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.901 0.88 . . . . 0.0 110.042 163.001 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -102.48 -11.47 18.54 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 -171.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -149.19 167.12 26.83 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.658 1.183 . . . . 0.0 113.166 -172.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.02 -161.01 53.21 Favored Glycine 0 CA--C 1.541 1.709 0 C-N-CA 124.062 0.839 . . . . 0.0 113.854 179.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -67.63 -16.41 46.69 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 123.163 2.575 . . . . 0.0 113.563 -177.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 97.7 mt -93.3 5.22 52.27 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.657 1.183 . . . . 0.0 113.95 176.015 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.61 120.84 8.44 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-N 121.114 1.779 . . . . 0.0 112.025 -178.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 82.55 7.23 87.76 Favored Glycine 0 CA--C 1.54 1.652 0 C-N-CA 125.402 1.477 . . . . 0.0 115.45 -174.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 16.3 mt -104.68 159.86 27.92 Favored Pre-proline 0 CA--C 1.558 1.287 0 C-N-CA 126.371 1.868 . . . . 0.0 111.445 -178.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -71.9 163.92 37.3 Favored 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 124.63 3.554 . . . . 0.0 114.163 -168.029 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 10.5 t -108.88 -26.55 3.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 123.902 0.881 . . . . 0.0 112.52 176.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 22.3 p -127.05 172.0 10.87 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 125.508 1.523 . . . . 0.0 113.924 178.292 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -64.83 -36.8 85.51 Favored 'General case' 0 N--CA 1.484 1.264 0 O-C-N 121.183 -0.948 . . . . 0.0 111.251 173.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 32.5 m -61.59 -46.82 88.24 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.948 0.899 . . . . 0.0 111.017 171.095 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -59.36 -46.55 88.33 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 118.776 0.716 . . . . 0.0 111.014 175.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.47 -41.55 98.85 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.692 0.797 . . . . 0.0 112.698 -178.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 60.6 mtp85 -67.81 -39.15 84.01 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.517 0.727 . . . . 0.0 112.396 175.401 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 73.4 t -64.15 -46.56 93.24 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.112 0 CA-C-N 118.847 0.748 . . . . 0.0 111.312 174.255 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.7 mp -60.29 -45.3 93.83 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 118.417 -0.802 . . . . 0.0 112.506 175.439 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 51.1 mt -54.4 -49.86 61.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 CA-C-N 118.969 0.804 . . . . 0.0 110.187 172.303 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 13.8 t80 -63.39 -51.25 66.62 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -177.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -67.11 -43.88 81.33 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 119.103 0.865 . . . . 0.0 112.455 -177.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -56.44 -52.69 63.72 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.237 0.615 . . . . 0.0 110.127 174.551 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 62.9 t90 -59.01 -47.76 84.03 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-O 117.09 -1.433 . . . . 0.0 111.631 176.59 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -56.62 -47.58 79.34 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 121.262 1.846 . . . . 0.0 113.249 -179.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -68.26 -47.7 67.03 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 119.516 1.053 . . . . 0.0 111.938 179.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 15.8 mmp_? -61.47 -44.57 96.86 Favored 'General case' 0 C--O 1.216 -0.702 0 O-C-N 121.642 -0.661 . . . . 0.0 110.596 178.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -61.75 -35.64 78.69 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 126.102 1.761 . . . . 0.0 113.147 174.335 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 63.0 tttm -62.34 -34.64 77.04 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 119.225 0.92 . . . . 0.0 111.263 170.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 7.9 t -77.72 -29.69 51.35 Favored 'General case' 0 CA--C 1.555 1.168 0 N-CA-C 114.762 1.393 . . . . 0.0 114.762 166.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -133.39 81.21 55.87 Favored Pre-proline 0 N--CA 1.476 0.86 0 C-N-CA 127.511 2.324 . . . . 0.0 111.94 -165.643 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -63.94 7.37 0.21 Allowed 'Trans proline' 0 CA--C 1.551 1.337 0 C-N-CA 124.456 3.437 . . . . 0.0 117.009 -169.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 39.5 p90 -105.24 -6.01 20.12 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 127.199 2.2 . . . . 0.0 114.785 176.33 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 12.9 tp -66.61 139.46 57.89 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.65 1.352 . . . . 0.0 114.65 -168.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 18.2 mmt85 -97.98 158.17 15.69 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 125.342 1.457 . . . . 0.0 112.908 -178.154 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -139.16 129.81 25.98 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 126.333 1.853 . . . . 0.0 110.297 -167.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -147.3 134.33 20.35 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.208 1.003 . . . . 0.0 111.19 177.475 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 64.4 mtt -131.14 3.65 4.36 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -172.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 70.4 m -63.84 153.25 37.28 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.541 0.736 . . . . 0.0 110.904 172.068 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -55.34 -33.25 63.19 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 -166.554 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 57.6 mtmt -59.4 -35.46 74.01 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.851 0.86 . . . . 0.0 113.285 174.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.52 -39.59 94.05 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.209 0.913 . . . . 0.0 111.723 173.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.77 -46.48 61.18 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 C-N-CA 124.212 1.005 . . . . 0.0 109.276 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 13.2 m-30 -56.66 -45.55 81.58 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 118.737 0.699 . . . . 0.0 112.511 174.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.4 tmt_? -75.74 -37.18 59.57 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.482 1.113 . . . . 0.0 112.255 -172.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 37.3 mtp85 -70.99 -38.83 72.7 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 118.587 0.63 . . . . 0.0 112.665 169.397 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -131.27 83.57 59.36 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 125.23 1.412 . . . . 0.0 111.263 -167.638 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -66.88 -18.52 52.59 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 122.846 2.364 . . . . 0.0 113.977 -172.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 8.8 p-80 -72.29 -24.56 61.35 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.901 0.88 . . . . 0.0 113.187 173.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.14 -14.01 48.37 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 126.004 1.722 . . . . 0.0 113.296 -175.837 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.326 0 C-N-CA 124.821 1.249 . . . . 0.0 112.723 178.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.6 ttp . . . . . 0 N--CA 1.495 1.811 0 CA-C-O 119.398 -0.334 . . . . 0.0 110.85 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 64.29 158.17 0.09 Allowed 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 127.268 2.227 . . . . 0.0 114.455 -177.344 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 81.24 151.24 8.05 Favored Glycine 0 CA--C 1.538 1.507 0 C-N-CA 125.281 1.42 . . . . 0.0 114.297 -178.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 21.4 t -157.76 150.94 23.29 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.43 1.492 . . . . 0.0 111.301 177.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 19.4 p80 -151.05 156.1 40.39 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.107 1.363 . . . . 0.0 112.223 174.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 23.0 p80 -154.47 159.83 41.25 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.344 1.458 . . . . 0.0 111.558 174.229 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 20.5 p80 -153.07 155.61 37.17 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.646 1.179 . . . . 0.0 112.267 172.462 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 75.6 t60 -154.65 145.47 22.48 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.258 1.423 . . . . 0.0 111.145 171.667 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 18.1 p80 -154.45 152.94 30.73 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.781 1.233 . . . . 0.0 112.255 173.137 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 77.6 t60 -153.89 155.85 36.46 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.501 1.52 . . . . 0.0 111.004 170.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -172.21 33.17 0.13 Allowed Glycine 0 CA--C 1.535 1.292 0 N-CA-C 116.508 1.363 . . . . 0.0 116.508 -177.246 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 85.0 p -141.89 154.53 45.19 Favored 'General case' 0 N--CA 1.478 0.975 0 CA-C-N 118.969 1.385 . . . . 0.0 113.949 -178.191 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 12.7 p -156.71 -42.61 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.197 0 C-N-CA 124.54 1.136 . . . . 0.0 112.492 171.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 39.3 m 61.85 149.28 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 127.423 2.289 . . . . 0.0 115.377 -174.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -141.82 -15.66 0.8 Allowed 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 115.046 1.498 . . . . 0.0 115.046 -175.676 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -66.84 132.53 31.57 Favored Glycine 0 CA--C 1.536 1.377 0 O-C-N 121.108 -0.995 . . . . 0.0 113.5 -177.363 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -147.85 68.61 10.74 Favored Pre-proline 0 CA--C 1.553 1.074 0 C-N-CA 125.098 1.359 . . . . 0.0 111.479 -179.255 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -69.64 153.1 69.89 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 123.47 2.78 . . . . 0.0 112.775 -179.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 70.4 m -135.32 67.31 67.58 Favored Pre-proline 0 N--CA 1.475 0.812 0 C-N-CA 125.054 1.342 . . . . 0.0 111.926 -177.193 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -65.66 141.74 67.66 Favored 'Trans proline' 0 CA--C 1.542 0.904 0 C-N-CA 123.2 2.6 . . . . 0.0 111.939 177.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 27.0 tp -135.25 -10.69 2.21 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 114.336 1.235 . . . . 0.0 114.336 -171.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 32.1 p -79.15 141.54 37.16 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.362 1.065 . . . . 0.0 113.082 -178.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 47.4 m -139.27 19.42 2.58 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.841 1.256 . . . . 0.0 113.697 -174.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 54.76 30.94 14.48 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 125.241 1.417 . . . . 0.0 113.527 -173.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 29.9 p -87.95 154.77 20.25 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.123 1.769 . . . . 0.0 112.932 -179.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 59.41 15.44 4.42 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 115.734 1.753 . . . . 0.0 115.734 179.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -77.29 96.47 4.6 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 121.15 -0.969 . . . . 0.0 110.127 169.06 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 57.5 20.0 5.75 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 126.546 1.938 . . . . 0.0 115.91 177.434 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 40.9 pt -61.8 -17.4 17.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 O-C-N 120.248 -1.533 . . . . 0.0 114.969 -170.586 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -74.07 -16.61 61.03 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.085 0.954 . . . . 0.0 113.394 175.65 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 34.4 t80 -136.83 -19.91 1.32 Allowed 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 114.597 1.332 . . . . 0.0 114.597 -177.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 24.1 ttt -78.02 55.28 1.43 Allowed 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.5 1.52 . . . . 0.0 111.981 178.239 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 18.8 p -134.78 60.49 41.92 Favored Pre-proline 0 N--CA 1.477 0.898 0 C-N-CA 127.0 2.12 . . . . 0.0 111.193 -174.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -67.88 160.69 47.29 Favored 'Trans proline' 0 CA--C 1.549 1.245 0 C-N-CA 123.567 2.845 . . . . 0.0 113.326 -175.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -78.77 56.41 5.94 Favored 'Trans proline' 0 CA--C 1.545 1.062 0 C-N-CA 124.791 3.661 . . . . 0.0 112.11 178.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -125.64 152.25 45.45 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 127.138 2.175 . . . . 0.0 111.302 -174.121 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -130.49 -36.04 1.47 Allowed 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 114.416 1.265 . . . . 0.0 114.416 -177.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -149.99 145.66 26.57 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.993 1.317 . . . . 0.0 112.258 177.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -151.49 45.65 0.79 Allowed 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.072 1.349 . . . . 0.0 111.993 -174.361 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 16.7 pt20 -143.74 59.37 7.18 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 124.371 1.068 . . . . 0.0 112.574 -171.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -77.44 -21.72 11.41 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 122.931 2.421 . . . . 0.0 114.122 -168.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 68.76 19.8 73.6 Favored Glycine 0 CA--C 1.538 1.527 0 N-CA-C 115.959 1.144 . . . . 0.0 115.959 170.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -144.74 152.15 39.95 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.913 1.285 . . . . 0.0 112.633 -175.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -112.0 167.76 10.13 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.965 2.106 . . . . 0.0 112.175 175.626 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -117.49 128.13 54.68 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.352 1.061 . . . . 0.0 112.611 177.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -87.01 146.33 26.16 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.725 1.21 . . . . 0.0 110.922 166.11 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.9 mt -128.13 157.54 40.48 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.449 1.1 . . . . 0.0 112.707 -169.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -77.82 138.11 38.78 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.901 0.88 . . . . 0.0 110.428 166.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -95.25 -15.13 23.44 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 114.478 1.288 . . . . 0.0 114.478 -175.21 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -150.19 169.72 20.65 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.876 1.27 . . . . 0.0 113.088 -172.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.2 -164.75 54.91 Favored Glycine 0 CA--C 1.54 1.605 0 C-N-CA 124.184 0.897 . . . . 0.0 114.138 179.385 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -67.69 -17.13 47.69 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 123.325 2.683 . . . . 0.0 113.788 -176.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.8 mt -94.58 6.61 48.34 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.785 1.234 . . . . 0.0 113.815 175.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -54.57 123.33 12.81 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 120.952 1.705 . . . . 0.0 112.256 -177.228 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 82.41 3.13 90.65 Favored Glycine 0 CA--C 1.541 1.678 0 C-N-CA 125.501 1.524 . . . . 0.0 115.378 -174.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 20.9 mt -102.01 163.54 17.56 Favored Pre-proline 0 CA--C 1.555 1.156 0 C-N-CA 126.265 1.826 . . . . 0.0 110.888 179.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -76.33 157.33 37.21 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 124.186 3.257 . . . . 0.0 113.383 -164.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 35.3 t -92.99 -35.88 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 O-C-N 121.533 -0.729 . . . . 0.0 112.502 174.511 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 19.6 p -123.29 172.67 8.47 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 114.716 1.376 . . . . 0.0 114.716 -177.501 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 15.0 ptp180 -61.73 -36.66 81.61 Favored 'General case' 0 N--CA 1.482 1.162 0 O-C-N 121.448 -0.783 . . . . 0.0 111.934 173.148 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 25.3 m -66.07 -44.31 84.88 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.895 0.878 . . . . 0.0 110.705 173.16 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -61.23 -42.21 98.22 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 121.714 -0.616 . . . . 0.0 111.401 175.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.09 -44.48 92.23 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.105 0.962 . . . . 0.0 112.831 177.639 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 81.1 mtp180 -66.12 -40.7 90.9 Favored 'General case' 0 N--CA 1.478 0.974 0 O-C-N 121.415 -0.803 . . . . 0.0 112.262 176.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 78.4 t -63.79 -45.85 96.06 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 123.356 0.663 . . . . 0.0 111.071 174.159 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 15.8 mt -57.26 -48.88 77.75 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 118.466 -0.778 . . . . 0.0 112.035 174.11 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 52.8 mt -54.48 -49.42 65.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 CA-C-N 118.736 0.698 . . . . 0.0 110.294 176.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 13.6 t80 -64.79 -51.62 61.23 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -179.32 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.9 t30 -66.36 -43.8 84.96 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 118.639 0.654 . . . . 0.0 112.544 -176.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -60.62 -51.27 70.11 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 118.845 -0.598 . . . . 0.0 110.025 174.044 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 62.5 t90 -56.26 -46.26 79.71 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-O 118.001 -0.999 . . . . 0.0 112.5 176.216 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -56.38 -51.31 68.78 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 120.053 1.297 . . . . 0.0 112.491 177.288 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -70.09 -45.58 66.66 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 119.75 1.159 . . . . 0.0 112.488 -178.112 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 58.1 mmt-85 -55.91 -44.01 77.88 Favored 'General case' 0 N--CA 1.475 0.789 0 O-C-N 121.839 -0.538 . . . . 0.0 109.642 174.327 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 78.8 tttt -69.24 -33.24 72.97 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 178.388 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -59.32 -32.5 70.12 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 119.941 1.246 . . . . 0.0 111.137 167.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 67.1 m -81.6 -24.26 36.57 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 115.374 1.62 . . . . 0.0 115.374 166.334 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -145.77 78.93 11.46 Favored Pre-proline 0 CA--C 1.552 1.029 0 C-N-CA 126.758 2.023 . . . . 0.0 111.974 -164.787 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_endo -60.87 -7.51 7.81 Favored 'Trans proline' 0 CA--C 1.548 1.209 0 C-N-CA 123.605 2.87 . . . . 0.0 116.682 -167.56 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 42.2 p90 -86.46 -2.8 58.76 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 126.996 2.118 . . . . 0.0 115.25 176.036 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.35 133.28 52.74 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 124.714 1.206 . . . . 0.0 114.153 -173.975 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -88.77 152.18 21.94 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 125.278 1.431 . . . . 0.0 113.0 176.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -133.36 129.22 37.15 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.63 1.572 . . . . 0.0 110.494 -174.06 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -145.99 134.98 22.61 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.319 1.048 . . . . 0.0 110.843 174.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 66.8 mtt -129.81 12.48 5.77 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.739 1.216 . . . . 0.0 113.818 -176.284 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 75.3 m -66.99 153.62 43.19 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 121.345 -0.847 . . . . 0.0 111.11 174.247 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -55.17 -36.08 65.47 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -169.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 59.2 mtmt -61.41 -33.19 73.27 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.052 0.941 . . . . 0.0 113.323 176.068 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.01 -40.43 97.73 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 119.194 0.906 . . . . 0.0 111.632 173.206 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.86 -46.14 61.93 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 C-N-CA 123.833 0.853 . . . . 0.0 109.541 -179.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 16.5 m-30 -55.58 -47.01 77.14 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.364 0.666 . . . . 0.0 112.641 174.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.4 tmt_? -77.51 -36.77 52.24 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 124.292 1.037 . . . . 0.0 112.254 -172.254 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 51.1 ttt85 -75.73 -34.56 60.35 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.831 0.852 . . . . 0.0 112.629 174.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 35.6 m-85 -130.74 88.64 45.75 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 125.588 1.555 . . . . 0.0 110.871 -175.316 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -67.51 -19.77 48.35 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 123.057 2.504 . . . . 0.0 114.6 -168.201 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 7.9 p-80 -73.78 -22.48 59.82 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.783 0.833 . . . . 0.0 113.07 173.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.5 4.96 37.61 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 126.571 1.948 . . . . 0.0 113.636 -177.773 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.256 1.402 0 C-N-CA 125.412 1.485 . . . . 0.0 111.433 172.255 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.8 ttt . . . . . 0 N--CA 1.495 1.817 0 CA-C-O 119.877 -0.106 . . . . 0.0 110.774 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 73.4 ttp85 -133.89 139.28 46.08 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 125.349 1.46 . . . . 0.0 111.601 179.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 80.4 136.31 1.64 Allowed Glycine 0 CA--C 1.539 1.56 0 C-N-CA 125.598 1.57 . . . . 0.0 114.042 179.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.4 t -150.68 33.13 0.62 Allowed 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.991 1.316 . . . . 0.0 111.9 178.345 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -91.04 135.88 33.45 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.426 1.09 . . . . 0.0 112.724 -167.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 13.4 p80 -153.8 142.96 21.37 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.177 1.391 . . . . 0.0 111.683 172.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -146.28 139.26 25.63 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.577 1.551 . . . . 0.0 110.792 177.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 15.8 p-80 -156.11 119.78 4.37 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.361 1.064 . . . . 0.0 111.87 177.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 65.4 m80 -145.72 115.39 7.26 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.629 1.572 . . . . 0.0 109.546 177.739 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 39.8 t-80 -155.84 151.74 27.53 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.813 0.845 . . . . 0.0 113.086 -177.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 82.77 148.77 7.73 Favored Glycine 0 CA--C 1.538 1.492 0 C-N-CA 125.361 1.458 . . . . 0.0 115.391 172.378 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 79.6 p -158.08 158.32 34.53 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 126.154 1.782 . . . . 0.0 111.617 175.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.3 p -151.54 140.94 15.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 124.492 1.117 . . . . 0.0 111.595 175.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.6 p -156.02 153.66 29.83 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.448 1.499 . . . . 0.0 111.797 174.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -153.69 156.09 37.19 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.028 1.331 . . . . 0.0 112.295 177.041 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 78.46 148.52 3.93 Favored Glycine 0 CA--C 1.54 1.614 0 C-N-CA 125.1 1.333 . . . . 0.0 114.228 -178.219 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -150.36 64.45 6.67 Favored Pre-proline 0 CA--C 1.555 1.142 0 C-N-CA 124.996 1.318 . . . . 0.0 111.941 179.133 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -68.68 131.09 21.99 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 123.19 2.594 . . . . 0.0 112.082 -179.29 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 73.2 m -140.58 68.97 31.55 Favored Pre-proline 0 N--CA 1.477 0.898 0 C-N-CA 125.162 1.385 . . . . 0.0 111.101 -178.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_endo -67.69 154.73 72.51 Favored 'Trans proline' 0 CA--C 1.543 0.96 0 C-N-CA 123.362 2.708 . . . . 0.0 112.492 179.581 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.1 mp -77.38 -21.38 53.31 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.893 0.877 . . . . 0.0 113.23 -176.499 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 14.0 t -151.97 159.6 43.72 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.636 1.575 . . . . 0.0 111.493 175.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.6 t -150.14 -42.51 0.13 Allowed 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.364 1.066 . . . . 0.0 112.458 178.566 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.6 mp0 -70.84 119.38 14.89 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.521 1.128 . . . . 0.0 112.274 -177.013 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 3.4 t -149.41 36.32 0.73 Allowed 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.627 1.171 . . . . 0.0 112.234 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -136.76 4.59 2.81 Favored 'General case' 0 N--CA 1.478 0.925 0 N-CA-C 114.989 1.477 . . . . 0.0 114.989 -169.491 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -72.86 -24.67 60.9 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 -173.103 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -139.76 14.86 2.5 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.935 1.694 . . . . 0.0 113.786 179.035 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 46.5 mt -130.25 125.33 59.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 125.1 1.36 . . . . 0.0 110.468 -170.635 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -152.91 159.8 43.01 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.595 1.558 . . . . 0.0 111.499 171.258 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -81.82 159.88 23.65 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.773 0.829 . . . . 0.0 111.698 169.548 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 64.7 mtt -126.78 -36.21 2.24 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.749 1.22 . . . . 0.0 112.538 171.563 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 19.6 p -132.09 60.37 50.75 Favored Pre-proline 0 N--CA 1.48 1.049 0 C-N-CA 125.941 1.696 . . . . 0.0 111.538 178.11 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_endo -65.82 155.4 69.48 Favored 'Trans proline' 0 CA--C 1.548 1.221 0 C-N-CA 123.21 2.607 . . . . 0.0 112.63 -178.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -73.59 112.95 3.66 Favored 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 123.456 2.771 . . . . 0.0 112.174 -177.437 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -142.91 8.51 1.68 Allowed 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.567 1.321 . . . . 0.0 114.567 179.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 -138.41 49.45 1.91 Allowed 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 124.68 1.192 . . . . 0.0 111.965 -168.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -125.28 126.13 44.63 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.139 1.376 . . . . 0.0 111.108 177.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -145.36 21.42 1.53 Allowed 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 124.519 1.128 . . . . 0.0 113.885 -174.137 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 57.1 tp60 -150.85 79.58 7.01 Favored Pre-proline 0 CA--C 1.544 0.748 0 C-N-CA 124.838 1.255 . . . . 0.0 109.213 -176.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -82.5 68.96 7.55 Favored 'Trans proline' 0 CA--C 1.543 0.957 0 C-N-CA 123.869 3.046 . . . . 0.0 111.276 -170.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 81.76 171.99 46.51 Favored Glycine 0 CA--C 1.537 1.413 0 C-N-CA 125.278 1.418 . . . . 0.0 113.178 -166.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -152.58 137.24 16.93 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.824 1.25 . . . . 0.0 111.718 176.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -126.94 151.12 48.92 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.779 1.631 . . . . 0.0 110.888 178.485 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -132.61 126.62 33.13 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.559 1.144 . . . . 0.0 111.932 171.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -87.2 143.44 27.29 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.426 1.091 . . . . 0.0 110.938 169.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 59.9 mt -127.9 157.51 40.33 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.517 1.127 . . . . 0.0 112.482 -170.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 93.5 m-70 -79.1 139.15 38.15 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.939 0.896 . . . . 0.0 110.242 167.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -94.19 -23.68 17.81 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -174.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -141.14 166.44 24.76 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.192 1.397 . . . . 0.0 112.61 -170.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 74.18 -163.86 54.6 Favored Glycine 0 CA--C 1.539 1.574 0 C-N-CA 124.277 0.942 . . . . 0.0 114.166 178.056 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -67.41 -17.21 49.1 Favored 'Trans proline' 0 CA--C 1.541 0.86 0 C-N-CA 123.281 2.654 . . . . 0.0 113.778 -175.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.9 mt -93.49 5.11 52.7 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.656 1.182 . . . . 0.0 113.81 175.377 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.26 123.61 14.33 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 120.954 1.707 . . . . 0.0 112.318 -176.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 81.98 2.9 90.69 Favored Glycine 0 CA--C 1.541 1.681 0 C-N-CA 125.71 1.624 . . . . 0.0 115.339 -174.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 17.0 mt -101.63 162.49 20.27 Favored Pre-proline 0 CA--C 1.557 1.224 0 C-N-CA 126.07 1.748 . . . . 0.0 110.951 -179.107 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -77.69 155.29 31.14 Favored 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 124.113 3.209 . . . . 0.0 113.751 -164.107 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 45.1 t -91.53 -36.44 7.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 CA-C-O 118.514 -0.755 . . . . 0.0 112.574 175.271 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 16.9 p -124.68 172.77 9.01 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 115.038 1.496 . . . . 0.0 115.038 -177.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 56.5 ttt180 -59.26 -41.36 88.63 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 125.253 1.421 . . . . 0.0 111.192 174.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.3 t -62.71 -47.32 84.09 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 123.612 0.765 . . . . 0.0 110.832 171.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 69.0 m-20 -60.08 -42.21 94.12 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.418 -0.801 . . . . 0.0 111.862 178.341 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.04 -43.52 92.06 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.63 0.772 . . . . 0.0 112.696 177.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 92.5 mtt180 -66.63 -38.33 86.69 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 121.163 -0.961 . . . . 0.0 113.005 175.55 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 77.6 t -66.31 -43.49 91.48 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 CA-C-N 118.835 0.743 . . . . 0.0 111.321 174.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 16.5 mt -56.82 -48.39 78.1 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 118.595 0.634 . . . . 0.0 112.173 172.542 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 59.9 mt -54.83 -51.26 54.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 122.943 0.497 . . . . 0.0 110.082 175.364 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 15.0 t80 -65.09 -48.0 75.25 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -177.001 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 20.1 t30 -69.64 -45.04 69.36 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.502 0.721 . . . . 0.0 112.246 -176.43 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 48.0 tt0 -66.04 -44.96 83.13 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 118.113 -0.946 . . . . 0.0 110.849 175.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.409 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 66.1 t90 -58.35 -46.0 87.11 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 119.987 1.267 . . . . 0.0 111.588 173.4 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -55.3 -46.15 76.23 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 120.71 1.595 . . . . 0.0 112.768 177.415 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -68.54 -52.24 34.18 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 119.533 1.061 . . . . 0.0 112.766 177.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 38.6 mmt180 -57.01 -45.34 83.12 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.447 0.699 . . . . 0.0 110.281 179.243 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.8 tmtt? -70.8 -29.49 65.68 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.785 1.634 . . . . 0.0 113.477 178.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 65.4 tttm -60.71 -35.34 76.07 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 120.237 1.381 . . . . 0.0 110.933 165.714 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 61.1 m -80.04 -23.47 41.39 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 115.226 1.565 . . . . 0.0 115.226 167.265 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -140.0 75.39 29.71 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 126.883 2.073 . . . . 0.0 111.8 -167.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -61.35 -6.23 6.49 Favored 'Trans proline' 0 CA--C 1.547 1.147 0 C-N-CA 123.947 3.098 . . . . 0.0 116.59 -167.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 41.3 p90 -87.44 -8.3 56.66 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 126.648 1.979 . . . . 0.0 114.938 174.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 16.2 tp -65.24 136.55 56.75 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 119.857 1.208 . . . . 0.0 114.048 -168.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 82.3 mtt85 -83.44 155.97 23.15 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.894 1.277 . . . . 0.0 113.084 179.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.409 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.4 tm? -138.8 128.29 24.54 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 126.606 1.962 . . . . 0.0 109.841 -174.672 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -146.5 137.48 24.23 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.111 0.964 . . . . 0.0 110.849 174.407 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 65.6 mtt -126.03 12.34 7.76 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.776 1.23 . . . . 0.0 113.713 -175.284 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 32.9 t -61.24 143.87 54.82 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.488 -0.758 . . . . 0.0 110.405 172.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 32.7 m-20 -60.51 -24.95 65.74 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 121.011 -1.056 . . . . 0.0 113.517 -172.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -56.25 -38.45 71.13 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.038 0.935 . . . . 0.0 112.609 169.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.42 -38.65 91.78 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.745 0.818 . . . . 0.0 112.035 173.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -70.38 -46.28 71.66 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 123.806 0.842 . . . . 0.0 109.396 -179.277 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 10.2 m-30 -58.83 -45.91 88.89 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 118.545 0.612 . . . . 0.0 112.284 174.448 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.09 -29.24 60.57 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 124.276 1.031 . . . . 0.0 113.267 -173.654 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -78.85 -38.91 36.76 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.085 0.954 . . . . 0.0 112.374 169.385 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -130.9 83.06 62.34 Favored Pre-proline 0 CA--C 1.546 0.814 0 C-N-CA 125.635 1.574 . . . . 0.0 110.84 -168.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.69 -15.46 44.53 Favored 'Trans proline' 0 CA--C 1.539 0.767 0 C-N-CA 123.067 2.511 . . . . 0.0 114.212 -170.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 12.5 p-80 -74.2 -22.71 59.26 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.083 0.953 . . . . 0.0 113.219 173.418 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -81.02 -25.63 37.03 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.389 1.475 . . . . 0.0 112.622 -171.435 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 69.9 ttp85 . . . . . 0 C--O 1.254 1.319 0 C-N-CA 124.585 1.154 . . . . 0.0 112.506 177.711 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.0 ttt . . . . . 0 N--CA 1.495 1.812 0 CA-C-O 120.485 0.183 . . . . 0.0 110.726 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 80.9 mtt85 -139.23 164.92 28.54 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 126.058 1.743 . . . . 0.0 111.802 177.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 82.75 176.57 51.53 Favored Glycine 0 CA--C 1.537 1.431 0 C-N-CA 124.997 1.284 . . . . 0.0 114.667 178.013 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 87.8 p -148.69 168.92 21.58 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 125.938 1.695 . . . . 0.0 112.364 -176.258 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 23.3 p80 -141.28 164.57 29.9 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.056 1.342 . . . . 0.0 112.487 178.729 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 55.7 t-80 -147.21 144.31 28.81 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.061 1.344 . . . . 0.0 111.571 174.109 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 22.2 p80 -151.12 158.94 44.66 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.229 1.412 . . . . 0.0 111.577 172.095 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 85.1 t60 -151.49 144.18 24.34 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.694 1.198 . . . . 0.0 112.081 176.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 18.6 p80 -152.99 151.66 30.53 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.556 1.542 . . . . 0.0 111.357 167.525 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 47.6 p-80 -155.84 173.31 16.94 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.072 1.349 . . . . 0.0 112.62 -179.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 91.25 84.48 1.44 Allowed Glycine 0 CA--C 1.533 1.217 0 C-N-CA 124.642 1.115 . . . . 0.0 114.542 168.346 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 70.9 p -147.9 140.02 24.2 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.317 1.447 . . . . 0.0 111.479 168.402 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 9.5 p -158.69 155.59 4.36 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 C-N-CA 125.091 1.357 . . . . 0.0 111.296 -178.183 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.2 p -143.14 149.39 38.01 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.923 1.289 . . . . 0.0 112.491 173.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -144.23 169.21 18.31 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 126.023 1.729 . . . . 0.0 111.815 -177.61 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 89.01 82.97 1.29 Allowed Glycine 0 CA--C 1.532 1.141 0 C-N-CA 124.712 1.149 . . . . 0.0 113.441 174.15 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.16 63.19 28.83 Favored Pre-proline 0 CA--C 1.554 1.119 0 C-N-CA 125.329 1.452 . . . . 0.0 111.434 175.093 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -68.38 150.26 75.79 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 123.606 2.87 . . . . 0.0 113.136 -175.625 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 54.1 p -146.51 50.78 1.05 Allowed Pre-proline 0 CA--C 1.552 1.023 0 C-N-CA 125.037 1.335 . . . . 0.0 113.841 -179.459 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -63.49 140.81 77.79 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 123.151 2.568 . . . . 0.0 112.447 -179.54 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -139.8 6.18 2.21 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 115.547 1.684 . . . . 0.0 115.547 -174.523 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.2 t -76.48 130.18 37.59 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 121.366 -0.834 . . . . 0.0 111.79 -178.235 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.4 t -158.09 150.22 21.98 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.33 1.452 . . . . 0.0 111.354 178.195 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -149.81 151.36 33.42 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.108 1.363 . . . . 0.0 112.236 175.118 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 12.3 t -152.58 99.68 2.49 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.763 1.225 . . . . 0.0 109.804 176.235 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -149.81 30.48 0.73 Allowed 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.28 1.032 . . . . 0.0 113.623 -168.652 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -75.51 61.11 1.26 Allowed 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.931 1.693 . . . . 0.0 112.268 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 54.08 43.7 30.32 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 126.413 1.885 . . . . 0.0 112.425 -170.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 75.4 mt -91.4 97.06 6.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 C-N-CA 125.308 1.443 . . . . 0.0 108.655 -176.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 52.1 t30 -146.78 37.69 0.99 Allowed 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 123.895 0.878 . . . . 0.0 113.31 -173.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 66.6 t80 -143.29 136.64 28.18 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 175.529 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 58.5 ttm -158.78 150.48 20.92 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.827 2.051 . . . . 0.0 109.049 165.15 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.8 t -133.17 117.7 14.81 Favored Pre-proline 0 N--CA 1.478 0.938 0 C-N-CA 123.233 0.613 . . . . 0.0 111.507 169.234 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -95.62 154.5 1.55 Allowed 'Trans proline' 0 CA--C 1.548 1.208 0 C-N-CA 124.005 3.136 . . . . 0.0 113.007 176.438 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -73.34 170.32 20.18 Favored 'Trans proline' 0 CA--C 1.544 1.021 0 C-N-CA 123.203 2.602 . . . . 0.0 111.393 165.408 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -69.24 -21.99 63.88 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 176.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -151.32 129.32 11.78 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.304 1.842 . . . . 0.0 109.72 171.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -89.21 -45.02 9.86 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -179.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 54.05 12.87 0.5 Allowed 'General case' 0 CA--C 1.555 1.163 0 N-CA-C 116.712 2.116 . . . . 0.0 116.712 179.758 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -152.67 70.42 7.29 Favored Pre-proline 0 CA--C 1.551 0.996 0 C-N-CA 125.887 1.675 . . . . 0.0 109.234 -178.77 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -81.04 176.42 8.91 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 124.177 3.251 . . . . 0.0 114.137 -165.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 98.15 -4.45 60.66 Favored Glycine 0 CA--C 1.538 1.469 0 C-N-CA 125.393 1.473 . . . . 0.0 115.691 172.206 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . 57.91 18.42 5.01 Favored 'General case' 0 CA--C 1.551 0.986 0 N-CA-C 116.662 2.097 . . . . 0.0 116.662 175.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -79.41 162.27 25.62 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.764 1.226 . . . . 0.0 110.598 163.696 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -132.02 140.44 48.92 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.438 1.095 . . . . 0.0 112.936 174.049 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -86.58 155.06 20.61 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.523 1.129 . . . . 0.0 110.837 164.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 91.3 mt -132.99 157.32 45.49 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.803 1.241 . . . . 0.0 112.105 -175.129 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -81.81 137.53 35.28 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 123.352 0.661 . . . . 0.0 109.615 162.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -96.48 -21.59 17.63 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 114.426 1.269 . . . . 0.0 114.426 -173.422 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -140.8 165.53 27.27 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.202 1.401 . . . . 0.0 112.373 -171.535 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.17 -162.72 54.79 Favored Glycine 0 CA--C 1.54 1.629 0 C-N-CA 124.162 0.887 . . . . 0.0 114.124 178.296 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -67.85 -17.36 46.92 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 123.251 2.634 . . . . 0.0 113.809 -175.168 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 97.8 mt -94.13 6.26 49.15 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.557 1.143 . . . . 0.0 113.901 175.273 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.45 122.01 10.28 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 120.798 1.636 . . . . 0.0 112.123 -178.04 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.15 6.28 88.23 Favored Glycine 0 CA--C 1.541 1.693 0 C-N-CA 125.447 1.499 . . . . 0.0 115.432 -175.18 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 18.2 mt -103.99 160.77 25.0 Favored Pre-proline 0 CA--C 1.559 1.293 0 C-N-CA 126.137 1.775 . . . . 0.0 111.33 -179.208 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -72.24 164.73 34.75 Favored 'Trans proline' 0 C--N 1.354 0.832 0 C-N-CA 124.307 3.338 . . . . 0.0 113.553 -168.497 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 10.6 t -110.12 -27.38 2.89 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 O-C-N 121.288 -0.883 . . . . 0.0 112.458 176.583 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 17.7 p -125.87 172.65 9.71 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 125.385 1.474 . . . . 0.0 114.203 179.726 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 10.1 mmt180 -60.19 -40.96 91.9 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 121.378 -0.826 . . . . 0.0 111.442 170.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 8.6 t -63.15 -44.28 95.98 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 122.617 0.367 . . . . 0.0 110.761 174.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -60.01 -45.14 93.74 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.717 -0.614 . . . . 0.0 111.417 175.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.72 -41.82 95.7 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.595 0.758 . . . . 0.0 112.67 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 34.0 mtp-105 -61.42 -45.8 92.8 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 118.803 0.729 . . . . 0.0 111.773 173.051 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 55.4 t -60.96 -49.78 83.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 124.046 0.938 . . . . 0.0 111.199 177.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.6 mp -60.13 -49.83 76.08 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 118.6 -0.714 . . . . 0.0 112.562 177.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 60.8 mt -54.47 -52.61 38.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-N 118.859 0.754 . . . . 0.0 110.199 175.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -65.44 -47.41 76.26 Favored 'General case' 0 C--O 1.224 -0.267 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -176.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -67.61 -45.95 73.99 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 119.47 1.032 . . . . 0.0 112.528 -178.071 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -64.86 -44.44 89.7 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 118.957 -0.544 . . . . 0.0 110.722 178.606 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.409 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 71.3 t90 -60.29 -46.0 91.4 Favored 'General case' 0 C--O 1.219 -0.545 0 CA-C-O 117.787 -1.102 . . . . 0.0 111.897 171.298 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -55.72 -49.2 73.67 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 121.042 1.747 . . . . 0.0 112.637 179.576 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -65.53 -53.71 38.42 Favored 'General case' 0 C--O 1.245 0.835 0 O-C-N 121.067 -1.02 . . . . 0.0 111.931 178.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 9.8 mmm180 -58.32 -47.12 84.72 Favored 'General case' 0 C--O 1.215 -0.739 0 C-N-CA 122.435 0.294 . . . . 0.0 111.039 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 13.7 tmtt? -67.37 -30.96 70.89 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.32 1.048 . . . . 0.0 113.192 178.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 8.9 mtpm? -66.64 -26.56 67.12 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 120.194 1.361 . . . . 0.0 112.531 168.565 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 79.8 p -91.06 -9.18 46.71 Favored 'General case' 0 N--CA 1.486 1.34 0 N-CA-C 116.185 1.92 . . . . 0.0 116.185 163.104 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -144.64 72.55 15.48 Favored Pre-proline 0 CA--C 1.552 1.02 0 C-N-CA 127.353 2.261 . . . . 0.0 111.4 -172.103 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -61.1 -7.78 8.72 Favored 'Trans proline' 0 CA--C 1.546 1.114 0 C-N-CA 123.835 3.024 . . . . 0.0 116.577 -166.277 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 41.0 p90 -84.31 -10.49 57.58 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 126.502 1.921 . . . . 0.0 115.037 174.506 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.4 tp -64.84 137.08 57.55 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.674 1.124 . . . . 0.0 113.747 -169.589 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 23.3 mmt85 -90.06 156.46 18.37 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.593 1.157 . . . . 0.0 112.78 -179.107 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.409 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.4 tm? -137.69 131.81 31.96 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 126.996 2.119 . . . . 0.0 109.266 -171.772 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 52.5 t0 -141.85 130.65 22.92 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.68 0.792 . . . . 0.0 111.041 175.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 65.0 mtt -122.8 9.23 9.45 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.836 1.654 . . . . 0.0 112.841 -179.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 28.9 t -64.52 153.73 38.14 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.026 0.93 . . . . 0.0 111.507 172.516 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -51.4 -38.28 52.64 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.238 1.015 . . . . 0.0 112.79 -179.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -58.78 -39.1 80.04 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.531 1.133 . . . . 0.0 112.914 176.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.24 -42.38 99.26 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 123.25 0.62 . . . . 0.0 111.551 175.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.02 -46.92 64.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.297 0 C-N-CA 123.651 0.781 . . . . 0.0 109.902 -179.036 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 18.8 m-30 -55.35 -46.48 76.4 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 118.869 0.759 . . . . 0.0 112.599 175.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 1.5 ttp85 -78.2 -35.18 48.87 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.906 0.882 . . . . 0.0 112.93 -172.053 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 61.7 ttm-85 -80.71 -37.24 30.98 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 124.433 1.093 . . . . 0.0 112.847 175.495 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -129.71 76.96 77.77 Favored Pre-proline 0 CA--C 1.547 0.846 0 C-N-CA 126.54 1.936 . . . . 0.0 110.893 -173.32 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -65.41 -17.67 58.26 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 123.109 2.54 . . . . 0.0 114.281 -172.598 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 7.6 p-80 -74.15 -23.98 59.34 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.078 0.951 . . . . 0.0 113.32 172.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -85.53 -4.79 59.26 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 126.278 1.831 . . . . 0.0 113.496 -178.795 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 57.5 ttp180 . . . . . 0 C--O 1.254 1.302 0 C-N-CA 125.405 1.482 . . . . 0.0 111.843 173.777 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.5 mtt . . . . . 0 N--CA 1.499 1.978 0 N-CA-C 110.364 -0.235 . . . . 0.0 110.364 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 80.3 mtm180 -140.37 167.89 21.1 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 125.964 1.706 . . . . 0.0 111.828 179.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 84.27 17.04 65.47 Favored Glycine 0 CA--C 1.535 1.337 0 N-CA-C 115.963 1.145 . . . . 0.0 115.963 169.289 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 56.4 p -69.18 150.11 47.85 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 118.68 1.24 . . . . 0.0 112.47 173.602 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 41.6 p-80 -80.91 -37.08 30.27 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 -174.274 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . 0.501 ' CG ' ' H ' ' A' ' 7' ' ' HIS . 33.2 t60 56.15 172.68 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 126.869 2.068 . . . . 0.0 115.131 -173.923 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.501 ' H ' ' CG ' ' A' ' 6' ' ' HIS . 94.7 m-70 -80.41 39.31 0.46 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.228 1.811 . . . . 0.0 113.658 -176.844 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 34.0 m80 -72.24 158.92 34.96 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.573 1.149 . . . . 0.0 112.182 172.003 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 23.3 m80 60.07 22.31 11.5 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 125.726 1.61 . . . . 0.0 115.248 178.431 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 58.8 m170 -100.38 152.37 20.42 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.371 1.468 . . . . 0.0 111.758 173.5 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 74.47 178.88 40.57 Favored Glycine 0 CA--C 1.54 1.631 0 C-N-CA 124.389 0.995 . . . . 0.0 114.631 -178.376 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 8.8 t -154.36 168.58 26.14 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 125.586 1.554 . . . . 0.0 111.662 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.9 p -140.86 139.27 34.36 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 125.381 1.472 . . . . 0.0 111.354 175.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 80.2 p -154.01 162.14 41.42 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.726 1.611 . . . . 0.0 111.618 179.535 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 84.1 m-85 -133.43 132.43 41.11 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.632 1.173 . . . . 0.0 111.363 -177.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 72.5 165.08 8.05 Favored Glycine 0 CA--C 1.54 1.619 0 C-N-CA 124.605 1.097 . . . . 0.0 114.235 -172.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -146.95 55.31 2.39 Favored Pre-proline 0 CA--C 1.555 1.14 0 C-N-CA 124.617 1.167 . . . . 0.0 112.984 178.037 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -66.83 141.48 59.32 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.097 2.532 . . . . 0.0 112.378 -179.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 9.6 t -152.08 80.88 5.84 Favored Pre-proline 0 CA--C 1.545 0.773 0 C-N-CA 124.479 1.112 . . . . 0.0 110.88 176.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -78.13 95.72 1.08 Allowed 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 123.659 2.906 . . . . 0.0 111.562 -176.498 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 97.9 mt -115.69 -3.26 12.29 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.963 1.305 . . . . 0.0 114.397 -175.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 21.1 t -81.52 134.61 35.54 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.751 0.82 . . . . 0.0 112.054 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 81.4 p -158.42 163.15 37.48 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.525 1.53 . . . . 0.0 112.353 179.44 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -131.05 144.55 51.52 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.217 1.407 . . . . 0.0 111.181 173.244 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 59.8 m -142.44 151.47 41.8 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.745 1.218 . . . . 0.0 112.85 -172.477 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 57.01 25.64 10.94 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.983 1.713 . . . . 0.0 115.467 172.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -70.95 -22.42 62.22 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 114.29 1.218 . . . . 0.0 114.29 -174.339 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 -127.78 7.07 6.16 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 125.906 1.682 . . . . 0.0 113.014 -179.239 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 46.3 mm -97.81 125.89 50.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 O-C-N 120.925 -1.109 . . . . 0.0 111.334 -170.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 66.3 m-20 48.53 42.73 19.3 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 126.394 1.878 . . . . 0.0 114.135 171.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 26.1 t80 -81.66 59.17 4.06 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.833 1.253 . . . . 0.0 113.055 -170.708 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 55.5 mtt 60.49 171.18 0.09 Allowed 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 127.881 2.472 . . . . 0.0 115.476 -179.197 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 26.3 p -137.34 154.21 75.27 Favored Pre-proline 0 N--CA 1.479 0.997 0 C-N-CA 126.531 1.932 . . . . 0.0 111.311 -179.342 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -68.09 152.0 76.86 Favored 'Trans proline' 0 CA--C 1.548 1.18 0 C-N-CA 122.884 2.39 . . . . 0.0 112.334 177.123 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -69.8 141.51 45.25 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 123.446 2.764 . . . . 0.0 112.547 -178.674 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -74.16 131.01 40.87 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.011 1.324 . . . . 0.0 112.214 -178.299 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.6 pm0 -78.02 -21.72 50.36 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 115.067 1.506 . . . . 0.0 115.067 -176.159 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -139.81 2.5 1.97 Allowed 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 115.669 1.729 . . . . 0.0 115.669 -168.68 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -83.98 61.88 6.69 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.04 1.336 . . . . 0.0 112.062 -177.366 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 33.0 tp60 -149.25 83.49 6.56 Favored Pre-proline 0 CA--C 1.541 0.611 0 C-N-CA 125.041 1.336 . . . . 0.0 109.087 179.22 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -87.31 -169.61 0.51 Allowed 'Trans proline' 0 CA--C 1.546 1.082 0 C-N-CA 123.522 2.815 . . . . 0.0 110.994 179.347 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 82.06 -129.58 9.15 Favored Glycine 0 CA--C 1.536 1.354 0 C-N-CA 124.093 0.854 . . . . 0.0 113.296 177.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . 58.8 52.73 6.35 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.98 1.712 . . . . 0.0 114.624 -175.605 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -85.81 168.08 14.61 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.019 1.727 . . . . 0.0 111.418 171.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -135.91 148.96 48.78 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.028 1.331 . . . . 0.0 113.032 176.272 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -92.93 154.54 18.13 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.128 1.371 . . . . 0.0 111.639 168.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 81.4 mt -129.25 157.12 42.75 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.145 1.378 . . . . 0.0 112.051 -176.284 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 79.3 m-70 -82.94 143.34 30.76 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.716 0.806 . . . . 0.0 109.584 162.347 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -107.13 -9.56 16.12 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 114.898 1.444 . . . . 0.0 114.898 -170.225 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -148.53 165.72 30.38 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.745 1.218 . . . . 0.0 112.957 -174.299 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 68.52 -158.9 52.32 Favored Glycine 0 CA--C 1.541 1.658 0 C-N-CA 123.931 0.777 . . . . 0.0 113.83 -179.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_endo -68.05 -15.45 43.26 Favored 'Trans proline' 0 CA--C 1.541 0.865 0 C-N-CA 123.268 2.645 . . . . 0.0 113.746 -177.441 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.0 mt -94.46 5.5 51.62 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.765 1.226 . . . . 0.0 113.949 176.301 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.93 114.12 2.41 Favored 'General case' 0 CA--C 1.549 0.907 0 CA-C-N 121.276 1.853 . . . . 0.0 111.995 -179.28 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.17 1.81 71.95 Favored Glycine 0 CA--C 1.542 1.763 0 C-N-CA 125.682 1.611 . . . . 0.0 115.694 -174.209 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 6.7 mp -98.61 157.17 34.74 Favored Pre-proline 0 CA--C 1.556 1.198 0 C-N-CA 126.792 2.037 . . . . 0.0 111.563 179.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -68.06 160.13 49.98 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 124.748 3.632 . . . . 0.0 113.664 -172.003 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 15.2 t -103.95 -30.77 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 O-C-N 121.445 -0.784 . . . . 0.0 112.2 175.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 22.3 p -124.96 170.31 11.24 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 125.143 1.377 . . . . 0.0 114.144 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 43.0 ttt-85 -59.97 -40.1 87.94 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.033 0.933 . . . . 0.0 111.119 173.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 37.4 m -62.77 -43.9 97.59 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.019 0.927 . . . . 0.0 111.291 172.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -60.59 -46.46 90.17 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 118.866 0.757 . . . . 0.0 111.274 175.069 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.19 -42.22 98.2 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 118.623 0.647 . . . . 0.0 112.55 179.587 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 74.5 mtp180 -64.45 -43.16 95.13 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 121.525 -0.735 . . . . 0.0 112.376 175.449 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 53.4 t -62.91 -48.33 88.55 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 C-N-CA 123.79 0.836 . . . . 0.0 111.142 176.195 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.7 mp -59.67 -45.15 92.91 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 118.45 -0.786 . . . . 0.0 112.602 176.542 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 49.7 mt -54.76 -51.49 51.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 CA-C-N 118.884 0.765 . . . . 0.0 110.157 173.346 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -65.44 -48.46 72.65 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 113.318 0.859 . . . . 0.0 113.318 -176.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 23.7 t30 -69.43 -42.78 74.56 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 118.627 0.648 . . . . 0.0 112.49 -176.704 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -65.01 -45.96 83.37 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 118.772 -0.633 . . . . 0.0 110.778 175.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.429 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 64.7 t90 -58.99 -47.34 85.53 Favored 'General case' 0 C--O 1.22 -0.454 0 CA-C-O 117.919 -1.039 . . . . 0.0 111.658 173.05 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -57.93 -45.22 86.9 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 120.645 1.566 . . . . 0.0 112.927 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -66.86 -52.76 39.77 Favored 'General case' 0 C--O 1.245 0.824 0 CA-C-N 119.599 1.09 . . . . 0.0 112.435 177.234 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -55.84 -48.51 75.36 Favored 'General case' 0 C--O 1.218 -0.595 0 O-C-N 121.776 -0.578 . . . . 0.0 110.16 177.513 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 18.5 ttpt -63.04 -34.02 76.67 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.214 1.405 . . . . 0.0 113.397 177.197 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -59.64 -33.66 71.81 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 119.998 1.272 . . . . 0.0 111.001 169.171 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 63.0 m -84.37 -17.66 38.69 Favored 'General case' 0 N--CA 1.484 1.234 0 N-CA-C 116.106 1.891 . . . . 0.0 116.106 165.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -143.09 72.89 18.29 Favored Pre-proline 0 CA--C 1.553 1.073 0 C-N-CA 127.266 2.226 . . . . 0.0 111.738 -165.278 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -61.84 -5.23 5.7 Favored 'Trans proline' 0 CA--C 1.547 1.166 0 C-N-CA 123.934 3.089 . . . . 0.0 116.649 -167.301 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 38.9 p90 -88.12 -9.11 54.27 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 126.921 2.088 . . . . 0.0 114.965 175.721 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.3 tp -65.43 137.5 57.51 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 114.725 1.38 . . . . 0.0 114.725 -164.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 34.4 mmt180 -84.21 155.01 22.71 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 125.139 1.376 . . . . 0.0 113.128 178.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.429 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -138.77 131.98 29.94 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.898 2.079 . . . . 0.0 109.681 -174.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 53.5 t0 -143.86 132.44 22.33 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.894 0.877 . . . . 0.0 111.152 174.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 66.7 mtt -125.9 2.21 7.35 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.313 1.445 . . . . 0.0 113.729 -176.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 73.4 m -62.73 144.7 56.14 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 118.96 0.8 . . . . 0.0 110.216 169.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -61.26 -25.04 66.82 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 -165.038 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -56.32 -34.48 66.58 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.86 0.864 . . . . 0.0 112.966 171.492 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.31 -40.04 95.0 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.508 0.723 . . . . 0.0 111.922 173.141 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.6 mp -73.28 -45.42 53.07 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 C-N-CA 124.204 1.001 . . . . 0.0 109.261 -179.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 11.7 m-30 -55.59 -46.15 77.29 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 118.618 0.644 . . . . 0.0 112.235 175.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.4 tmt_? -77.66 -39.92 43.45 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.65 1.18 . . . . 0.0 112.523 -173.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 62.2 ttm-85 -76.89 -35.69 57.24 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.144 0.978 . . . . 0.0 112.994 177.123 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 45.1 m-85 -127.19 72.68 76.96 Favored Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 125.991 1.717 . . . . 0.0 111.115 -174.534 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -66.68 -11.08 30.42 Favored 'Trans proline' 0 CA--C 1.542 0.898 0 C-N-CA 123.348 2.699 . . . . 0.0 114.171 -175.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 16.1 p-80 -74.83 -23.48 58.46 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.003 0.921 . . . . 0.0 113.343 171.296 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -81.04 -45.66 16.2 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.82 1.248 . . . . 0.0 111.892 -164.462 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 20.8 mmt85 . . . . . 0 C--O 1.253 1.268 0 C-N-CA 127.054 2.142 . . . . 0.0 111.121 172.794 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.7 mmt . . . . . 0 N--CA 1.498 1.934 0 CA-C-O 120.079 -0.01 . . . . 0.0 111.012 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 82.2 mtp180 -135.23 165.73 24.73 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 125.739 1.616 . . . . 0.0 112.405 -178.07 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 104.6 117.28 4.33 Favored Glycine 0 CA--C 1.536 1.35 0 C-N-CA 125.711 1.624 . . . . 0.0 113.974 171.079 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 79.1 p -157.9 156.92 32.2 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.593 1.957 . . . . 0.0 111.162 173.146 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 56.5 t-80 -151.92 133.51 14.7 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.196 0.998 . . . . 0.0 112.331 178.222 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 95.3 m-70 -145.77 96.36 2.8 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 125.474 1.51 . . . . 0.0 110.564 175.347 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 57.8 t-80 -152.53 135.16 15.31 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.971 0.908 . . . . 0.0 112.194 173.36 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 64.7 m80 -146.94 151.57 37.23 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.956 1.702 . . . . 0.0 111.267 178.038 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 55.9 t-80 -149.32 137.0 20.31 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 124.407 1.083 . . . . 0.0 111.936 171.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 46.6 p-80 -162.25 176.22 10.83 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.859 1.664 . . . . 0.0 112.016 -175.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 88.38 18.25 55.62 Favored Glycine 0 CA--C 1.537 1.441 0 N-CA-C 116.181 1.232 . . . . 0.0 116.181 168.076 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 70.4 p -79.23 -10.82 59.91 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 114.972 1.471 . . . . 0.0 114.972 -179.266 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.0 m -84.92 -1.38 6.64 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 N-CA-C 115.294 1.59 . . . . 0.0 115.294 -169.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 30.2 m -73.4 -13.42 61.08 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 115.71 1.745 . . . . 0.0 115.71 -168.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -79.24 149.36 31.9 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -176.708 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 86.59 134.51 3.86 Favored Glycine 0 CA--C 1.538 1.476 0 C-N-CA 125.693 1.616 . . . . 0.0 114.341 175.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -151.78 67.26 7.15 Favored Pre-proline 0 CA--C 1.556 1.177 0 C-N-CA 125.099 1.36 . . . . 0.0 112.152 -179.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -70.32 146.65 57.35 Favored 'Trans proline' 0 CA--C 1.543 0.948 0 C-N-CA 123.369 2.712 . . . . 0.0 112.725 179.56 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 67.3 m -139.47 62.43 24.01 Favored Pre-proline 0 N--CA 1.479 1.014 0 C-N-CA 124.933 1.293 . . . . 0.0 112.637 -177.618 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -67.77 132.15 26.03 Favored 'Trans proline' 0 CA--C 1.542 0.923 0 C-N-CA 123.169 2.579 . . . . 0.0 112.095 179.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.3 tt -153.92 115.56 4.2 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.901 1.28 . . . . 0.0 110.341 179.067 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 76.2 p -155.41 148.48 24.61 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.787 1.235 . . . . 0.0 112.304 172.028 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.9 t -159.69 128.72 5.17 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.682 1.193 . . . . 0.0 111.269 172.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -155.97 124.59 5.93 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.981 1.312 . . . . 0.0 110.353 172.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 11.0 t -160.44 151.77 19.36 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.425 1.09 . . . . 0.0 112.426 177.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 47.54 63.05 2.15 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.634 1.974 . . . . 0.0 114.364 170.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -76.54 43.02 0.3 Allowed 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 124.914 1.285 . . . . 0.0 112.27 172.218 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 54.47 42.73 31.18 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 126.918 2.087 . . . . 0.0 113.575 -168.307 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 16.9 mm -88.77 51.14 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 126.012 1.725 . . . . 0.0 109.366 179.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -146.88 137.03 23.48 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.727 1.611 . . . . 0.0 111.03 -177.067 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 32.3 p90 -163.26 151.93 14.19 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.295 1.438 . . . . 0.0 111.854 -179.345 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 14.6 ttt -155.98 141.48 17.72 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.92 1.288 . . . . 0.0 110.646 169.259 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 17.9 p -135.48 64.38 58.42 Favored Pre-proline 0 N--CA 1.484 1.23 0 C-N-CA 125.021 1.328 . . . . 0.0 112.012 -176.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -71.18 149.67 58.29 Favored 'Trans proline' 0 CA--C 1.548 1.221 0 C-N-CA 123.013 2.475 . . . . 0.0 112.58 -176.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -74.39 149.95 40.56 Favored 'Trans proline' 0 CA--C 1.539 0.769 0 C-N-CA 123.467 2.778 . . . . 0.0 112.329 176.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -90.34 -21.73 21.87 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 177.193 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.0 tt0 49.37 47.49 22.3 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 126.554 1.941 . . . . 0.0 113.723 175.516 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -65.15 -29.86 70.73 Favored 'General case' 0 N--CA 1.477 0.925 0 O-C-N 120.989 -1.069 . . . . 0.0 113.143 -174.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -81.71 67.55 7.72 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.605 1.562 . . . . 0.0 111.641 178.451 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -136.1 38.59 0.39 Allowed Pre-proline 0 CA--C 1.555 1.156 0 C-N-CA 125.229 1.412 . . . . 0.0 114.347 178.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -70.95 146.97 54.21 Favored 'Trans proline' 0 CA--C 1.544 1.011 0 C-N-CA 122.646 2.231 . . . . 0.0 112.966 -170.793 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 68.81 -173.47 34.43 Favored Glycine 0 CA--C 1.539 1.562 0 C-N-CA 124.422 1.01 . . . . 0.0 114.566 -176.488 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -144.52 102.0 3.76 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.665 1.186 . . . . 0.0 111.084 177.087 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -123.21 143.84 49.77 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.584 1.554 . . . . 0.0 110.947 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -150.73 155.97 40.37 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.685 1.594 . . . . 0.0 112.549 178.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -92.41 150.96 20.49 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.612 1.165 . . . . 0.0 111.681 168.844 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 99.5 mt -131.34 157.49 43.21 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.678 1.591 . . . . 0.0 111.28 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -79.23 143.37 35.38 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.809 0.843 . . . . 0.0 109.91 166.552 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -106.83 -9.01 16.51 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 -172.002 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -148.39 165.7 30.31 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.85 1.26 . . . . 0.0 112.924 -174.802 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 69.53 -161.16 52.68 Favored Glycine 0 CA--C 1.541 1.701 0 C-N-CA 123.942 0.782 . . . . 0.0 113.9 -179.33 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -68.07 -16.03 44.17 Favored 'Trans proline' 0 CA--C 1.541 0.851 0 C-N-CA 123.191 2.594 . . . . 0.0 113.72 -177.059 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.1 mt -92.91 4.28 54.2 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 124.813 1.245 . . . . 0.0 113.971 175.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.39 113.94 2.2 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-N 121.107 1.776 . . . . 0.0 112.088 -178.099 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 92.55 4.27 66.0 Favored Glycine 0 CA--C 1.544 1.864 0 C-N-CA 125.642 1.591 . . . . 0.0 115.704 -173.631 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 5.9 mp -105.45 154.77 38.83 Favored Pre-proline 0 CA--C 1.555 1.173 0 C-N-CA 126.831 2.052 . . . . 0.0 111.435 179.848 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -71.56 162.55 41.84 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 124.98 3.786 . . . . 0.0 113.859 -167.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 14.7 t -105.27 -32.88 2.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 O-C-N 121.441 -0.787 . . . . 0.0 113.09 -179.122 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 25.1 p -123.93 172.75 8.69 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 124.914 1.285 . . . . 0.0 113.988 179.364 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 41.5 mtp-105 -61.68 -40.5 95.21 Favored 'General case' 0 N--CA 1.482 1.156 0 O-C-N 121.378 -0.827 . . . . 0.0 110.562 175.054 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 31.3 m -61.67 -44.61 96.63 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 124.353 1.061 . . . . 0.0 111.237 173.321 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -61.16 -47.29 86.88 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 118.885 0.766 . . . . 0.0 111.233 175.116 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.21 -39.58 90.75 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.616 -0.677 . . . . 0.0 112.216 179.698 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 75.3 ttt180 -65.21 -42.07 93.86 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 121.422 -0.798 . . . . 0.0 112.354 174.14 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 68.1 t -63.07 -48.54 87.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 CA-C-N 118.786 0.721 . . . . 0.0 111.223 175.021 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -60.63 -45.11 95.29 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 118.628 -0.701 . . . . 0.0 111.952 178.178 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 52.9 mt -53.59 -51.69 40.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-N 118.736 0.698 . . . . 0.0 110.33 170.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -64.15 -46.5 83.79 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 -176.298 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -70.71 -44.99 65.78 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.033 0.933 . . . . 0.0 112.353 -176.517 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -65.71 -44.01 87.37 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 118.766 -0.635 . . . . 0.0 111.091 176.091 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.426 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 68.3 t90 -60.02 -45.48 92.64 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-O 117.572 -1.204 . . . . 0.0 111.59 171.589 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -54.93 -48.68 72.81 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 120.836 1.653 . . . . 0.0 112.492 178.667 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -65.29 -51.5 60.3 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 119.68 1.127 . . . . 0.0 112.232 177.207 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 38.2 mmt180 -58.54 -46.25 87.22 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 122.99 0.516 . . . . 0.0 110.845 -178.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 3.5 tmtm? -69.27 -30.32 68.4 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 126.043 1.737 . . . . 0.0 113.509 178.661 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 90.8 mttt -65.83 -28.23 68.83 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 119.993 1.27 . . . . 0.0 111.98 166.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 68.5 m -82.9 -22.65 33.88 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 115.173 1.546 . . . . 0.0 115.173 163.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -140.44 75.83 26.48 Favored Pre-proline 0 N--CA 1.477 0.903 0 C-N-CA 127.105 2.162 . . . . 0.0 111.363 -167.332 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -58.63 -16.84 32.29 Favored 'Trans proline' 0 CA--C 1.542 0.907 0 C-N-CA 123.379 2.719 . . . . 0.0 116.039 -165.393 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 39.1 p90 -79.08 -9.78 59.64 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 126.611 1.964 . . . . 0.0 115.463 177.181 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 18.2 tp -64.05 135.42 56.39 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 120.098 1.317 . . . . 0.0 114.35 -167.069 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 7.5 tpm_? -77.9 146.65 35.46 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.939 1.696 . . . . 0.0 112.721 178.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.426 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.4 tm? -128.36 133.89 48.74 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 126.886 2.074 . . . . 0.0 109.847 179.533 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -149.62 134.3 17.69 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.901 0.881 . . . . 0.0 111.084 176.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 63.6 mtt -130.24 1.79 4.67 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.052 1.341 . . . . 0.0 114.288 -171.653 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 69.6 m -63.78 147.34 52.0 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.022 0.828 . . . . 0.0 111.067 173.097 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -58.52 -27.64 64.69 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 114.888 1.44 . . . . 0.0 114.888 -166.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -56.85 -37.37 71.2 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 119.035 0.834 . . . . 0.0 112.802 172.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.06 -37.1 86.2 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.661 0.784 . . . . 0.0 112.065 174.162 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.6 mp -73.65 -46.4 47.94 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 C-N-CA 124.104 0.962 . . . . 0.0 109.327 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 13.9 m-30 -56.17 -45.81 79.56 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 119.006 0.821 . . . . 0.0 112.334 174.391 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.46 -38.97 62.8 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 124.277 1.031 . . . . 0.0 112.283 -173.943 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 39.7 ttm105 -78.99 -34.78 43.79 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.836 0.854 . . . . 0.0 112.948 176.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 -128.21 78.16 75.86 Favored Pre-proline 0 CA--C 1.546 0.827 0 C-N-CA 126.396 1.879 . . . . 0.0 110.757 -174.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -66.16 -16.04 50.59 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 123.091 2.527 . . . . 0.0 114.231 -173.4 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 12.9 p-80 -73.99 -24.01 59.53 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.138 0.975 . . . . 0.0 113.444 172.48 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -82.18 -27.31 32.71 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 125.858 1.663 . . . . 0.0 112.252 -171.442 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 59.6 ttp180 . . . . . 0 C--O 1.254 1.311 0 C-N-CA 125.169 1.388 . . . . 0.0 112.291 175.994 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.832 0 N-CA-C 111.718 0.266 . . . . 0.0 111.718 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 17.9 tpt180 -152.77 151.85 30.96 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 125.037 1.335 . . . . 0.0 111.448 178.122 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 78.27 -58.84 4.03 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 125.418 1.485 . . . . 0.0 114.596 174.229 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 25.1 m 59.31 179.25 0.08 Allowed 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 126.581 1.953 . . . . 0.0 114.755 -177.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 65.8 m80 -128.9 156.17 44.12 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.434 1.494 . . . . 0.0 112.228 -176.186 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 46.8 t60 -145.44 157.19 44.06 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.312 1.445 . . . . 0.0 112.004 -179.103 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 95.3 m-70 -135.31 149.87 49.87 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.606 1.562 . . . . 0.0 112.295 -176.156 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 25.1 p80 -145.43 166.5 25.45 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 125.138 1.375 . . . . 0.0 112.479 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 56.3 t-80 -146.11 148.86 33.05 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.114 1.365 . . . . 0.0 111.801 176.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 25.3 p80 -149.19 160.03 43.73 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.557 1.543 . . . . 0.0 111.686 175.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 174.33 -158.52 27.02 Favored Glycine 0 CA--C 1.537 1.415 0 C-N-CA 123.879 0.752 . . . . 0.0 114.305 -178.389 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.6 t 64.92 161.06 0.12 Allowed 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 127.19 2.196 . . . . 0.0 115.35 -174.366 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 15.1 m -143.33 152.83 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 126.831 2.053 . . . . 0.0 111.819 -174.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 26.4 m -73.66 -34.44 64.93 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 113.322 0.86 . . . . 0.0 113.322 -179.074 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 7.3 t80 52.09 37.18 20.81 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 126.289 1.836 . . . . 0.0 114.956 172.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -69.84 144.61 40.29 Favored Glycine 0 CA--C 1.537 1.46 0 O-C-N 121.247 -0.908 . . . . 0.0 113.747 -178.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -146.22 66.59 11.42 Favored Pre-proline 0 CA--C 1.554 1.124 0 C-N-CA 125.036 1.334 . . . . 0.0 111.878 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_endo -69.35 150.47 70.74 Favored 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 123.677 2.918 . . . . 0.0 113.094 -177.343 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.9 p -148.31 53.53 1.5 Allowed Pre-proline 0 CA--C 1.553 1.07 0 C-N-CA 125.094 1.357 . . . . 0.0 113.472 -179.458 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -66.02 144.77 77.39 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 123.413 2.742 . . . . 0.0 113.358 -176.176 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.4 mt -140.82 153.7 45.9 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.637 1.975 . . . . 0.0 110.939 176.571 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 81.9 p -152.26 161.46 42.57 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.783 1.233 . . . . 0.0 113.171 -179.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 63.0 m -137.61 148.67 46.02 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.904 1.682 . . . . 0.0 111.393 178.232 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -150.7 138.09 19.54 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.498 1.119 . . . . 0.0 112.121 -177.211 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 69.0 m -142.02 132.69 25.51 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 125.523 1.529 . . . . 0.0 111.132 177.435 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -146.72 -1.56 0.68 Allowed 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 115.396 1.628 . . . . 0.0 115.396 -177.451 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -70.26 -13.48 62.19 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 115.727 1.751 . . . . 0.0 115.727 -165.698 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -127.13 3.01 6.45 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.371 1.469 . . . . 0.0 113.033 173.061 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 19.5 mm -87.32 56.63 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 O-C-N 120.507 -1.371 . . . . 0.0 110.141 -172.155 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -142.78 -6.97 0.86 Allowed 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 125.188 1.395 . . . . 0.0 114.548 -170.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 49.3 m-85 -121.05 56.68 1.01 Allowed 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.391 1.076 . . . . 0.0 112.63 -162.431 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 62.4 mtt -108.51 5.61 25.35 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 125.3 1.44 . . . . 0.0 114.194 -172.061 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 17.1 p -127.98 69.52 77.13 Favored Pre-proline 0 N--CA 1.482 1.154 0 C-N-CA 125.282 1.433 . . . . 0.0 113.081 -167.316 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -67.1 156.42 66.41 Favored 'Trans proline' 0 CA--C 1.55 1.317 0 C-N-CA 123.271 2.647 . . . . 0.0 112.389 174.12 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -72.76 125.37 10.47 Favored 'Trans proline' 0 CA--C 1.542 0.888 0 C-N-CA 123.416 2.744 . . . . 0.0 112.313 -178.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -157.42 170.4 22.53 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.997 1.719 . . . . 0.0 112.018 176.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 62.3 16.18 8.26 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 115.459 1.652 . . . . 0.0 115.459 169.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -98.72 113.84 26.1 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.589 1.555 . . . . 0.0 111.674 177.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -146.63 22.87 1.28 Allowed 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 124.824 1.25 . . . . 0.0 113.449 -176.442 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 23.0 tt0 -150.62 76.79 8.15 Favored Pre-proline 0 CA--C 1.546 0.802 0 C-N-CA 125.026 1.33 . . . . 0.0 109.547 -172.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -82.15 69.34 7.54 Favored 'Trans proline' 0 CA--C 1.544 1.005 0 C-N-CA 123.919 3.079 . . . . 0.0 112.315 -167.302 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 88.77 123.78 2.21 Favored Glycine 0 CA--C 1.535 1.322 0 C-N-CA 126.021 1.772 . . . . 0.0 112.747 -175.207 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -156.52 162.86 39.92 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.896 1.678 . . . . 0.0 111.088 178.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.8 mp -90.11 163.32 14.91 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.185 1.394 . . . . 0.0 111.07 173.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -126.22 140.41 52.57 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.686 1.195 . . . . 0.0 112.895 174.69 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -89.25 159.57 17.36 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.792 1.237 . . . . 0.0 111.275 164.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 96.5 mt -135.52 156.17 49.32 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.047 1.339 . . . . 0.0 112.178 -176.059 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 87.3 m-70 -81.67 141.87 33.24 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.731 0.812 . . . . 0.0 109.479 162.12 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -104.82 -16.76 14.81 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 -172.415 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -139.58 162.67 34.53 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.155 1.382 . . . . 0.0 112.373 -173.061 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.84 -161.23 53.97 Favored Glycine 0 CA--C 1.541 1.671 0 C-N-CA 124.075 0.845 . . . . 0.0 113.99 179.065 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -67.81 -16.38 45.86 Favored 'Trans proline' 0 CA--C 1.542 0.902 0 C-N-CA 123.241 2.628 . . . . 0.0 113.835 -176.162 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 98.9 mt -92.82 4.28 54.13 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.697 1.199 . . . . 0.0 113.865 175.245 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.41 113.74 2.12 Favored 'General case' 0 CA--C 1.548 0.896 0 CA-C-N 121.097 1.771 . . . . 0.0 111.999 -179.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.93 6.16 65.53 Favored Glycine 0 CA--C 1.543 1.787 0 C-N-CA 125.453 1.501 . . . . 0.0 115.737 -173.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 6.0 mp -106.44 157.3 35.32 Favored Pre-proline 0 CA--C 1.558 1.267 0 C-N-CA 126.986 2.114 . . . . 0.0 111.318 178.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -71.36 163.9 37.53 Favored 'Trans proline' 0 C--N 1.355 0.882 0 C-N-CA 124.65 3.567 . . . . 0.0 113.833 -168.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 11.0 t -107.05 -27.88 2.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 123.658 0.783 . . . . 0.0 112.084 176.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 29.1 p -126.89 170.38 12.29 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 125.021 1.328 . . . . 0.0 114.471 -179.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 71.8 ttt180 -64.65 -39.36 93.56 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 124.618 1.167 . . . . 0.0 111.116 176.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 11.8 p -65.9 -40.58 91.66 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.275 1.03 . . . . 0.0 111.987 170.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 85.6 m-20 -58.82 -48.86 79.82 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 120.01 1.277 . . . . 0.0 110.846 172.297 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.22 -40.74 91.24 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 121.573 -0.704 . . . . 0.0 112.504 179.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 38.4 mmm-85 -61.55 -46.8 88.37 Favored 'General case' 0 N--CA 1.485 1.292 0 O-C-N 121.38 -0.825 . . . . 0.0 112.778 172.3 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 55.4 t -61.67 -46.07 97.33 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 C-N-CA 123.662 0.785 . . . . 0.0 111.058 177.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 56.5 mt -63.11 -43.49 98.28 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 117.839 -1.077 . . . . 0.0 112.107 178.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 54.5 mt -53.98 -52.6 34.82 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 CA-C-N 119.591 1.087 . . . . 0.0 110.146 171.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -63.33 -46.83 84.79 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 -177.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -69.91 -44.8 68.92 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 119.043 0.838 . . . . 0.0 112.233 -177.114 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -54.42 -54.85 35.15 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.951 0.9 . . . . 0.0 109.992 172.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.436 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 66.2 t90 -62.39 -42.76 99.67 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-O 117.771 -1.109 . . . . 0.0 112.436 178.805 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -57.56 -46.59 83.74 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 120.723 1.602 . . . . 0.0 112.513 178.408 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -66.65 -49.31 66.64 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 119.347 0.976 . . . . 0.0 112.036 176.399 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 6.1 mmp_? -53.9 -53.88 46.53 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.56 0.744 . . . . 0.0 110.053 177.487 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 45.7 tptt -64.04 -34.26 77.61 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 126.1 1.76 . . . . 0.0 113.374 -178.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt -59.7 -37.23 78.29 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.324 0.966 . . . . 0.0 111.086 169.453 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 70.7 m -81.71 -21.97 37.67 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 115.414 1.635 . . . . 0.0 115.414 169.116 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -143.52 84.82 9.78 Favored Pre-proline 0 N--CA 1.477 0.909 0 C-N-CA 125.913 1.685 . . . . 0.0 112.132 -161.063 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -60.45 -12.66 21.51 Favored 'Trans proline' 0 CA--C 1.544 1.019 0 C-N-CA 123.009 2.473 . . . . 0.0 115.288 -172.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 40.4 p90 -81.91 -8.07 59.65 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 115.509 1.67 . . . . 0.0 115.509 176.661 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.47 137.74 58.32 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 120.394 1.452 . . . . 0.0 113.444 -176.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 84.2 mtp180 -99.99 153.44 19.19 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 125.951 1.7 . . . . 0.0 112.277 175.021 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.436 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.4 tm? -128.4 130.99 48.48 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.769 1.628 . . . . 0.0 110.029 -174.29 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -142.01 131.08 23.23 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.244 1.018 . . . . 0.0 111.049 176.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 61.1 mtt -128.32 -0.37 5.7 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.737 1.384 . . . . 0.0 114.737 -171.824 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 63.6 m -65.77 150.86 47.84 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 118.769 0.713 . . . . 0.0 110.467 172.635 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 27.4 m-20 -59.86 -24.45 64.24 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 114.652 1.352 . . . . 0.0 114.652 -165.558 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -55.56 -36.76 67.17 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.678 0.791 . . . . 0.0 112.416 171.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.61 -39.31 90.77 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 118.868 0.758 . . . . 0.0 112.101 174.195 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.6 mp -73.14 -47.15 48.51 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 C-N-CA 124.341 1.056 . . . . 0.0 109.071 -179.307 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 11.3 m-30 -57.11 -44.41 83.22 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 118.669 0.668 . . . . 0.0 112.296 176.351 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.3 tmt_? -77.66 -38.29 48.05 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 124.656 1.182 . . . . 0.0 112.595 -173.246 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 46.8 mtt-85 -69.02 -41.92 77.1 Favored 'General case' 0 N--CA 1.483 1.181 0 CA-C-N 118.912 0.778 . . . . 0.0 112.506 169.473 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -130.35 71.15 82.38 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 125.43 1.492 . . . . 0.0 111.544 -164.145 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -66.33 -12.68 36.64 Favored 'Trans proline' 0 CA--C 1.54 0.813 0 C-N-CA 123.171 2.58 . . . . 0.0 113.739 -177.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 15.9 p-80 -72.83 -23.86 60.82 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.308 1.043 . . . . 0.0 113.442 172.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -80.79 -45.25 17.26 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.193 0.997 . . . . 0.0 112.528 -161.069 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 3.7 tmt_? . . . . . 0 C--O 1.253 1.278 0 C-N-CA 125.968 1.707 . . . . 0.0 110.752 -178.042 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.495 1.814 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 66.6 ttt180 -149.16 57.07 1.01 Allowed 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 124.747 1.219 . . . . 0.0 112.133 -177.598 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -178.27 131.15 1.69 Allowed Glycine 0 CA--C 1.534 1.23 0 O-C-N 121.669 -0.644 . . . . 0.0 114.146 175.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 82.3 p -153.21 162.03 41.76 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.949 1.699 . . . . 0.0 111.732 177.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 78.6 t60 -147.9 145.4 28.62 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.444 1.097 . . . . 0.0 112.561 179.303 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 -151.43 137.22 18.02 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 125.398 1.479 . . . . 0.0 110.616 169.022 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 40.4 t-80 -155.07 156.36 35.72 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.668 1.187 . . . . 0.0 111.758 177.474 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 19.0 p80 -145.1 154.11 42.13 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 125.205 1.402 . . . . 0.0 111.627 173.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 56.1 p-80 -146.63 155.65 42.61 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.651 1.18 . . . . 0.0 113.208 -173.092 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 55.0 p-80 -157.06 165.31 36.46 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.219 1.808 . . . . 0.0 111.523 178.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 173.64 138.94 2.77 Favored Glycine 0 CA--C 1.535 1.338 0 C-N-CA 123.677 0.656 . . . . 0.0 113.89 173.334 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 71.1 m -146.04 150.56 36.22 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.904 1.682 . . . . 0.0 111.529 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 62.0 t -133.58 114.96 21.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 C-N-CA 125.179 1.391 . . . . 0.0 109.371 174.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.0 m -137.89 15.29 2.88 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 -171.389 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 36.2 p90 -112.54 163.04 14.97 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.512 1.525 . . . . 0.0 113.322 -173.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 130.86 89.68 0.51 Allowed Glycine 0 CA--C 1.533 1.163 0 C-N-CA 125.693 1.616 . . . . 0.0 112.236 177.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -144.36 64.23 11.97 Favored Pre-proline 0 CA--C 1.556 1.179 0 C-N-CA 124.702 1.201 . . . . 0.0 112.351 -178.475 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -69.52 157.54 60.49 Favored 'Trans proline' 0 CA--C 1.543 0.955 0 C-N-CA 123.65 2.9 . . . . 0.0 112.884 179.388 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 75.4 p -150.3 151.57 31.64 Favored Pre-proline 0 N--CA 1.476 0.844 0 C-N-CA 125.004 1.321 . . . . 0.0 112.732 178.167 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -74.97 156.07 43.11 Favored 'Trans proline' 0 CA--C 1.542 0.919 0 C-N-CA 123.61 2.873 . . . . 0.0 112.721 177.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.1 pp -151.19 165.63 33.33 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.142 1.377 . . . . 0.0 112.871 176.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.3 t 60.41 178.55 0.1 Allowed 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 126.604 1.962 . . . . 0.0 115.678 177.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 61.39 8.4 2.14 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 127.907 2.483 . . . . 0.0 116.566 179.441 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -63.0 -30.97 72.01 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 120.447 -1.408 . . . . 0.0 113.764 -168.565 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 76.7 p -99.22 0.55 43.46 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.368 1.467 . . . . 0.0 114.743 -176.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -136.75 -5.81 1.94 Allowed 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 116.215 1.931 . . . . 0.0 116.215 -169.565 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -58.74 -23.57 60.07 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 115.137 1.532 . . . . 0.0 115.137 -173.083 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -112.12 1.42 16.27 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 126.915 2.086 . . . . 0.0 114.407 177.581 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 44.3 mm -94.92 97.25 6.63 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 C-N-CA 124.588 1.155 . . . . 0.0 110.871 -173.466 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 49.0 t-20 -152.45 122.45 7.05 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.143 1.377 . . . . 0.0 110.647 172.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 86.4 t80 -150.24 106.79 3.5 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.444 1.098 . . . . 0.0 110.855 171.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 36.8 tpp 59.89 159.45 0.04 OUTLIER 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 127.159 2.184 . . . . 0.0 115.316 -177.689 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 19.3 p -128.84 62.43 61.44 Favored Pre-proline 0 N--CA 1.48 1.027 0 C-N-CA 125.74 1.616 . . . . 0.0 111.607 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -71.79 153.61 58.93 Favored 'Trans proline' 0 CA--C 1.546 1.12 0 C-N-CA 123.068 2.512 . . . . 0.0 112.669 -175.508 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -71.96 115.78 4.44 Favored 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 123.071 2.514 . . . . 0.0 110.477 171.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -135.83 142.82 44.87 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 125.36 1.464 . . . . 0.0 111.33 -176.633 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -146.67 -27.93 0.4 Allowed 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 -177.594 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -137.14 143.54 42.53 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.939 1.296 . . . . 0.0 112.08 -174.185 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -137.44 44.38 2.25 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 126.157 1.783 . . . . 0.0 111.068 177.322 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -143.68 62.71 11.27 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 125.205 1.402 . . . . 0.0 112.135 -170.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -80.08 64.74 8.9 Favored 'Trans proline' 0 CA--C 1.546 1.096 0 C-N-CA 124.274 3.316 . . . . 0.0 112.332 -171.395 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 84.16 154.72 20.17 Favored Glycine 0 CA--C 1.538 1.508 0 C-N-CA 125.671 1.605 . . . . 0.0 113.27 -170.495 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -153.05 152.12 31.0 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.029 1.332 . . . . 0.0 111.927 -178.249 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 11.1 mp -100.77 160.49 14.32 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.566 1.546 . . . . 0.0 111.053 174.459 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -144.9 155.8 43.64 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.156 1.382 . . . . 0.0 113.215 178.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -97.15 154.02 17.62 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.312 1.445 . . . . 0.0 111.987 171.194 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 98.2 mt -130.67 157.36 43.0 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 125.64 1.576 . . . . 0.0 111.186 178.518 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 83.2 m-70 -77.87 141.09 39.32 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.587 0.755 . . . . 0.0 109.82 165.425 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -102.89 -16.75 15.79 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 -174.396 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -139.87 163.0 33.81 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.264 1.425 . . . . 0.0 112.373 -173.093 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.86 -162.71 54.43 Favored Glycine 0 CA--C 1.541 1.686 0 C-N-CA 123.978 0.799 . . . . 0.0 114.159 179.02 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -68.0 -17.02 46.11 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 123.279 2.653 . . . . 0.0 113.887 -175.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 81.7 mt -92.25 4.88 52.35 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.741 1.216 . . . . 0.0 113.837 174.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.88 114.96 2.55 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 121.142 1.792 . . . . 0.0 112.061 -178.313 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 92.12 3.55 67.58 Favored Glycine 0 CA--C 1.543 1.792 0 C-N-CA 125.704 1.621 . . . . 0.0 115.592 -173.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 5.6 mp -105.09 155.36 37.81 Favored Pre-proline 0 CA--C 1.555 1.147 0 C-N-CA 126.841 2.056 . . . . 0.0 111.26 178.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -68.4 162.22 41.55 Favored 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 124.71 3.606 . . . . 0.0 113.459 -170.423 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 14.9 t -102.15 -33.72 3.49 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 O-C-N 121.428 -0.795 . . . . 0.0 112.706 178.329 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 27.1 p -123.98 173.87 7.96 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 125.053 1.341 . . . . 0.0 114.165 -178.618 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 55.4 ttt85 -61.28 -42.1 98.08 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.128 0.971 . . . . 0.0 110.914 173.054 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 32.9 m -61.16 -45.03 96.29 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.908 0.883 . . . . 0.0 110.941 173.353 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 78.2 m-20 -61.11 -47.02 88.19 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 118.644 0.657 . . . . 0.0 111.273 175.595 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.36 -41.24 88.79 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.458 -0.776 . . . . 0.0 112.708 179.461 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.7 tmt_? -65.38 -45.44 84.06 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 118.661 0.664 . . . . 0.0 111.818 174.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 76.6 t -62.21 -46.01 97.43 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 CA-C-N 118.712 0.687 . . . . 0.0 111.38 177.787 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -63.84 -44.93 91.71 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 118.099 -0.953 . . . . 0.0 112.375 177.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 50.2 mt -53.94 -51.78 42.28 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 CA-C-N 119.684 1.129 . . . . 0.0 109.819 171.319 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -60.65 -52.41 65.27 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.09 0.556 . . . . 0.0 112.196 -176.561 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -78.63 -34.71 46.31 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -171.641 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -63.32 -44.22 95.56 Favored 'General case' 0 N--CA 1.467 0.377 0 O-C-N 121.807 -0.558 . . . . 0.0 110.051 169.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.426 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 68.2 t90 -59.41 -48.72 80.55 Favored 'General case' 0 C--O 1.216 -0.7 0 CA-C-O 116.834 -1.555 . . . . 0.0 111.753 170.658 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -51.59 -47.94 63.37 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 121.756 2.071 . . . . 0.0 112.606 179.394 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -68.12 -50.14 56.64 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 118.941 0.791 . . . . 0.0 112.432 178.705 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 90.0 mmt-85 -59.23 -45.14 91.93 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 121.471 -0.768 . . . . 0.0 110.474 178.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 47.1 tptt -61.31 -36.27 79.67 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 127.108 2.163 . . . . 0.0 113.078 174.833 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -61.33 -35.34 77.12 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.531 1.06 . . . . 0.0 111.145 169.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 60.6 m -80.31 -19.83 45.71 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 115.472 1.656 . . . . 0.0 115.472 167.096 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -142.07 78.71 16.92 Favored Pre-proline 0 N--CA 1.477 0.892 0 C-N-CA 127.004 2.122 . . . . 0.0 111.88 -166.151 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_endo -59.0 -15.81 29.45 Favored 'Trans proline' 0 CA--C 1.545 1.035 0 C-N-CA 123.121 2.547 . . . . 0.0 114.977 -173.487 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 39.4 p90 -78.89 -10.03 59.68 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.932 1.693 . . . . 0.0 115.3 174.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 14.6 tp -67.36 134.24 51.13 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 120.389 1.45 . . . . 0.0 113.849 -169.211 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 80.1 ttt180 -86.45 152.68 22.48 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 126.12 1.768 . . . . 0.0 112.494 178.171 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.426 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -131.4 131.49 43.66 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.824 2.05 . . . . 0.0 109.692 -177.05 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -143.49 135.26 26.48 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.945 0.898 . . . . 0.0 111.006 176.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 63.2 mtt -130.37 21.89 5.19 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.08 1.352 . . . . 0.0 112.782 -176.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 32.4 t -63.86 152.53 39.43 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.626 0.771 . . . . 0.0 111.173 173.315 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -52.02 -39.46 59.52 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.964 0.906 . . . . 0.0 112.329 179.349 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -59.32 -37.54 78.01 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.794 1.238 . . . . 0.0 112.78 176.426 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.3 -42.05 99.03 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 118.767 0.712 . . . . 0.0 111.638 176.388 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.26 -46.98 62.68 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 C-N-CA 123.384 0.674 . . . . 0.0 109.735 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 16.6 m-30 -56.11 -45.75 79.37 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 176.457 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.99 -38.31 37.11 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 124.417 1.087 . . . . 0.0 112.631 -172.098 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 56.0 ttt85 -75.7 -36.88 59.9 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.117 0.967 . . . . 0.0 112.631 175.265 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 38.4 m-85 -124.04 80.49 57.67 Favored Pre-proline 0 CA--C 1.545 0.773 0 C-N-CA 125.683 1.593 . . . . 0.0 110.929 -175.439 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -67.75 -9.54 25.86 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 123.326 2.684 . . . . 0.0 114.442 -173.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 10.7 p-80 -80.62 -18.54 47.85 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.343 1.057 . . . . 0.0 113.619 170.383 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.58 -10.8 26.4 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 126.666 1.986 . . . . 0.0 113.546 -172.512 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 6.5 ppt_? . . . . . 0 C--O 1.253 1.255 0 C-N-CA 124.621 1.168 . . . . 0.0 113.48 174.531 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 23.3 t . . . . . 0 N--CA 1.474 0.767 0 N-CA-C 110.31 -0.255 . . . . 0.0 110.31 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 22.2 m -140.19 152.92 21.95 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 125.124 1.37 . . . . 0.0 112.884 -176.78 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.6 m -140.97 155.82 46.17 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 125.967 1.707 . . . . 0.0 111.534 178.622 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 60.2 t80 -138.14 76.9 1.6 Allowed 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.645 1.178 . . . . 0.0 111.286 179.247 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -79.47 43.99 2.63 Favored Glycine 0 CA--C 1.537 1.46 0 C-N-CA 125.518 1.532 . . . . 0.0 114.589 -178.852 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -130.88 67.31 80.59 Favored Pre-proline 0 CA--C 1.553 1.084 0 C-N-CA 125.23 1.412 . . . . 0.0 112.953 -172.294 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -71.21 165.76 31.39 Favored 'Trans proline' 0 CA--C 1.544 1.017 0 C-N-CA 123.703 2.936 . . . . 0.0 112.617 174.232 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 61.8 m -129.42 66.41 76.8 Favored Pre-proline 0 N--CA 1.478 0.93 0 C-N-CA 124.93 1.292 . . . . 0.0 112.308 -178.863 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -70.4 159.24 53.6 Favored 'Trans proline' 0 CA--C 1.543 0.927 0 C-N-CA 123.559 2.839 . . . . 0.0 112.799 178.301 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 58.6 tp -146.05 130.55 17.79 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.033 1.333 . . . . 0.0 111.356 176.598 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 77.7 p -143.13 18.37 1.93 Allowed 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 125.089 1.356 . . . . 0.0 113.964 -177.125 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.0 t -90.11 2.39 55.32 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 114.633 1.345 . . . . 0.0 114.633 -167.397 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -137.4 127.3 25.69 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.832 1.253 . . . . 0.0 111.939 -176.418 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 69.3 m -136.88 62.48 1.6 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.976 2.11 . . . . 0.0 110.338 178.899 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 61.84 21.28 12.13 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.778 2.031 . . . . 0.0 115.237 -177.541 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -64.06 -25.78 68.26 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 115.106 1.521 . . . . 0.0 115.106 -171.616 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 . . . . . 0 CA--C 1.548 0.892 0 C-N-CA 125.632 1.573 . . . . 0.0 113.217 -179.137 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.584 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -83.67 143.95 29.73 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.348 1.059 . . . . 0.0 110.908 169.18 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 59.0 mt -128.08 157.66 40.1 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.336 1.054 . . . . 0.0 112.65 -169.496 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -79.2 138.82 38.0 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.22 1.008 . . . . 0.0 110.193 166.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -95.85 -15.3 22.57 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 114.658 1.355 . . . . 0.0 114.658 -173.773 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -150.28 169.4 21.45 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.721 1.209 . . . . 0.0 113.105 -172.242 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 72.49 -163.67 54.68 Favored Glycine 0 CA--C 1.54 1.65 0 C-N-CA 124.169 0.89 . . . . 0.0 114.041 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -67.63 -16.94 47.82 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 123.173 2.582 . . . . 0.0 113.713 -176.747 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.3 mt -94.01 5.88 50.28 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.723 1.209 . . . . 0.0 113.931 175.668 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.12 123.33 13.31 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 120.91 1.687 . . . . 0.0 112.387 -177.2 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 81.78 3.58 90.56 Favored Glycine 0 CA--C 1.54 1.641 0 C-N-CA 125.523 1.535 . . . . 0.0 115.323 -175.015 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 16.4 mt -101.46 162.1 21.53 Favored Pre-proline 0 CA--C 1.556 1.208 0 C-N-CA 126.145 1.778 . . . . 0.0 110.926 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -76.8 159.35 34.83 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 124.269 3.312 . . . . 0.0 113.562 -164.557 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 42.4 t -96.55 -33.85 4.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 CA-C-O 118.621 -0.704 . . . . 0.0 112.743 174.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 16.2 p -124.5 172.18 9.4 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 114.707 1.373 . . . . 0.0 114.707 -178.157 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 13.6 ptp180 -63.65 -35.03 79.19 Favored 'General case' 0 N--CA 1.482 1.125 0 O-C-N 121.358 -0.839 . . . . 0.0 112.052 174.72 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.0 t -64.98 -46.58 80.86 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.427 0.691 . . . . 0.0 110.411 171.134 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -59.78 -42.64 93.81 Favored 'General case' 0 CA--C 1.539 0.538 0 O-C-N 121.658 -0.651 . . . . 0.0 111.616 177.141 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.01 -43.66 94.98 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 123.957 0.903 . . . . 0.0 113.035 177.191 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.6 tmt_? -64.49 -43.61 93.6 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 119.311 0.959 . . . . 0.0 111.668 176.495 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 77.5 t -63.13 -44.34 99.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 123.605 0.762 . . . . 0.0 110.983 176.803 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 20.4 mt -57.89 -51.26 70.34 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 118.113 -0.946 . . . . 0.0 112.103 173.848 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 65.7 mt -54.37 -50.12 59.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 CA-C-N 119.25 0.932 . . . . 0.0 110.365 177.274 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.438 ' HB2' ' HE1' ' A' ' 101' ' ' MET . 16.0 t80 -64.19 -47.8 78.36 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 -178.104 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -70.45 -42.84 70.98 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 119.131 0.878 . . . . 0.0 112.466 -177.705 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -56.22 -54.79 41.06 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 124.286 1.034 . . . . 0.0 110.073 172.959 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.443 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 68.4 t90 -61.07 -45.37 95.03 Favored 'General case' 0 C--O 1.219 -0.505 0 CA-C-O 117.755 -1.117 . . . . 0.0 111.934 177.674 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -55.49 -47.69 75.76 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 120.562 1.528 . . . . 0.0 112.433 178.957 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -70.65 -48.44 54.92 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 119.524 1.056 . . . . 0.0 112.521 178.423 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.5 mmp_? -55.34 -49.8 71.3 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.063 0.545 . . . . 0.0 110.48 177.375 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.8 tmtt? -69.79 -29.23 66.49 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.882 1.673 . . . . 0.0 113.637 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 34.0 ttpt -58.92 -37.1 75.89 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.965 1.257 . . . . 0.0 110.851 165.583 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 68.3 m -81.89 -22.57 36.79 Favored 'General case' 0 N--CA 1.481 1.106 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 168.142 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -139.92 73.06 33.9 Favored Pre-proline 0 N--CA 1.477 0.916 0 C-N-CA 126.669 1.988 . . . . 0.0 111.534 -164.899 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -62.05 -6.68 8.34 Favored 'Trans proline' 0 CA--C 1.546 1.099 0 C-N-CA 124.095 3.196 . . . . 0.0 116.5 -165.168 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 37.7 p90 -83.9 -11.58 56.71 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 126.458 1.903 . . . . 0.0 114.875 175.203 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.5 tp -65.54 136.55 56.54 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 -167.185 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 27.2 mmm180 -84.23 156.07 22.18 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 124.886 1.275 . . . . 0.0 112.798 179.39 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.443 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -138.75 127.46 23.45 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 126.224 1.81 . . . . 0.0 110.1 -175.636 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -150.17 139.66 21.49 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.604 1.161 . . . . 0.0 111.772 177.349 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.438 ' HE1' ' HB2' ' A' ' 84' ' ' PHE . 62.6 mtt -135.01 11.04 3.6 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 114.098 1.148 . . . . 0.0 114.098 -167.751 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 29.8 m -63.02 155.02 28.8 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.117 0.967 . . . . 0.0 111.541 177.039 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -55.23 -36.31 65.86 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 121.09 -1.007 . . . . 0.0 113.448 -171.909 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -60.86 -34.16 74.18 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.964 0.905 . . . . 0.0 112.841 175.702 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.05 -41.84 98.55 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 119.071 0.851 . . . . 0.0 111.56 174.712 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.6 mp -71.34 -45.94 67.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 C-N-CA 123.855 0.862 . . . . 0.0 109.413 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 15.5 m-30 -56.21 -47.02 79.22 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 118.746 0.703 . . . . 0.0 112.693 174.869 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.9 tmt_? -76.0 -38.18 57.64 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.582 1.153 . . . . 0.0 112.366 -172.14 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 6.1 ttm180 -75.18 -41.28 58.32 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.675 0.79 . . . . 0.0 112.249 173.846 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 38.7 m-85 -124.6 81.43 60.3 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 126.028 1.731 . . . . 0.0 111.027 -173.009 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -66.28 -17.48 54.25 Favored 'Trans proline' 0 CA--C 1.539 0.75 0 C-N-CA 123.114 2.543 . . . . 0.0 114.499 -171.297 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 10.2 p-80 -74.25 -22.89 59.12 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.875 0.87 . . . . 0.0 113.299 173.526 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -84.32 -15.04 47.99 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 125.819 1.648 . . . . 0.0 113.162 -175.748 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 57.8 ttp180 . . . . . 0 C--O 1.254 1.299 0 C-N-CA 124.501 1.12 . . . . 0.0 111.985 174.018 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 78.8 p . . . . . 0 N--CA 1.478 0.944 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.8 p -156.4 148.11 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 126.263 1.825 . . . . 0.0 110.718 175.607 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 79.2 p -150.87 151.69 32.59 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.81 1.244 . . . . 0.0 112.552 174.627 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 38.6 t80 -153.9 155.87 36.5 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.082 1.353 . . . . 0.0 111.739 176.883 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -77.1 172.83 55.08 Favored Glycine 0 CA--C 1.539 1.568 0 C-N-CA 124.411 1.005 . . . . 0.0 114.801 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -148.13 148.42 29.41 Favored Pre-proline 0 CA--C 1.551 1.007 0 C-N-CA 125.076 1.35 . . . . 0.0 111.826 174.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -74.53 118.33 5.29 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 123.247 2.632 . . . . 0.0 111.708 178.512 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 68.6 m -139.2 61.63 21.67 Favored Pre-proline 0 N--CA 1.476 0.856 0 C-N-CA 125.068 1.347 . . . . 0.0 111.92 -179.58 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -66.22 126.39 15.63 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 123.2 2.6 . . . . 0.0 111.904 -178.603 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 21.9 tp -141.58 -3.35 1.16 Allowed 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 124.524 1.13 . . . . 0.0 113.963 -175.013 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 21.4 m -64.59 138.35 58.35 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.482 1.113 . . . . 0.0 113.202 -173.934 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 65.4 p -90.94 -16.56 27.87 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -178.565 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.1 pp20? -77.82 160.84 28.07 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 124.499 1.12 . . . . 0.0 113.6 179.198 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 81.4 p -122.05 20.73 10.68 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 125.816 1.646 . . . . 0.0 114.074 -170.153 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 60.64 -7.92 0.07 Allowed 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 127.805 2.442 . . . . 0.0 116.391 -170.823 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -64.19 -25.49 68.1 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 120.858 -1.151 . . . . 0.0 113.998 -177.892 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 . . . . . 0 N--CA 1.472 0.669 0 C-N-CA 125.229 1.412 . . . . 0.0 114.604 176.81 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.55 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -91.24 163.47 14.23 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.642 1.577 . . . . 0.0 111.408 165.357 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 96.7 mt -136.64 157.18 47.38 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 125.147 1.379 . . . . 0.0 112.18 -176.337 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 84.8 m-70 -80.82 144.13 32.28 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.681 0.792 . . . . 0.0 109.906 162.362 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -109.01 -6.11 15.79 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.631 1.345 . . . . 0.0 114.631 -173.591 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -147.54 164.59 32.94 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.904 1.282 . . . . 0.0 112.917 -175.33 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 69.23 -161.77 52.07 Favored Glycine 0 CA--C 1.541 1.681 0 C-N-CA 123.888 0.756 . . . . 0.0 113.892 -179.52 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -68.09 -15.93 43.89 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 123.212 2.608 . . . . 0.0 113.752 -177.525 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 81.3 mt -92.49 4.2 53.98 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.815 1.246 . . . . 0.0 113.924 175.501 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.27 113.27 1.87 Allowed 'General case' 0 CA--C 1.548 0.893 0 CA-C-N 121.048 1.749 . . . . 0.0 111.807 -179.561 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.32 9.76 62.95 Favored Glycine 0 CA--C 1.542 1.743 0 C-N-CA 125.179 1.371 . . . . 0.0 115.676 -173.263 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 5.3 mp -111.84 156.56 41.46 Favored Pre-proline 0 CA--C 1.556 1.19 0 C-N-CA 126.911 2.084 . . . . 0.0 111.545 178.804 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -63.17 162.21 27.38 Favored 'Trans proline' 0 C--N 1.356 0.921 0 C-N-CA 125.056 3.837 . . . . 0.0 114.33 -172.809 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 8.2 t -105.5 -30.04 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 123.666 0.786 . . . . 0.0 111.824 172.409 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 26.6 p -126.9 170.71 11.96 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 125.087 1.355 . . . . 0.0 114.237 -178.117 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 42.9 ttm-85 -60.37 -41.4 93.65 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.011 0.924 . . . . 0.0 110.848 172.768 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 28.4 m -60.47 -45.45 93.69 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.903 0.881 . . . . 0.0 111.017 173.718 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -59.78 -49.32 78.19 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 118.443 0.565 . . . . 0.0 110.9 175.427 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.03 -43.73 98.46 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.633 0.773 . . . . 0.0 112.637 -177.847 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 73.0 ttt180 -68.91 -40.94 78.8 Favored 'General case' 0 N--CA 1.478 0.935 0 O-C-N 121.213 -0.929 . . . . 0.0 112.497 178.1 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 77.3 t -64.76 -42.22 94.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 CA-C-N 118.365 0.529 . . . . 0.0 111.192 175.389 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 87.4 mt -65.54 -41.56 92.9 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 118.179 -0.915 . . . . 0.0 112.541 176.267 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 47.7 mt -53.65 -50.89 47.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 CA-C-N 119.368 0.986 . . . . 0.0 109.729 169.794 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -64.19 -46.63 83.1 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 113.255 0.835 . . . . 0.0 113.255 -178.241 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -69.96 -44.41 69.56 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.136 0.975 . . . . 0.0 112.598 -176.706 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -61.04 -52.11 66.36 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 118.554 -0.736 . . . . 0.0 110.117 172.747 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.422 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 61.7 t90 -56.06 -46.44 78.93 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-N 119.452 1.024 . . . . 0.0 112.126 177.004 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -51.75 -55.36 20.13 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 119.72 1.145 . . . . 0.0 112.459 176.248 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -74.25 -42.97 58.81 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 121.137 -0.977 . . . . 0.0 112.822 -175.647 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 35.7 mmt180 -57.29 -45.34 84.21 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.296 0.638 . . . . 0.0 109.835 174.81 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.9 tmtt? -69.72 -32.18 70.6 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.106 0.962 . . . . 0.0 113.516 178.953 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 66.4 mttt -61.89 -31.14 71.4 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 119.761 1.164 . . . . 0.0 111.715 167.885 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 70.6 m -81.82 -24.21 36.01 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 115.14 1.533 . . . . 0.0 115.14 165.93 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -142.49 78.97 15.86 Favored Pre-proline 0 CA--C 1.55 0.949 0 C-N-CA 126.819 2.048 . . . . 0.0 111.561 -166.136 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -62.21 -5.08 5.97 Favored 'Trans proline' 0 CA--C 1.547 1.161 0 C-N-CA 123.707 2.938 . . . . 0.0 116.566 -167.005 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 39.5 p90 -88.04 -3.53 58.89 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.815 2.046 . . . . 0.0 115.065 175.75 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.84 141.82 43.3 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-N 119.96 1.255 . . . . 0.0 113.447 -177.634 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 1.9 mpp_? -103.24 153.82 19.99 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 125.255 1.422 . . . . 0.0 112.412 174.301 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.422 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.3 tm? -127.37 128.11 45.32 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.837 1.655 . . . . 0.0 110.264 -173.857 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 58.4 t0 -143.25 128.7 19.01 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.355 1.062 . . . . 0.0 110.956 179.203 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 65.3 mtt -127.47 10.76 6.75 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.459 1.504 . . . . 0.0 113.127 -177.928 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 72.6 m -68.14 152.44 45.48 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 121.42 -0.8 . . . . 0.0 111.383 172.19 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -57.21 -34.58 68.68 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -166.14 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 33.7 mmtp -59.12 -37.28 76.83 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.002 0.921 . . . . 0.0 112.484 177.03 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.38 -37.25 82.7 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.546 0.739 . . . . 0.0 111.844 173.073 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 2.5 mm -75.18 -44.0 43.69 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 C-N-CA 123.374 0.67 . . . . 0.0 109.396 -175.31 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 10.2 m-30 -60.86 -45.39 94.72 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 123.088 0.555 . . . . 0.0 112.106 174.405 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 6.5 tmm_? -74.15 -35.14 64.05 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.126 0.971 . . . . 0.0 112.52 -173.14 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 73.4 mtp85 -74.78 -40.61 61.07 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.702 0.801 . . . . 0.0 112.564 170.706 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 34.3 m-85 -130.3 77.38 76.29 Favored Pre-proline 0 CA--C 1.545 0.785 0 C-N-CA 125.594 1.558 . . . . 0.0 111.266 -169.164 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -66.51 -16.85 52.31 Favored 'Trans proline' 0 CA--C 1.539 0.767 0 C-N-CA 123.077 2.518 . . . . 0.0 113.979 -173.786 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 12.1 p-80 -74.05 -22.39 59.56 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.278 1.031 . . . . 0.0 113.495 172.763 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.47 -19.57 27.8 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 125.986 1.715 . . . . 0.0 112.753 -172.584 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 . . . . . 0 C--O 1.256 1.411 0 C-N-CA 124.625 1.17 . . . . 0.0 112.202 174.738 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 88.6 p . . . . . 0 N--CA 1.474 0.774 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.3 p -150.89 148.51 14.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 125.391 1.476 . . . . 0.0 111.027 178.608 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.2 t -148.18 141.74 25.44 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.623 1.169 . . . . 0.0 111.668 175.296 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -152.3 154.51 35.83 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.713 1.605 . . . . 0.0 110.912 176.416 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 173.62 -154.81 20.84 Favored Glycine 0 CA--C 1.534 1.276 0 C-N-CA 123.702 0.668 . . . . 0.0 114.148 -178.837 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . 50.71 56.43 17.23 Favored Pre-proline 0 CA--C 1.557 1.243 0 C-N-CA 126.323 1.849 . . . . 0.0 114.981 -179.563 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -66.75 159.44 51.26 Favored 'Trans proline' 0 CA--C 1.544 0.981 0 C-N-CA 123.242 2.628 . . . . 0.0 112.328 174.346 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 37.3 p -136.57 56.78 14.33 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 124.835 1.254 . . . . 0.0 113.863 -173.775 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -64.67 143.29 80.44 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 123.208 2.605 . . . . 0.0 112.233 177.051 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 58.2 tp -153.34 142.65 21.55 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.86 1.264 . . . . 0.0 111.715 -177.605 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 66.5 p -145.57 140.69 27.6 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.201 1.4 . . . . 0.0 111.354 168.125 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.4 m -141.02 13.22 2.24 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 -169.045 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -148.1 156.35 42.51 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.672 1.189 . . . . 0.0 113.466 -170.435 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 19.4 t -154.55 148.39 25.54 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.471 1.508 . . . . 0.0 111.156 175.014 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 56.95 24.25 9.19 Favored 'General case' 0 CA--C 1.552 1.019 0 C-N-CA 125.676 1.59 . . . . 0.0 114.712 178.114 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -75.7 -24.8 56.26 Favored 'General case' 0 N--CA 1.475 0.799 0 O-C-N 120.816 -1.177 . . . . 0.0 113.918 -174.779 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 . . . . . 0 CA--C 1.546 0.815 0 C-N-CA 125.624 1.57 . . . . 0.0 114.693 -175.806 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.573 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -84.61 144.05 28.86 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.437 1.095 . . . . 0.0 110.7 166.693 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.4 mt -128.05 157.55 40.38 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.408 1.083 . . . . 0.0 112.441 -169.943 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -78.07 138.72 38.91 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.896 0.879 . . . . 0.0 110.044 166.846 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -94.09 -22.75 18.3 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 114.321 1.23 . . . . 0.0 114.321 -175.209 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -140.68 165.91 26.19 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.99 1.316 . . . . 0.0 112.855 -170.056 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.37 -163.14 54.81 Favored Glycine 0 CA--C 1.54 1.599 0 C-N-CA 124.247 0.927 . . . . 0.0 114.201 177.618 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -67.49 -17.08 48.62 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 123.314 2.676 . . . . 0.0 113.754 -176.016 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.5 mt -93.94 5.0 53.1 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.662 1.185 . . . . 0.0 113.782 175.641 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.32 123.69 14.64 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 120.936 1.698 . . . . 0.0 112.282 -177.06 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 82.58 3.04 90.68 Favored Glycine 0 CA--C 1.541 1.664 0 C-N-CA 125.631 1.586 . . . . 0.0 115.321 -174.863 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.402 ' HB3' ' HD2' ' A' ' 73' ' ' PRO . 18.0 mt -102.1 161.63 22.8 Favored Pre-proline 0 CA--C 1.556 1.184 0 C-N-CA 126.057 1.743 . . . . 0.0 111.087 -179.214 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.402 ' HD2' ' HB3' ' A' ' 72' ' ' LEU . 73.5 Cg_endo -77.06 156.65 34.05 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 124.208 3.272 . . . . 0.0 113.837 -164.822 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 39.2 t -94.73 -35.73 6.37 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 O-C-N 121.569 -0.707 . . . . 0.0 112.82 176.45 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 19.9 p -123.44 172.67 8.53 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 125.229 1.412 . . . . 0.0 114.017 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 47.7 ttp180 -64.7 -36.43 84.26 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 121.11 -0.994 . . . . 0.0 110.97 174.948 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 30.4 m -60.53 -44.27 96.25 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.476 0.71 . . . . 0.0 110.937 170.507 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 -63.19 -43.67 97.56 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.48 -0.762 . . . . 0.0 111.74 176.238 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.6 -41.45 96.22 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 118.79 0.723 . . . . 0.0 112.743 177.372 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 22.9 tpp85 -61.75 -45.89 91.98 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.096 1.359 . . . . 0.0 111.762 175.047 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 73.4 t -65.08 -44.14 95.76 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 123.705 0.802 . . . . 0.0 111.11 177.247 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 17.9 mt -56.46 -49.71 73.81 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 118.603 -0.713 . . . . 0.0 111.997 173.435 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 51.8 mt -54.24 -52.05 42.02 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 CA-C-N 118.573 0.624 . . . . 0.0 110.322 176.99 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 22.5 t80 -66.6 -47.19 73.45 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -177.347 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -68.33 -45.47 72.82 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 118.722 0.692 . . . . 0.0 112.244 -177.552 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 58.1 mm-40 -60.51 -51.4 69.62 Favored 'General case' 0 C--N 1.342 0.248 0 CA-C-O 118.38 -0.819 . . . . 0.0 109.926 174.278 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.445 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 67.5 t90 -56.6 -43.61 80.3 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 119.797 1.18 . . . . 0.0 112.598 177.63 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -59.04 -49.64 77.1 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 119.849 1.204 . . . . 0.0 113.109 177.009 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -71.56 -46.31 59.78 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 119.673 1.124 . . . . 0.0 112.471 -179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 33.4 mmt180 -58.8 -44.6 90.83 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.752 0.821 . . . . 0.0 109.721 176.926 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 74.5 tttt -70.8 -29.41 65.59 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 176.46 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -59.47 -35.2 73.64 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 119.922 1.237 . . . . 0.0 110.857 166.955 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 8.4 t -78.22 -32.9 50.12 Favored 'General case' 0 CA--C 1.553 1.088 0 N-CA-C 114.617 1.34 . . . . 0.0 114.617 167.116 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -132.97 77.82 67.22 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 127.196 2.198 . . . . 0.0 112.198 -166.627 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -63.9 5.79 0.34 Allowed 'Trans proline' 0 CA--C 1.549 1.247 0 C-N-CA 124.697 3.598 . . . . 0.0 117.532 -165.194 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 31.2 p90 -99.78 -6.01 27.67 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 127.306 2.242 . . . . 0.0 114.806 177.88 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 13.1 tp -65.77 139.51 58.35 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 115.224 1.565 . . . . 0.0 115.224 -167.011 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 11.6 ptp85 -90.02 157.74 17.67 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 125.834 1.653 . . . . 0.0 113.788 176.917 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.445 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.4 tm? -137.95 130.95 30.13 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 126.935 2.094 . . . . 0.0 109.924 -172.348 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -142.03 136.65 30.45 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.288 1.035 . . . . 0.0 110.632 172.398 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 61.9 mtt -123.61 5.76 8.89 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.912 1.285 . . . . 0.0 114.268 -172.864 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 35.0 t -63.74 148.22 49.7 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 119.011 0.823 . . . . 0.0 111.557 178.479 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -53.82 -31.86 50.76 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 121.202 -0.937 . . . . 0.0 112.813 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 53.8 tptt -54.93 -41.24 70.78 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.956 1.302 . . . . 0.0 112.623 172.748 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.68 -36.41 83.77 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.159 0.983 . . . . 0.0 112.263 176.363 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.9 mp -74.35 -46.51 43.6 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 C-N-CA 124.185 0.994 . . . . 0.0 109.458 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -56.43 -44.74 80.69 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 119.076 0.853 . . . . 0.0 112.132 174.596 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.3 tmt_? -72.4 -40.55 67.12 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 124.576 1.15 . . . . 0.0 112.26 -174.863 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 73.4 mtt85 -72.04 -38.75 69.46 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 173.091 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -131.48 79.39 69.54 Favored Pre-proline 0 CA--C 1.545 0.753 0 C-N-CA 125.584 1.553 . . . . 0.0 110.822 -166.6 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -66.85 -16.05 48.88 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 123.064 2.509 . . . . 0.0 113.986 -173.606 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 12.1 p-80 -73.49 -23.94 60.11 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.052 0.941 . . . . 0.0 113.134 172.507 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.44 -27.99 37.83 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.579 1.552 . . . . 0.0 112.3 -173.201 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 51.8 ttt85 . . . . . 0 C--O 1.255 1.359 0 C-N-CA 124.69 1.196 . . . . 0.0 112.288 175.357 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.6 t . . . . . 0 N--CA 1.473 0.684 0 CA-C-O 120.622 0.249 . . . . 0.0 111.088 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 9.7 p -83.73 143.77 11.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 124.444 1.098 . . . . 0.0 112.02 -178.726 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 50.4 m -79.44 152.94 30.02 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.04 0.936 . . . . 0.0 112.379 175.905 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -124.55 146.8 48.81 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.937 1.295 . . . . 0.0 111.566 176.403 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 72.56 177.19 30.65 Favored Glycine 0 CA--C 1.539 1.546 0 C-N-CA 123.993 0.806 . . . . 0.0 113.73 -169.449 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -149.27 151.32 33.66 Favored Pre-proline 0 CA--C 1.55 0.952 0 C-N-CA 125.033 1.333 . . . . 0.0 111.929 179.402 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.48 149.33 68.54 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 123.209 2.606 . . . . 0.0 112.219 175.904 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 49.8 m -75.01 147.58 83.76 Favored Pre-proline 0 N--CA 1.474 0.728 0 C-N-CA 123.921 0.888 . . . . 0.0 112.791 -178.963 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -71.06 164.82 34.43 Favored 'Trans proline' 0 CA--C 1.543 0.95 0 C-N-CA 123.522 2.815 . . . . 0.0 112.322 172.254 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.3 tt -136.34 127.71 28.4 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.975 1.31 . . . . 0.0 110.836 178.159 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 31.2 m -139.8 29.71 2.1 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.286 1.435 . . . . 0.0 112.591 -173.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.5 m -74.39 -10.07 59.21 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 115.921 1.823 . . . . 0.0 115.921 -164.076 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -129.08 136.09 49.78 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.939 1.296 . . . . 0.0 111.884 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 81.7 p -158.54 166.66 31.61 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.425 1.49 . . . . 0.0 112.575 -177.361 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 61.12 21.35 11.76 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 115.35 1.611 . . . . 0.0 115.35 172.292 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -74.45 -19.61 60.33 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 120.769 -1.207 . . . . 0.0 114.158 -175.009 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 . . . . . 0 CA--C 1.553 1.058 0 C-N-CA 125.416 1.486 . . . . 0.0 113.41 -177.656 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.619 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -95.23 150.52 20.14 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.981 1.312 . . . . 0.0 112.137 173.686 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 91.5 mt -130.43 157.62 42.11 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.623 1.569 . . . . 0.0 111.675 -179.164 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -79.06 141.26 37.55 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.102 0.961 . . . . 0.0 110.463 168.004 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -100.25 -11.85 20.02 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 -173.954 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -149.41 167.83 25.08 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.791 1.236 . . . . 0.0 113.233 -172.781 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.41 -163.62 54.11 Favored Glycine 0 CA--C 1.54 1.647 0 C-N-CA 124.16 0.886 . . . . 0.0 114.014 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -67.64 -16.56 46.97 Favored 'Trans proline' 0 CA--C 1.542 0.882 0 C-N-CA 123.262 2.642 . . . . 0.0 113.686 -177.653 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.0 mt -92.89 4.66 53.51 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.702 1.201 . . . . 0.0 113.873 175.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.63 122.62 11.76 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 120.874 1.67 . . . . 0.0 112.016 -177.661 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.2 5.06 89.35 Favored Glycine 0 CA--C 1.541 1.704 0 C-N-CA 125.399 1.476 . . . . 0.0 115.404 -174.537 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 18.7 mt -104.74 159.07 30.55 Favored Pre-proline 0 CA--C 1.556 1.177 0 C-N-CA 126.227 1.811 . . . . 0.0 111.263 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -79.38 160.12 25.89 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 124.523 3.482 . . . . 0.0 113.805 -164.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 19.1 t -102.36 -33.15 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 N-CA-C 113.381 0.882 . . . . 0.0 113.381 -175.96 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 19.7 p -123.44 171.28 9.59 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 114.3 1.222 . . . . 0.0 114.3 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 46.3 ttt180 -61.83 -40.14 94.24 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 124.356 1.063 . . . . 0.0 110.767 177.384 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 31.4 m -63.6 -44.42 94.06 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 124.683 1.193 . . . . 0.0 111.552 171.634 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 78.5 m-20 -60.1 -47.0 87.72 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.007 0.821 . . . . 0.0 110.993 174.908 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.66 -39.56 91.82 Favored 'General case' 0 CA--C 1.541 0.596 0 O-C-N 121.405 -0.81 . . . . 0.0 112.575 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 78.9 ttt180 -64.49 -43.66 93.46 Favored 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 119.24 0.927 . . . . 0.0 112.344 172.742 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 54.9 t -60.62 -49.24 85.25 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 CA-C-N 118.797 0.726 . . . . 0.0 111.182 175.494 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -62.64 -42.66 99.73 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 118.22 -0.895 . . . . 0.0 112.15 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 56.0 mt -55.86 -51.37 61.1 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 CA-C-N 119.408 1.004 . . . . 0.0 110.471 170.383 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 20.2 t80 -63.67 -47.63 80.44 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -175.918 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 12.3 t30 -68.99 -44.07 73.57 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 118.913 0.779 . . . . 0.0 112.169 -179.354 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -56.21 -53.5 56.46 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 122.701 0.401 . . . . 0.0 110.059 174.285 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.448 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 62.6 t90 -59.37 -46.8 87.64 Favored 'General case' 0 C--O 1.218 -0.587 0 CA-C-O 117.415 -1.278 . . . . 0.0 111.793 177.226 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -55.91 -48.76 75.09 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 120.928 1.694 . . . . 0.0 113.306 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -69.01 -47.4 65.59 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.171 0.896 . . . . 0.0 111.982 179.279 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 38.8 mmm-85 -59.16 -47.63 84.59 Favored 'General case' 0 C--O 1.216 -0.67 0 O-C-N 121.645 -0.659 . . . . 0.0 110.699 177.518 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 18.9 tptm -62.42 -35.09 78.15 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 126.07 1.748 . . . . 0.0 113.043 176.337 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 14.9 tmtt? -59.44 -36.82 76.65 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 119.603 1.092 . . . . 0.0 111.126 168.458 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 66.5 m -81.7 -18.34 44.73 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 115.926 1.824 . . . . 0.0 115.926 168.691 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -140.13 84.07 15.19 Favored Pre-proline 0 N--CA 1.477 0.903 0 C-N-CA 126.603 1.961 . . . . 0.0 111.88 -165.467 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -62.04 -0.92 1.91 Allowed 'Trans proline' 0 CA--C 1.549 1.256 0 C-N-CA 124.274 3.316 . . . . 0.0 116.598 -171.559 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 31.3 p90 -98.25 -10.96 23.17 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.667 1.987 . . . . 0.0 115.161 177.616 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 11.1 tp -66.82 137.73 56.82 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 114.671 1.36 . . . . 0.0 114.671 -166.854 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 18.6 mmt85 -99.37 159.25 15.15 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 126.05 1.74 . . . . 0.0 112.44 -179.638 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.448 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.4 tm? -137.07 133.51 35.5 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.573 1.949 . . . . 0.0 109.958 -169.556 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 54.0 t0 -141.43 130.53 23.34 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.186 0.994 . . . . 0.0 111.079 176.781 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 65.4 mtt -124.47 6.88 8.3 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.259 1.423 . . . . 0.0 113.409 -179.002 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 68.7 m -64.18 147.25 52.76 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 121.496 -0.753 . . . . 0.0 110.547 168.746 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.4 -26.23 67.71 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 113.526 0.935 . . . . 0.0 113.526 -166.009 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 61.0 mtpt -56.95 -34.79 68.37 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.76 1.224 . . . . 0.0 113.248 172.677 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.92 -39.69 92.93 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 118.914 0.779 . . . . 0.0 111.613 173.963 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.6 mp -73.62 -46.13 48.94 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 C-N-CA 124.299 1.039 . . . . 0.0 109.24 -179.647 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.4 m-30 -55.87 -46.13 78.34 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 119.152 0.887 . . . . 0.0 112.464 175.39 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.72 -41.59 44.53 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.387 1.075 . . . . 0.0 112.532 -173.087 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 6.9 ttm180 -75.27 -39.81 59.4 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.642 0.777 . . . . 0.0 112.447 176.563 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -124.73 74.58 64.19 Favored Pre-proline 0 CA--C 1.547 0.854 0 C-N-CA 125.999 1.72 . . . . 0.0 111.214 -172.521 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -67.09 -10.25 27.91 Favored 'Trans proline' 0 CA--C 1.538 0.694 0 C-N-CA 123.521 2.814 . . . . 0.0 114.626 -173.619 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 14.7 p-80 -77.98 -24.55 47.99 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.341 1.056 . . . . 0.0 113.407 172.079 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -77.76 -48.84 15.64 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.292 1.037 . . . . 0.0 112.057 -161.447 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 10.7 mmt180 . . . . . 0 C--O 1.254 1.301 0 C-N-CA 126.442 1.897 . . . . 0.0 112.923 179.633 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.2 t . . . . . 0 N--CA 1.476 0.865 0 N-CA-C 113.021 0.749 . . . . 0.0 113.021 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 13.1 p -153.75 142.94 14.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 126.0 1.72 . . . . 0.0 110.271 174.236 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 82.1 p -155.62 159.95 40.04 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.331 1.053 . . . . 0.0 113.366 -178.85 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 90.7 t80 -148.08 151.37 35.54 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.458 1.503 . . . . 0.0 111.252 170.016 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -179.71 47.33 0.08 OUTLIER Glycine 0 CA--C 1.532 1.156 0 C-N-CA 123.848 0.737 . . . . 0.0 113.772 177.608 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -129.09 62.11 60.63 Favored Pre-proline 0 CA--C 1.554 1.117 0 C-N-CA 124.429 1.092 . . . . 0.0 113.944 -171.744 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -69.97 168.74 20.95 Favored 'Trans proline' 0 CA--C 1.545 1.054 0 C-N-CA 123.379 2.72 . . . . 0.0 112.163 169.755 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 14.8 t -134.88 83.8 39.76 Favored Pre-proline 0 N--CA 1.474 0.764 0 C-N-CA 124.465 1.106 . . . . 0.0 111.316 176.093 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -80.22 64.03 8.82 Favored 'Trans proline' 0 CA--C 1.546 1.115 0 C-N-CA 124.454 3.436 . . . . 0.0 111.475 -179.413 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -75.77 -6.61 51.45 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 115.784 1.772 . . . . 0.0 115.784 -170.675 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.2 m -64.11 139.67 58.79 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.633 1.173 . . . . 0.0 113.132 -175.729 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 77.9 p -133.41 15.05 4.11 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 125.19 1.396 . . . . 0.0 114.291 -171.968 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -64.03 -27.92 69.45 Favored 'General case' 0 N--CA 1.476 0.871 0 O-C-N 120.901 -1.125 . . . . 0.0 113.691 -171.8 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 31.1 p -79.84 -45.89 17.89 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.579 1.151 . . . . 0.0 112.214 171.664 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 57.8 mt-10 -60.21 -27.0 66.82 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.78 1.232 . . . . 0.0 112.868 179.649 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -67.37 -14.18 62.69 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.018 1.327 . . . . 0.0 114.239 175.43 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 . . . . . 0 N--CA 1.476 0.853 0 N-CA-C 115.624 1.713 . . . . 0.0 115.624 179.583 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.621 0 CA-C-O 120.398 0.142 . . . . 0.0 111.34 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -84.36 143.71 29.3 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.318 1.047 . . . . 0.0 111.22 170.759 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 58.3 mt -126.88 157.46 39.3 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.718 1.207 . . . . 0.0 112.629 -170.295 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -79.41 137.47 37.28 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.01 0.924 . . . . 0.0 110.24 166.53 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -93.74 -16.9 23.74 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 -174.211 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -150.65 170.31 19.49 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.772 1.229 . . . . 0.0 113.005 -172.423 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.59 -163.99 54.79 Favored Glycine 0 CA--C 1.54 1.655 0 C-N-CA 124.155 0.883 . . . . 0.0 114.049 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -67.58 -17.11 48.2 Favored 'Trans proline' 0 CA--C 1.542 0.882 0 C-N-CA 123.265 2.643 . . . . 0.0 113.752 -176.075 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.7 mt -95.32 6.89 47.8 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.699 1.199 . . . . 0.0 113.834 175.849 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -54.7 123.46 13.34 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 120.853 1.66 . . . . 0.0 112.442 -176.926 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 81.63 3.0 90.72 Favored Glycine 0 CA--C 1.54 1.625 0 C-N-CA 125.577 1.561 . . . . 0.0 115.387 -175.109 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.431 ' HB3' ' HD2' ' A' ' 73' ' ' PRO . 19.0 mt -100.57 161.21 24.68 Favored Pre-proline 0 CA--C 1.555 1.144 0 C-N-CA 126.062 1.745 . . . . 0.0 111.0 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.431 ' HD2' ' HB3' ' A' ' 72' ' ' LEU . 71.8 Cg_endo -75.24 157.24 41.87 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 124.197 3.265 . . . . 0.0 113.63 -165.74 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 52.0 t -92.5 -36.27 7.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 O-C-N 121.434 -0.791 . . . . 0.0 112.719 175.382 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 16.4 p -122.41 172.36 8.39 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 124.999 1.319 . . . . 0.0 114.496 -178.879 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 34.6 ptt-85 -63.48 -34.4 77.69 Favored 'General case' 0 N--CA 1.483 1.193 0 O-C-N 121.298 -0.876 . . . . 0.0 112.26 172.866 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 17.7 t -66.4 -44.96 81.57 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.16 0.584 . . . . 0.0 110.605 171.924 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -60.4 -43.16 96.94 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.619 -0.676 . . . . 0.0 111.397 175.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.47 -43.97 97.53 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.775 0.83 . . . . 0.0 112.78 176.627 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 60.3 ttp180 -65.34 -41.75 93.6 Favored 'General case' 0 N--CA 1.477 0.917 0 O-C-N 121.341 -0.849 . . . . 0.0 112.233 177.115 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 71.0 t -63.73 -45.0 98.52 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 C-N-CA 123.65 0.78 . . . . 0.0 111.073 175.42 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 21.4 mt -58.61 -48.96 79.22 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 118.56 -0.733 . . . . 0.0 112.335 174.148 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 57.2 mt -54.2 -51.12 50.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-N 118.598 0.636 . . . . 0.0 109.915 176.232 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.406 ' HB2' ' HE1' ' A' ' 101' ' ' MET . 12.7 t80 -64.17 -50.65 67.33 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.856 0.687 . . . . 0.0 112.856 -177.695 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -66.46 -45.79 78.58 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 119.193 0.906 . . . . 0.0 112.395 -177.666 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -62.2 -45.83 91.6 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 119.135 -0.459 . . . . 0.0 110.505 178.247 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 68.6 t90 -60.09 -46.58 89.12 Favored 'General case' 0 C--O 1.217 -0.617 0 CA-C-O 117.506 -1.235 . . . . 0.0 111.953 172.542 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -57.35 -45.15 84.64 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 121.149 1.795 . . . . 0.0 113.042 179.794 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -69.53 -50.02 48.94 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 119.559 1.072 . . . . 0.0 112.187 178.213 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -56.64 -49.74 74.11 Favored 'General case' 0 C--O 1.216 -0.672 0 O-C-N 121.789 -0.569 . . . . 0.0 110.602 176.622 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.9 tmtt? -66.44 -30.92 71.38 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.664 1.586 . . . . 0.0 113.634 179.271 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 2.4 tmpt? -58.73 -37.92 77.22 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 120.015 1.279 . . . . 0.0 110.756 165.615 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 51.5 m -83.03 -16.94 45.07 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 115.575 1.694 . . . . 0.0 115.575 169.459 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -142.91 72.11 18.99 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 127.328 2.251 . . . . 0.0 111.194 -166.724 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -61.56 -6.26 6.87 Favored 'Trans proline' 0 CA--C 1.548 1.185 0 C-N-CA 123.921 3.081 . . . . 0.0 116.545 -165.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 38.9 p90 -86.13 -9.78 56.02 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 126.76 2.024 . . . . 0.0 115.032 174.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.6 tp -65.76 138.06 57.68 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 114.762 1.393 . . . . 0.0 114.762 -165.463 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 82.0 mtp180 -84.26 155.23 22.55 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 125.737 1.615 . . . . 0.0 112.997 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -138.52 129.87 27.34 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 126.608 1.963 . . . . 0.0 109.947 -173.69 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 50.8 t0 -147.4 131.54 17.35 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.084 0.954 . . . . 0.0 111.439 -179.382 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.406 ' HE1' ' HB2' ' A' ' 84' ' ' PHE . 65.6 mtt -132.3 6.03 4.14 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 114.526 1.306 . . . . 0.0 114.526 -171.199 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 66.6 m -63.44 155.87 27.83 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 121.313 -0.867 . . . . 0.0 111.591 174.576 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 24.1 p-10 -48.62 -43.41 36.28 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.288 1.218 . . . . 0.0 114.288 -176.601 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 62.1 mtpt -55.5 -38.02 68.64 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.858 1.263 . . . . 0.0 113.52 173.963 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.87 -40.73 96.39 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 119.26 0.936 . . . . 0.0 111.931 176.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -73.75 -45.96 48.64 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 C-N-CA 124.617 1.167 . . . . 0.0 109.73 -179.105 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 14.9 m-30 -56.93 -45.13 82.96 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 118.806 0.73 . . . . 0.0 112.61 175.094 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -74.51 -36.4 63.2 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.44 1.096 . . . . 0.0 111.99 -174.641 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 72.1 mtt85 -70.16 -40.28 74.83 Favored 'General case' 0 N--CA 1.484 1.229 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 169.909 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 35.3 m-85 -132.22 88.41 40.4 Favored Pre-proline 0 CA--C 1.546 0.792 0 C-N-CA 125.398 1.479 . . . . 0.0 110.87 -167.503 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -68.05 -19.96 44.88 Favored 'Trans proline' 0 CA--C 1.538 0.711 0 C-N-CA 122.795 2.33 . . . . 0.0 114.013 -170.508 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 8.4 p-80 -71.94 -23.63 61.49 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 123.619 0.767 . . . . 0.0 112.919 173.01 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -85.31 1.93 46.27 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 126.56 1.944 . . . . 0.0 113.593 -179.873 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? . . . . . 0 C--O 1.253 1.256 0 C-N-CA 125.715 1.606 . . . . 0.0 110.84 172.404 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 69.9 m . . . . . 0 N--CA 1.477 0.891 0 N-CA-C 111.748 0.277 . . . . 0.0 111.748 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.6 p -152.2 146.3 15.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 C-N-CA 124.751 1.221 . . . . 0.0 111.803 179.773 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.1 p -148.01 149.92 33.03 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.74 1.616 . . . . 0.0 111.292 171.728 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -154.63 164.33 38.9 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.41 1.084 . . . . 0.0 112.756 -175.497 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 101.74 132.82 7.86 Favored Glycine 0 CA--C 1.535 1.317 0 C-N-CA 125.673 1.606 . . . . 0.0 113.908 173.347 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -155.24 154.65 28.94 Favored Pre-proline 0 CA--C 1.552 1.034 0 C-N-CA 126.321 1.849 . . . . 0.0 111.137 178.363 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo -69.9 153.1 68.67 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 123.142 2.562 . . . . 0.0 112.343 174.171 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 67.8 m -134.53 66.17 69.23 Favored Pre-proline 0 N--CA 1.477 0.894 0 C-N-CA 124.709 1.204 . . . . 0.0 112.445 -175.826 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -66.97 135.68 38.57 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 123.102 2.535 . . . . 0.0 111.567 175.301 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 90.0 mt -142.85 152.47 42.2 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.474 1.509 . . . . 0.0 112.158 -176.249 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 54.7 p -80.41 161.2 25.07 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.204 1.402 . . . . 0.0 112.353 169.107 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 88.6 p -145.96 -4.73 0.63 Allowed 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.565 1.32 . . . . 0.0 114.565 -178.821 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -121.6 -3.14 9.32 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 126.322 1.849 . . . . 0.0 114.765 -171.507 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 42.3 m -73.17 141.32 47.4 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.059 0.944 . . . . 0.0 113.481 -173.906 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 60.42 10.04 2.28 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 116.859 2.17 . . . . 0.0 116.859 171.453 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -69.46 -20.58 63.75 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 114.789 1.403 . . . . 0.0 114.789 -174.678 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 . . . . . 0 CA--C 1.549 0.905 0 C-N-CA 124.991 1.317 . . . . 0.0 114.532 -179.732 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.569 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -82.78 146.35 29.02 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.218 1.007 . . . . 0.0 110.898 167.88 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 61.5 mt -128.9 157.78 40.63 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.57 1.148 . . . . 0.0 112.712 -169.53 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 -80.8 141.62 34.53 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.074 0.95 . . . . 0.0 110.206 166.765 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -100.16 -13.1 19.08 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 114.811 1.411 . . . . 0.0 114.811 -171.901 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -149.56 167.74 25.46 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.586 1.154 . . . . 0.0 113.221 -172.464 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.69 -162.03 53.72 Favored Glycine 0 CA--C 1.541 1.704 0 C-N-CA 124.17 0.891 . . . . 0.0 113.916 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -67.52 -16.44 47.25 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 123.194 2.596 . . . . 0.0 113.649 -177.838 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 97.2 mt -92.68 4.22 54.12 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.756 1.222 . . . . 0.0 113.915 175.985 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.1 122.21 11.17 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 120.941 1.7 . . . . 0.0 112.139 -177.683 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 82.64 4.62 90.02 Favored Glycine 0 CA--C 1.539 1.593 0 C-N-CA 125.457 1.503 . . . . 0.0 115.372 -174.929 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.421 ' HB3' ' HD2' ' A' ' 73' ' ' PRO . 16.5 mt -102.1 159.86 28.12 Favored Pre-proline 0 CA--C 1.555 1.14 0 C-N-CA 126.15 1.78 . . . . 0.0 111.271 -179.172 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.421 ' HD2' ' HB3' ' A' ' 72' ' ' LEU . 74.4 Cg_endo -75.78 160.45 37.56 Favored 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 124.317 3.344 . . . . 0.0 113.884 -165.296 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 29.6 t -103.24 -32.01 2.99 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 178.282 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 18.1 p -124.51 170.42 10.91 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 125.181 1.393 . . . . 0.0 113.898 177.91 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 39.3 ttm180 -66.03 -34.58 78.42 Favored 'General case' 0 N--CA 1.48 1.046 0 O-C-N 121.019 -1.05 . . . . 0.0 111.113 178.359 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 34.2 m -61.51 -46.54 89.54 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.028 0.931 . . . . 0.0 111.255 168.332 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -60.22 -44.51 95.13 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 119.14 0.882 . . . . 0.0 111.426 176.733 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.39 -41.1 96.84 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.439 0.696 . . . . 0.0 112.538 178.749 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 20.7 ttp180 -67.88 -40.51 83.53 Favored 'General case' 0 N--CA 1.479 1.005 0 O-C-N 121.114 -0.991 . . . . 0.0 112.344 176.357 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 72.2 t -62.74 -45.18 99.47 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 C-N-CA 123.486 0.715 . . . . 0.0 110.799 175.033 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 23.7 mt -58.27 -49.05 78.5 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 118.389 -0.815 . . . . 0.0 112.193 173.617 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 51.9 mt -52.76 -52.12 30.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 CA-C-N 118.796 0.726 . . . . 0.0 110.043 176.012 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -65.95 -50.83 63.0 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 -176.764 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -68.57 -43.03 77.44 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 118.933 0.788 . . . . 0.0 112.511 -175.259 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -64.85 -45.88 84.23 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 118.639 -0.696 . . . . 0.0 110.48 175.425 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.413 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 68.1 t90 -58.98 -47.35 85.47 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-O 117.08 -1.438 . . . . 0.0 111.579 173.21 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -55.15 -49.32 72.11 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 121.329 1.877 . . . . 0.0 112.771 178.88 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -64.47 -51.73 61.57 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 121.124 -0.985 . . . . 0.0 112.427 179.015 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 10.3 mmm180 -58.22 -47.47 83.4 Favored 'General case' 0 C--O 1.213 -0.829 0 C-N-CA 123.114 0.566 . . . . 0.0 110.51 177.783 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 18.8 tptp -60.17 -37.33 79.85 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 125.936 1.695 . . . . 0.0 113.143 177.414 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 61.1 mtpt -62.89 -31.16 72.16 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 119.194 0.906 . . . . 0.0 111.866 170.099 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 68.7 m -83.15 -20.06 35.45 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 115.922 1.823 . . . . 0.0 115.922 165.449 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -145.16 77.81 12.72 Favored Pre-proline 0 N--CA 1.479 0.988 0 C-N-CA 127.06 2.144 . . . . 0.0 111.254 -162.931 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -56.77 -24.25 54.48 Favored 'Trans proline' 0 CA--C 1.546 1.077 0 C-N-CA 122.624 2.216 . . . . 0.0 114.756 -170.481 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 44.8 p90 -71.85 -6.55 42.54 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 116.043 1.868 . . . . 0.0 116.043 177.532 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 14.0 tp -70.58 131.83 44.57 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 120.981 1.719 . . . . 0.0 114.101 -170.444 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 41.4 ptt180 -87.79 160.07 18.18 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 124.904 1.282 . . . . 0.0 113.735 176.584 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.413 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.4 tm? -139.17 129.83 25.99 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.741 2.016 . . . . 0.0 109.995 -169.971 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -147.87 135.04 20.43 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.287 1.035 . . . . 0.0 111.332 178.147 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 63.8 mtt -129.82 1.48 4.87 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 114.731 1.382 . . . . 0.0 114.731 -169.456 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 66.2 m -62.36 151.1 37.74 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 119.057 0.844 . . . . 0.0 111.613 175.812 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 43.2 p-10 -50.74 -37.81 44.0 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 114.65 1.352 . . . . 0.0 114.65 -174.823 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt -52.97 -40.05 63.42 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.408 1.483 . . . . 0.0 113.167 173.317 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.5 -39.01 89.41 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 123.625 0.77 . . . . 0.0 112.042 176.226 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.6 mp -73.83 -45.19 50.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 C-N-CA 123.391 0.677 . . . . 0.0 109.3 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 9.9 m-30 -55.94 -44.51 78.45 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 118.779 0.718 . . . . 0.0 112.214 175.199 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.0 -39.72 55.19 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.975 1.31 . . . . 0.0 112.49 -174.497 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 94.5 mtt-85 -74.89 -36.52 62.24 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.888 0.875 . . . . 0.0 112.704 175.268 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 48.3 m-85 -131.68 75.92 75.56 Favored Pre-proline 0 CA--C 1.546 0.816 0 C-N-CA 125.958 1.703 . . . . 0.0 110.834 -170.033 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -66.12 -14.92 46.55 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.083 2.522 . . . . 0.0 114.031 -175.303 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 13.2 p-80 -73.52 -24.39 60.14 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.198 0.999 . . . . 0.0 113.279 171.875 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.71 -53.71 5.99 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.861 1.265 . . . . 0.0 112.061 -162.591 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 65.7 ttt-85 . . . . . 0 C--O 1.253 1.28 0 C-N-CA 126.635 1.974 . . . . 0.0 112.737 -176.181 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 21.5 t . . . . . 0 N--CA 1.473 0.723 0 CA-C-O 120.363 0.125 . . . . 0.0 111.256 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 48.3 t -138.98 130.23 34.85 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 C-N-CA 125.469 1.507 . . . . 0.0 109.777 177.112 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 68.4 m -140.26 135.87 32.73 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.024 1.329 . . . . 0.0 111.427 178.253 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -154.04 155.32 35.28 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.135 1.374 . . . . 0.0 111.69 176.281 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -172.41 130.1 1.85 Allowed Glycine 0 CA--C 1.533 1.216 0 C-N-CA 124.345 0.974 . . . . 0.0 112.421 171.067 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -146.65 61.32 6.7 Favored Pre-proline 0 CA--C 1.553 1.092 0 C-N-CA 124.91 1.284 . . . . 0.0 111.757 178.701 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -67.75 150.18 78.94 Favored 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 123.371 2.714 . . . . 0.0 112.834 -177.826 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 75.1 p -153.23 153.78 29.91 Favored Pre-proline 0 N--CA 1.474 0.757 0 C-N-CA 125.324 1.449 . . . . 0.0 112.131 178.927 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.11 152.08 67.35 Favored 'Trans proline' 0 CA--C 1.54 0.82 0 C-N-CA 123.106 2.537 . . . . 0.0 112.178 175.047 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 60.5 tp -146.82 134.78 21.41 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.747 1.219 . . . . 0.0 111.529 -179.297 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.8 t -151.47 146.2 25.75 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.981 1.312 . . . . 0.0 110.996 169.175 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 78.9 p -141.92 9.13 1.92 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.144 1.378 . . . . 0.0 113.987 -176.854 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -112.43 120.46 41.73 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.799 1.24 . . . . 0.0 112.34 -172.695 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 40.4 m -124.23 3.85 8.52 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.942 1.297 . . . . 0.0 113.755 176.741 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 58.09 17.03 4.19 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 126.452 1.901 . . . . 0.0 115.539 -178.855 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -76.12 -24.14 54.93 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 114.036 1.125 . . . . 0.0 114.036 -174.864 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 . . . . . 0 N--CA 1.476 0.869 0 C-N-CA 125.702 1.601 . . . . 0.0 114.472 -179.218 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.51 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -88.48 154.89 19.99 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.757 1.223 . . . . 0.0 111.114 164.282 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 91.6 mt -132.59 157.55 44.45 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.952 1.301 . . . . 0.0 112.112 -175.786 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -81.24 138.61 35.76 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.468 0.707 . . . . 0.0 109.974 163.218 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -97.26 -20.57 17.8 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 -174.986 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -140.66 165.47 27.4 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.211 1.405 . . . . 0.0 112.428 -171.405 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.17 -163.27 54.89 Favored Glycine 0 CA--C 1.54 1.648 0 C-N-CA 124.246 0.927 . . . . 0.0 114.13 178.115 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -67.74 -17.14 47.42 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 123.267 2.645 . . . . 0.0 113.833 -175.624 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.2 mt -94.08 5.95 50.09 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 124.612 1.165 . . . . 0.0 113.935 175.462 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.42 122.37 11.05 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 120.875 1.67 . . . . 0.0 112.123 -177.938 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.25 5.66 88.68 Favored Glycine 0 CA--C 1.541 1.718 0 C-N-CA 125.568 1.556 . . . . 0.0 115.469 -175.104 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.461 ' HB3' ' HD2' ' A' ' 73' ' ' PRO . 20.3 mt -104.02 160.71 25.2 Favored Pre-proline 0 CA--C 1.557 1.228 0 C-N-CA 126.348 1.859 . . . . 0.0 111.295 -179.481 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.461 ' HD2' ' HB3' ' A' ' 72' ' ' LEU . 60.8 Cg_endo -71.36 164.95 34.01 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 124.318 3.346 . . . . 0.0 113.408 -169.165 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.9 t -107.53 -29.58 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 O-C-N 121.324 -0.86 . . . . 0.0 112.468 175.867 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 22.1 p -125.73 172.12 10.07 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 125.31 1.444 . . . . 0.0 114.056 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 34.6 ptt-85 -63.42 -35.6 80.97 Favored 'General case' 0 N--CA 1.48 1.071 0 O-C-N 121.284 -0.885 . . . . 0.0 111.92 173.903 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 37.2 m -65.39 -44.08 88.62 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.971 0.909 . . . . 0.0 110.95 172.491 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 76.3 m-20 -60.52 -46.42 90.19 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 118.522 0.601 . . . . 0.0 111.066 175.043 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.94 -42.3 98.95 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.61 0.764 . . . . 0.0 112.611 179.512 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 62.8 ttp85 -64.55 -42.84 95.43 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 118.962 0.801 . . . . 0.0 112.234 175.504 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 54.5 t -62.39 -47.87 91.01 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 123.752 0.821 . . . . 0.0 111.078 176.128 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.2 mp -58.95 -48.63 80.82 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 118.519 -0.753 . . . . 0.0 112.791 175.393 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 55.2 mt -55.49 -51.03 61.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 CA-C-N 118.775 0.716 . . . . 0.0 110.173 176.356 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -65.62 -49.19 69.62 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -177.399 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -66.72 -46.61 74.97 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 118.986 0.812 . . . . 0.0 112.299 -177.446 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -60.31 -49.71 76.51 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 118.458 -0.782 . . . . 0.0 110.25 175.044 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.424 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 64.3 t90 -56.44 -47.12 79.78 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-O 117.719 -1.134 . . . . 0.0 112.116 176.385 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -57.15 -48.26 79.13 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 120.792 1.633 . . . . 0.0 113.078 178.346 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -68.92 -48.52 63.08 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 119.902 1.228 . . . . 0.0 112.399 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 34.2 mmt180 -60.54 -39.62 88.57 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.673 0.789 . . . . 0.0 110.175 178.429 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -72.64 -30.13 64.04 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 125.057 1.343 . . . . 0.0 113.581 176.302 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.7 mmtp -62.29 -31.46 72.06 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 120.135 1.334 . . . . 0.0 111.412 165.412 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 60.2 m -80.0 -25.76 40.16 Favored 'General case' 0 N--CA 1.483 1.193 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 165.587 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -139.85 78.58 24.87 Favored Pre-proline 0 N--CA 1.478 0.961 0 C-N-CA 126.775 2.03 . . . . 0.0 111.667 -168.41 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -59.93 -11.78 16.43 Favored 'Trans proline' 0 CA--C 1.546 1.121 0 C-N-CA 123.539 2.826 . . . . 0.0 116.495 -166.718 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 40.6 p90 -85.08 -7.11 59.24 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 126.778 2.031 . . . . 0.0 115.21 176.716 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.4 tp -62.32 137.73 58.31 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 114.515 1.302 . . . . 0.0 114.515 -167.56 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 30.1 mmm180 -83.83 154.74 23.33 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 125.258 1.423 . . . . 0.0 113.113 179.107 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.424 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -137.62 130.35 29.98 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.826 2.05 . . . . 0.0 109.671 -175.85 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 59.2 t0 -143.74 129.61 19.43 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.011 0.924 . . . . 0.0 111.004 176.762 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 66.1 mtt -124.98 13.54 8.45 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.476 1.511 . . . . 0.0 112.952 -179.814 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 38.8 t -59.9 148.45 34.91 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.568 -0.707 . . . . 0.0 110.906 170.196 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -54.66 -35.25 63.33 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.21 -0.931 . . . . 0.0 112.437 -178.205 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -60.3 -36.19 77.33 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.369 1.067 . . . . 0.0 113.039 175.024 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.49 -41.06 98.55 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 118.95 0.795 . . . . 0.0 111.429 174.771 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.79 -46.91 59.16 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 C-N-CA 123.791 0.837 . . . . 0.0 109.758 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 16.9 m-30 -55.08 -46.42 75.44 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 118.89 0.768 . . . . 0.0 112.575 175.206 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.7 tmt_? -76.71 -38.47 54.27 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.508 1.123 . . . . 0.0 112.332 -172.88 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 19.9 ttm180 -75.9 -37.13 59.12 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.804 0.842 . . . . 0.0 112.646 175.328 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 34.9 m-85 -128.1 82.81 67.73 Favored Pre-proline 0 CA--C 1.547 0.864 0 C-N-CA 126.13 1.772 . . . . 0.0 110.648 -173.279 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -66.01 -19.68 57.63 Favored 'Trans proline' 0 CA--C 1.539 0.738 0 C-N-CA 122.971 2.447 . . . . 0.0 114.174 -172.051 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 8.1 p-80 -72.09 -20.6 61.62 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.917 0.887 . . . . 0.0 113.294 172.81 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -91.88 -0.91 57.52 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 127.015 2.126 . . . . 0.0 113.578 -178.531 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.231 0 C-N-CA 124.769 1.228 . . . . 0.0 111.211 170.908 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 64.1 m . . . . . 0 N--CA 1.477 0.882 0 CA-C-O 120.722 0.296 . . . . 0.0 111.784 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 27.0 m -126.7 155.38 37.28 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 125.221 1.408 . . . . 0.0 112.547 -178.925 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 79.8 p -145.02 155.7 43.51 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.689 1.595 . . . . 0.0 111.988 177.91 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 51.1 p90 -153.54 165.58 35.42 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.057 1.343 . . . . 0.0 112.535 -175.768 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 81.94 162.53 30.41 Favored Glycine 0 CA--C 1.538 1.507 0 C-N-CA 124.992 1.282 . . . . 0.0 114.742 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -152.34 154.15 31.71 Favored Pre-proline 0 CA--C 1.55 0.97 0 C-N-CA 125.852 1.661 . . . . 0.0 111.723 -179.553 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -69.44 160.35 50.13 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 123.353 2.702 . . . . 0.0 112.447 174.637 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 37.2 p -132.62 56.43 22.62 Favored Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 125.158 1.383 . . . . 0.0 113.98 -173.756 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -68.03 156.09 67.14 Favored 'Trans proline' 0 CA--C 1.542 0.925 0 C-N-CA 123.368 2.712 . . . . 0.0 112.891 178.629 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.5 pp -146.12 157.53 43.85 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.548 1.539 . . . . 0.0 111.784 173.917 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 83.5 p -140.0 -11.3 1.13 Allowed 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 115.876 1.806 . . . . 0.0 115.876 -173.112 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.2 t -152.92 154.1 34.36 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.409 1.084 . . . . 0.0 112.616 -178.187 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -129.95 9.42 5.34 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 127.233 2.213 . . . . 0.0 113.257 179.443 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 6.9 t -142.77 -178.53 5.84 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.272 1.429 . . . . 0.0 113.067 -172.136 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 56.23 50.02 14.22 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 126.315 1.846 . . . . 0.0 113.3 -179.349 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 25.8 m-20 -76.69 56.34 1.14 Allowed 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.536 1.535 . . . . 0.0 111.702 174.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 . . . . . 0 N--CA 1.478 0.925 0 C-N-CA 126.57 1.948 . . . . 0.0 114.16 -176.24 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.6 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -85.32 159.13 20.1 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.774 1.23 . . . . 0.0 111.294 167.758 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 95.1 mt -133.94 157.02 47.07 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.871 1.269 . . . . 0.0 112.529 -174.501 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 -82.09 140.31 33.92 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 123.908 0.883 . . . . 0.0 109.944 163.205 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -98.19 -20.3 17.36 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 -174.423 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -140.45 165.13 28.28 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.124 1.369 . . . . 0.0 112.492 -171.273 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 72.92 -162.93 54.9 Favored Glycine 0 CA--C 1.541 1.674 0 C-N-CA 124.2 0.905 . . . . 0.0 114.074 178.4 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -67.54 -17.0 48.36 Favored 'Trans proline' 0 CA--C 1.541 0.865 0 C-N-CA 123.325 2.683 . . . . 0.0 113.763 -176.243 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.0 mt -93.85 5.66 50.93 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.701 1.2 . . . . 0.0 113.915 175.406 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.86 121.53 9.46 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 120.823 1.647 . . . . 0.0 111.909 -178.58 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.37 8.09 85.61 Favored Glycine 0 CA--C 1.54 1.631 0 C-N-CA 125.358 1.456 . . . . 0.0 115.5 -174.793 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.43 ' HB3' ' HD2' ' A' ' 73' ' ' PRO . 18.3 mt -107.84 159.51 30.19 Favored Pre-proline 0 CA--C 1.558 1.258 0 C-N-CA 126.42 1.888 . . . . 0.0 111.469 -179.176 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.43 ' HD2' ' HB3' ' A' ' 72' ' ' LEU . 58.3 Cg_endo -71.75 166.27 30.0 Favored 'Trans proline' 0 C--N 1.354 0.853 0 C-N-CA 124.655 3.57 . . . . 0.0 113.968 -169.322 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 5.7 t -111.58 -26.35 3.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 123.856 0.862 . . . . 0.0 112.486 177.655 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 29.8 p -127.87 172.6 10.72 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 125.296 1.439 . . . . 0.0 114.236 179.478 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -68.51 -36.93 79.57 Favored 'General case' 0 N--CA 1.482 1.157 0 O-C-N 121.167 -0.958 . . . . 0.0 111.358 176.354 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 10.2 p -63.56 -42.6 98.34 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 118.492 -0.765 . . . . 0.0 111.761 169.428 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 84.5 m-20 -58.37 -50.98 71.73 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 119.582 1.083 . . . . 0.0 110.809 173.668 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.01 -41.19 97.8 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.565 0.746 . . . . 0.0 112.531 -178.229 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 33.6 ttt85 -65.58 -43.58 89.3 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.08 0.952 . . . . 0.0 112.063 177.513 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 70.4 t -64.47 -45.79 94.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 C-N-CA 123.756 0.822 . . . . 0.0 111.227 175.538 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 54.6 mt -61.28 -43.92 98.09 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 118.309 -0.853 . . . . 0.0 112.406 176.414 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 47.7 mt -55.5 -51.57 56.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 CA-C-N 119.143 0.883 . . . . 0.0 109.949 173.28 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -63.3 -46.97 84.25 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -178.106 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 55.4 m-20 -68.91 -45.9 69.67 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.84 0.856 . . . . 0.0 112.189 -177.131 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -63.62 -46.45 85.66 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 119.131 -0.461 . . . . 0.0 110.793 177.402 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.434 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 66.8 t90 -60.03 -46.04 90.83 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-O 117.657 -1.163 . . . . 0.0 111.658 172.945 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -56.19 -45.72 79.68 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 120.873 1.67 . . . . 0.0 112.877 179.182 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -67.75 -52.06 41.89 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 119.644 1.111 . . . . 0.0 112.401 177.103 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 13.1 mmm180 -56.84 -48.41 78.12 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 121.759 -0.588 . . . . 0.0 110.626 178.809 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.9 tmtt? -67.21 -30.14 69.99 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.593 1.557 . . . . 0.0 113.562 178.435 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -60.77 -36.52 79.15 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 120.293 1.406 . . . . 0.0 111.096 166.257 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 64.9 m -79.95 -20.69 45.03 Favored 'General case' 0 N--CA 1.482 1.166 0 N-CA-C 115.343 1.609 . . . . 0.0 115.343 167.603 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -141.5 73.34 24.82 Favored Pre-proline 0 CA--C 1.548 0.894 0 C-N-CA 127.084 2.153 . . . . 0.0 111.469 -166.078 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -61.31 -7.98 9.52 Favored 'Trans proline' 0 CA--C 1.546 1.084 0 C-N-CA 123.744 2.963 . . . . 0.0 116.325 -166.83 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 41.2 p90 -84.64 -10.17 57.58 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.586 1.954 . . . . 0.0 114.88 174.666 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 16.5 tp -65.48 135.47 55.21 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 119.862 1.21 . . . . 0.0 113.952 -167.842 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -83.57 156.08 22.95 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.761 1.225 . . . . 0.0 113.021 178.67 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.434 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -137.23 130.98 31.75 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 127.027 2.131 . . . . 0.0 109.228 -174.23 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -137.81 129.66 28.57 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.233 1.013 . . . . 0.0 110.829 178.062 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 63.8 mtt -126.72 16.21 7.5 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.469 1.508 . . . . 0.0 113.53 -178.077 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 47.6 t -63.3 148.97 46.81 Favored 'General case' 0 N--CA 1.47 0.575 0 O-C-N 121.573 -0.704 . . . . 0.0 110.615 165.569 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -56.51 -32.02 64.67 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 121.118 -0.989 . . . . 0.0 112.329 178.773 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 60.3 mtpt -59.78 -33.43 71.69 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.31 1.044 . . . . 0.0 112.997 174.326 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.27 -40.81 97.46 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 119.161 0.891 . . . . 0.0 111.486 173.945 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.87 -46.99 58.21 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 C-N-CA 123.814 0.846 . . . . 0.0 109.405 179.852 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.7 m-30 -56.24 -45.54 79.94 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 118.759 0.708 . . . . 0.0 112.568 176.479 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.09 -38.55 52.13 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 124.409 1.084 . . . . 0.0 112.121 -173.589 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 62.1 ttm-85 -75.61 -35.57 60.49 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.934 0.893 . . . . 0.0 112.494 175.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 46.7 m-85 -128.53 82.93 67.61 Favored Pre-proline 0 CA--C 1.546 0.795 0 C-N-CA 126.088 1.755 . . . . 0.0 110.724 -174.397 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -66.03 -18.54 57.06 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 123.088 2.526 . . . . 0.0 114.092 -172.51 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' HIS . . . . . 0.452 ' CE1' HD23 ' A' ' 113' ' ' LEU . 7.8 p-80 -73.83 -21.63 60.06 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.022 0.929 . . . . 0.0 113.333 173.009 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.452 HD23 ' CE1' ' A' ' 112' ' ' HIS . 0.1 OUTLIER -90.17 -8.36 51.38 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 126.113 1.765 . . . . 0.0 113.86 -173.163 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? . . . . . 0 C--O 1.254 1.311 0 C-N-CA 125.109 1.363 . . . . 0.0 110.977 175.418 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 12.3 t . . . . . 0 N--CA 1.474 0.752 0 CA-C-O 120.492 0.186 . . . . 0.0 111.458 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.1 p -149.11 146.67 17.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 125.308 1.443 . . . . 0.0 111.503 178.1 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.1 m -132.08 132.74 43.6 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.17 1.388 . . . . 0.0 111.013 177.76 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 54.6 p90 -154.93 162.86 40.96 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.084 1.354 . . . . 0.0 112.445 -177.141 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 173.6 147.66 6.06 Favored Glycine 0 CA--C 1.536 1.383 0 C-N-CA 124.693 1.14 . . . . 0.0 113.171 174.962 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -147.29 60.58 5.71 Favored Pre-proline 0 CA--C 1.554 1.122 0 C-N-CA 124.712 1.205 . . . . 0.0 112.534 -179.459 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -67.82 152.22 77.66 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 123.356 2.704 . . . . 0.0 112.586 179.399 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 9.3 t -147.3 73.52 11.88 Favored Pre-proline 0 N--CA 1.475 0.802 0 C-N-CA 124.548 1.139 . . . . 0.0 111.379 177.743 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -73.17 155.3 52.06 Favored 'Trans proline' 0 CA--C 1.542 0.896 0 C-N-CA 123.621 2.881 . . . . 0.0 112.824 -179.422 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -150.27 154.73 38.4 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.496 1.518 . . . . 0.0 112.307 174.939 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 32.9 m -127.24 -4.3 6.17 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 115.088 1.514 . . . . 0.0 115.088 -173.158 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 49.5 m -142.24 150.94 41.58 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.859 1.264 . . . . 0.0 112.606 -172.428 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -151.41 137.8 18.55 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.11 1.364 . . . . 0.0 111.467 177.333 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 75.6 p -111.25 -7.17 14.45 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 125.415 1.486 . . . . 0.0 114.801 -178.224 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -67.71 -12.3 60.21 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 -173.444 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -68.68 -21.81 64.41 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.683 1.193 . . . . 0.0 113.543 172.722 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 . . . . . 0 N--CA 1.476 0.853 0 C-N-CA 125.511 1.524 . . . . 0.0 113.605 177.253 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.546 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -85.04 156.89 20.91 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.539 1.136 . . . . 0.0 111.443 168.687 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 98.2 mt -131.97 156.27 46.49 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.028 1.331 . . . . 0.0 112.381 -175.259 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 84.9 m-70 -83.04 142.82 31.04 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.057 0.943 . . . . 0.0 109.755 163.41 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -103.14 -18.17 15.05 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 114.695 1.368 . . . . 0.0 114.695 -172.397 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -139.8 163.05 33.65 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.114 1.365 . . . . 0.0 112.459 -172.369 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.05 -160.91 54.12 Favored Glycine 0 CA--C 1.539 1.572 0 C-N-CA 124.137 0.875 . . . . 0.0 114.001 178.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -67.63 -16.4 46.7 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 123.339 2.693 . . . . 0.0 113.763 -176.536 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 98.6 mt -92.95 4.87 53.2 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.647 1.179 . . . . 0.0 113.807 174.829 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.84 114.0 2.33 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 121.233 1.833 . . . . 0.0 111.91 -179.081 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.68 5.86 68.41 Favored Glycine 0 CA--C 1.543 1.785 0 C-N-CA 125.322 1.439 . . . . 0.0 115.57 -173.771 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 6.0 mp -104.97 156.24 36.35 Favored Pre-proline 0 CA--C 1.556 1.191 0 C-N-CA 126.807 2.043 . . . . 0.0 111.63 178.595 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -67.87 163.29 36.09 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 124.912 3.741 . . . . 0.0 113.987 -170.982 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.8 t -105.42 -30.18 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 O-C-N 121.373 -0.829 . . . . 0.0 112.319 175.988 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 17.8 p -125.87 170.05 12.03 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 125.235 1.414 . . . . 0.0 114.266 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 37.5 ttt180 -62.07 -39.13 91.36 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.593 1.157 . . . . 0.0 111.084 174.451 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 18.5 t -62.62 -46.71 87.01 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.843 0.857 . . . . 0.0 111.101 171.474 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 78.5 m-20 -57.99 -48.94 78.51 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 118.852 0.751 . . . . 0.0 111.069 176.284 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.58 -42.87 97.56 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -179.573 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 70.2 ttp85 -67.07 -41.99 85.46 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 121.199 -0.938 . . . . 0.0 112.597 176.909 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 78.5 t -63.84 -43.4 97.84 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.034 0 C-N-CA 123.603 0.761 . . . . 0.0 111.14 175.962 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 55.1 mt -60.49 -47.19 87.21 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 118.169 -0.92 . . . . 0.0 112.102 175.062 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 60.6 mt -53.4 -50.28 49.2 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 CA-C-N 119.064 0.847 . . . . 0.0 110.111 173.619 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.414 ' HB2' ' HE1' ' A' ' 101' ' ' MET . 12.3 t80 -62.89 -51.16 68.06 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 112.916 0.709 . . . . 0.0 112.916 -178.135 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -70.87 -41.44 71.37 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -174.887 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 57.4 mm-40 -58.7 -53.52 57.41 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 118.574 -0.727 . . . . 0.0 110.057 169.906 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.42 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 61.4 t90 -55.9 -44.58 78.35 Favored 'General case' 0 C--O 1.218 -0.577 0 CA-C-O 117.444 -1.265 . . . . 0.0 112.081 178.124 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -56.33 -51.05 69.66 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 120.755 1.616 . . . . 0.0 112.856 176.919 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -68.13 -45.29 74.02 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 119.879 1.218 . . . . 0.0 112.618 179.469 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 31.4 mmt180 -59.79 -44.48 93.92 Favored 'General case' 0 C--O 1.218 -0.583 0 C-N-CA 123.773 0.829 . . . . 0.0 109.952 177.832 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -63.69 -36.55 84.21 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 126.055 1.742 . . . . 0.0 112.819 175.329 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -62.3 -30.82 71.41 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 119.381 0.992 . . . . 0.0 111.845 170.012 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 68.4 m -82.91 -20.97 34.38 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 115.44 1.644 . . . . 0.0 115.44 166.077 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -140.53 79.0 20.86 Favored Pre-proline 0 CA--C 1.547 0.86 0 C-N-CA 127.077 2.151 . . . . 0.0 111.419 -167.346 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -63.81 6.03 0.31 Allowed 'Trans proline' 0 CA--C 1.55 1.311 0 C-N-CA 124.252 3.301 . . . . 0.0 116.878 -169.184 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 40.5 p90 -103.55 -6.76 21.4 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 127.402 2.281 . . . . 0.0 114.668 175.425 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 13.7 tp -64.82 135.5 55.85 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 -165.381 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 85.0 mtp180 -86.21 156.57 20.25 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.593 1.557 . . . . 0.0 113.063 178.597 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.42 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -138.38 131.49 30.02 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.726 2.01 . . . . 0.0 110.043 -173.846 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 33.3 t0 -146.6 135.96 22.83 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.066 0.946 . . . . 0.0 111.432 177.045 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.414 ' HE1' ' HB2' ' A' ' 84' ' ' PHE . 66.3 mtt -133.3 3.41 3.64 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 114.467 1.284 . . . . 0.0 114.467 -173.503 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 72.5 m -60.6 145.05 50.33 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 119.166 0.894 . . . . 0.0 110.96 173.082 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.416 ' HA ' HG12 ' A' ' 106' ' ' ILE . 17.2 m-20 -61.82 -25.39 67.47 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 114.813 1.412 . . . . 0.0 114.813 -163.137 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -56.11 -38.38 70.69 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.091 0.956 . . . . 0.0 112.719 171.734 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.77 -35.75 75.28 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 123.8 0.84 . . . . 0.0 112.05 172.743 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.416 HG12 ' HA ' ' A' ' 103' ' ' ASP . 4.8 mm -78.35 -43.61 26.88 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 C-N-CA 123.85 0.86 . . . . 0.0 109.544 -175.052 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -59.5 -43.53 93.33 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.255 0.622 . . . . 0.0 111.932 173.463 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.72 -39.27 57.63 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.52 1.128 . . . . 0.0 112.774 -174.52 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 88.2 mtt-85 -69.63 -40.3 76.62 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.749 0.82 . . . . 0.0 112.478 172.029 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -127.67 77.89 75.57 Favored Pre-proline 0 CA--C 1.544 0.748 0 C-N-CA 125.094 1.358 . . . . 0.0 111.142 -168.208 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -68.02 -10.1 27.82 Favored 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 123.389 2.726 . . . . 0.0 114.097 -175.736 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 14.2 p-80 -78.9 -21.9 46.7 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.144 0.977 . . . . 0.0 113.469 169.89 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -89.7 -32.52 16.99 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.774 1.63 . . . . 0.0 112.462 -168.844 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 . . . . . 0 C--O 1.254 1.335 0 C-N-CA 124.723 1.209 . . . . 0.0 113.715 174.811 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.7 t . . . . . 0 N--CA 1.474 0.726 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.9 m -131.47 11.47 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 C-N-CA 125.809 1.644 . . . . 0.0 112.99 178.252 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 40.0 m -82.37 54.24 2.52 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 125.678 1.591 . . . . 0.0 113.276 -169.544 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 82.4 m-85 -133.72 166.13 23.33 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.907 1.683 . . . . 0.0 112.99 -172.114 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 104.87 107.38 3.21 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 125.732 1.635 . . . . 0.0 112.77 178.409 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -153.39 153.06 28.75 Favored Pre-proline 0 CA--C 1.552 1.037 0 C-N-CA 126.157 1.783 . . . . 0.0 111.049 177.033 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -71.17 140.94 38.48 Favored 'Trans proline' 0 CA--C 1.543 0.957 0 C-N-CA 123.148 2.565 . . . . 0.0 112.373 177.906 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 71.2 m -138.82 63.57 32.31 Favored Pre-proline 0 N--CA 1.477 0.888 0 C-N-CA 125.193 1.397 . . . . 0.0 111.847 -179.388 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -67.78 131.7 24.88 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 C-N-CA 123.337 2.691 . . . . 0.0 112.387 -177.071 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 62.3 tp -155.76 134.2 11.67 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.309 1.443 . . . . 0.0 111.051 178.265 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 31.6 t -154.83 131.35 10.54 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.648 1.179 . . . . 0.0 111.22 170.862 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.3 t -158.99 82.52 0.79 Allowed 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.849 1.259 . . . . 0.0 110.416 175.166 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -140.62 -11.81 1.02 Allowed 'General case' 0 N--CA 1.479 1.016 0 N-CA-C 115.797 1.777 . . . . 0.0 115.797 -174.556 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 21.3 t -65.39 111.98 3.31 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 119.516 1.053 . . . . 0.0 111.407 -171.645 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 53.63 20.46 2.17 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 125.867 1.667 . . . . 0.0 114.583 -173.535 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -75.3 -27.45 59.34 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 -169.91 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 . . . . . 0 CA--C 1.548 0.878 0 C-N-CA 125.893 1.677 . . . . 0.0 113.898 179.998 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.634 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -96.7 149.07 22.22 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.064 1.346 . . . . 0.0 112.401 174.857 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 89.5 mt -128.29 157.39 41.07 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.694 1.597 . . . . 0.0 111.741 -179.293 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -77.46 140.02 39.75 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.898 0.879 . . . . 0.0 110.479 167.195 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -99.1 -12.39 20.55 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 -174.636 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -149.49 168.16 24.24 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.786 1.235 . . . . 0.0 113.211 -172.911 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.78 -164.47 54.14 Favored Glycine 0 CA--C 1.54 1.615 0 C-N-CA 124.151 0.882 . . . . 0.0 114.094 179.74 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -67.72 -16.82 47.14 Favored 'Trans proline' 0 CA--C 1.542 0.925 0 C-N-CA 123.254 2.636 . . . . 0.0 113.674 -177.145 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.1 mt -92.49 4.42 53.55 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.784 1.234 . . . . 0.0 113.877 175.798 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.01 122.9 11.93 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 120.922 1.692 . . . . 0.0 112.088 -177.342 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.23 4.45 89.65 Favored Glycine 0 CA--C 1.54 1.612 0 C-N-CA 125.418 1.485 . . . . 0.0 115.384 -174.649 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 21.5 mt -103.85 160.05 27.33 Favored Pre-proline 0 CA--C 1.555 1.141 0 C-N-CA 126.204 1.802 . . . . 0.0 111.174 179.49 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -80.23 156.69 22.8 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 124.12 3.213 . . . . 0.0 113.664 -163.464 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 24.1 t -95.52 -36.32 6.59 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -177.157 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 22.2 p -123.52 174.24 7.52 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 124.965 1.306 . . . . 0.0 114.413 -178.584 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -64.12 -39.52 94.22 Favored 'General case' 0 N--CA 1.483 1.184 0 O-C-N 121.176 -0.953 . . . . 0.0 110.83 176.909 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 35.1 m -61.42 -45.1 95.74 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.196 0.998 . . . . 0.0 111.283 171.306 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -61.35 -46.92 88.22 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 118.842 0.746 . . . . 0.0 111.16 175.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.16 -38.69 89.99 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.467 -0.77 . . . . 0.0 112.313 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 69.4 ttt180 -67.3 -41.56 85.18 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 119.202 0.91 . . . . 0.0 112.622 173.988 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 59.7 t -61.12 -49.98 82.43 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 CA-C-N 118.713 0.688 . . . . 0.0 110.972 173.689 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -62.61 -40.75 97.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 118.319 -0.848 . . . . 0.0 112.464 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 48.8 mt -56.36 -50.72 70.6 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 CA-C-N 119.17 0.895 . . . . 0.0 110.31 170.7 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -64.29 -45.44 87.98 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -178.117 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 55.4 t30 -68.39 -46.58 69.63 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.918 0.887 . . . . 0.0 111.948 -177.508 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 55.6 mm-40 -60.19 -51.75 68.26 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 118.488 -0.767 . . . . 0.0 110.55 172.814 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.44 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 60.4 t90 -56.26 -47.17 79.06 Favored 'General case' 0 C--O 1.222 -0.358 0 CA-C-N 119.526 1.057 . . . . 0.0 111.929 177.673 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -58.39 -45.5 88.22 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 120.46 1.482 . . . . 0.0 113.027 178.811 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -69.46 -49.72 52.26 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-N 120.001 1.273 . . . . 0.0 112.747 178.126 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 32.6 mmt180 -59.0 -41.05 86.76 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.93 0.892 . . . . 0.0 109.839 178.066 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 21.5 ttpt -69.7 -31.86 70.13 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.088 1.355 . . . . 0.0 113.447 174.831 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -59.52 -33.22 71.1 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 120.022 1.283 . . . . 0.0 110.777 167.672 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 53.1 m -81.02 -24.32 37.99 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 115.453 1.649 . . . . 0.0 115.453 165.635 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -140.02 78.89 23.47 Favored Pre-proline 0 CA--C 1.552 1.024 0 C-N-CA 127.004 2.122 . . . . 0.0 112.251 -168.671 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -61.66 -5.81 6.34 Favored 'Trans proline' 0 CA--C 1.549 1.231 0 C-N-CA 123.859 3.039 . . . . 0.0 116.653 -168.658 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 41.4 p90 -90.89 -6.37 54.26 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.795 2.038 . . . . 0.0 114.887 175.54 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.3 tp -62.77 135.5 57.38 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 119.702 1.137 . . . . 0.0 113.776 -168.089 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 54.3 mmt-85 -86.06 157.36 20.08 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.61 1.164 . . . . 0.0 112.761 179.199 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.44 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -136.72 131.82 34.01 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 126.714 2.005 . . . . 0.0 110.04 -172.612 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 54.9 t0 -142.89 131.09 21.98 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.186 0.994 . . . . 0.0 111.12 176.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 64.7 mtt -127.71 6.75 6.18 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.359 1.464 . . . . 0.0 113.56 -177.277 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 71.3 m -63.21 147.48 50.81 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 118.884 0.766 . . . . 0.0 110.39 169.153 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -61.27 -28.33 69.11 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -163.9 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -57.11 -34.34 68.26 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.459 1.104 . . . . 0.0 113.41 172.829 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.7 -40.21 96.42 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 119.075 0.852 . . . . 0.0 111.704 173.8 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.63 -45.71 65.85 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 C-N-CA 124.406 1.083 . . . . 0.0 109.212 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 8.4 m-30 -56.92 -46.43 82.0 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 118.716 0.689 . . . . 0.0 112.279 175.237 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.72 -38.49 62.3 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.68 1.192 . . . . 0.0 112.57 -173.03 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 75.1 mtp85 -72.37 -38.85 68.42 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 172.176 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 27.3 m-85 -130.23 83.37 63.19 Favored Pre-proline 0 CA--C 1.548 0.866 0 C-N-CA 125.256 1.423 . . . . 0.0 110.902 -168.594 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -66.99 -16.79 50.5 Favored 'Trans proline' 0 CA--C 1.541 0.832 0 C-N-CA 123.04 2.493 . . . . 0.0 114.252 -171.478 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 12.4 p-80 -74.86 -23.45 58.42 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.153 0.981 . . . . 0.0 113.257 173.13 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -82.65 -24.36 33.81 Favored 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 125.719 1.608 . . . . 0.0 112.723 -171.708 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 8.3 tmm_? . . . . . 0 C--O 1.254 1.292 0 C-N-CA 125.162 1.385 . . . . 0.0 111.918 178.445 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 21.7 m . . . . . 0 N--CA 1.476 0.852 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.5 p -150.65 152.76 11.14 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 125.197 1.399 . . . . 0.0 111.359 -179.578 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 33.2 t -140.37 149.62 42.9 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.955 1.302 . . . . 0.0 112.039 176.537 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 22.4 t80 -134.98 28.94 3.47 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.887 1.675 . . . . 0.0 111.319 175.431 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 74.79 -156.98 50.04 Favored Glycine 0 CA--C 1.536 1.403 0 C-N-CA 124.282 0.944 . . . . 0.0 112.78 -168.793 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -130.77 63.15 69.02 Favored Pre-proline 0 CA--C 1.554 1.121 0 C-N-CA 124.837 1.255 . . . . 0.0 112.517 -178.539 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_endo -67.52 151.87 79.23 Favored 'Trans proline' 0 CA--C 1.542 0.919 0 C-N-CA 123.318 2.679 . . . . 0.0 112.523 177.81 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 78.6 p -152.11 155.97 33.66 Favored Pre-proline 0 N--CA 1.476 0.854 0 C-N-CA 125.358 1.463 . . . . 0.0 112.007 179.136 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -74.63 133.66 17.47 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 123.017 2.478 . . . . 0.0 112.009 177.295 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.3 mp -122.06 151.97 40.31 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.869 1.668 . . . . 0.0 111.018 175.298 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 78.1 p -147.62 149.02 31.74 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.24 1.416 . . . . 0.0 111.764 172.129 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.5 m -135.77 9.35 3.34 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 -170.039 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -146.78 140.18 25.64 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.788 1.235 . . . . 0.0 111.937 -175.495 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 15.4 t -154.09 152.31 30.3 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.339 1.456 . . . . 0.0 111.196 174.223 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 52.91 40.93 31.77 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 125.493 1.517 . . . . 0.0 113.953 177.658 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -74.23 82.69 1.84 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.505 1.122 . . . . 0.0 111.549 179.511 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 . . . . . 0 CA--C 1.551 1.013 0 C-N-CA 125.861 1.664 . . . . 0.0 113.701 -171.408 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.604 0 N-CA-C 112.425 0.528 . . . . 0.0 112.425 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -87.62 158.79 18.78 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.756 1.223 . . . . 0.0 111.562 167.862 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 95.8 mt -135.83 157.03 47.86 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 125.34 1.456 . . . . 0.0 111.812 -177.838 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -82.2 139.97 33.99 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.535 0.734 . . . . 0.0 109.463 162.487 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -101.28 -19.07 15.82 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -173.359 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -140.1 164.12 30.9 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 125.323 1.449 . . . . 0.0 112.145 -173.129 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 72.37 -161.37 54.33 Favored Glycine 0 CA--C 1.542 1.727 0 C-N-CA 124.105 0.86 . . . . 0.0 113.992 179.269 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -67.9 -16.8 46.23 Favored 'Trans proline' 0 CA--C 1.541 0.872 0 C-N-CA 123.325 2.684 . . . . 0.0 113.895 -174.949 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 89.5 mt -95.24 6.78 48.09 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.81 1.244 . . . . 0.0 113.829 175.482 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.2 113.52 1.97 Allowed 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 121.067 1.758 . . . . 0.0 112.018 -178.638 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.63 7.68 64.62 Favored Glycine 0 CA--C 1.542 1.779 0 C-N-CA 125.418 1.485 . . . . 0.0 115.672 -173.625 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 5.7 mp -108.61 155.73 40.02 Favored Pre-proline 0 CA--C 1.556 1.211 0 C-N-CA 126.666 1.986 . . . . 0.0 111.877 179.491 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -64.82 163.35 28.32 Favored 'Trans proline' 0 C--N 1.354 0.817 0 C-N-CA 125.207 3.938 . . . . 0.0 114.235 -172.795 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 9.1 t -106.96 -30.29 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 123.719 0.808 . . . . 0.0 112.041 174.765 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 24.2 p -126.88 169.52 13.18 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 125.161 1.385 . . . . 0.0 114.004 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 41.0 ptt180 -61.97 -36.07 80.35 Favored 'General case' 0 N--CA 1.482 1.138 0 O-C-N 121.306 -0.871 . . . . 0.0 111.789 173.782 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 22.3 m -63.86 -43.3 96.53 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.361 1.065 . . . . 0.0 110.845 172.754 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -60.81 -49.75 76.23 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 118.688 0.676 . . . . 0.0 111.2 174.494 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.41 -42.97 93.03 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-N 118.721 0.691 . . . . 0.0 112.308 -179.576 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.94 -49.04 76.34 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.261 1.024 . . . . 0.0 111.895 175.808 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 51.7 t -60.2 -47.59 91.51 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 123.638 0.775 . . . . 0.0 111.234 177.95 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 88.0 mt -61.6 -42.87 99.48 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 118.277 -0.868 . . . . 0.0 111.968 179.222 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 55.7 mt -56.79 -52.7 51.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 CA-C-N 119.147 0.885 . . . . 0.0 110.156 172.97 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -64.44 -45.97 85.15 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 -176.361 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 46.2 m-20 -67.2 -49.11 65.82 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.337 1.055 . . . . 0.0 111.811 -178.936 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -65.33 -43.22 91.63 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 118.927 -0.558 . . . . 0.0 110.972 179.836 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.42 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 58.2 t90 -57.48 -47.66 81.28 Favored 'General case' 0 C--O 1.217 -0.612 0 CA-C-O 117.217 -1.373 . . . . 0.0 111.315 170.693 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -61.13 -40.79 95.12 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 121.124 1.784 . . . . 0.0 113.519 -178.822 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -65.92 -51.58 57.37 Favored 'General case' 0 N--CA 1.478 0.965 0 CA-C-N 120.212 1.369 . . . . 0.0 111.896 175.253 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -55.28 -48.25 74.33 Favored 'General case' 0 C--O 1.215 -0.715 0 C-N-CA 122.921 0.488 . . . . 0.0 110.491 176.714 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.24 -33.19 75.19 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 126.772 2.029 . . . . 0.0 113.648 179.125 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 44.6 mttp -61.37 -31.46 71.35 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 120.163 1.347 . . . . 0.0 111.579 166.401 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 5.6 t -81.76 -24.86 35.78 Favored 'General case' 0 N--CA 1.484 1.262 0 N-CA-C 115.04 1.496 . . . . 0.0 115.04 165.281 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -137.8 72.69 48.23 Favored Pre-proline 0 CA--C 1.552 1.031 0 C-N-CA 127.708 2.403 . . . . 0.0 111.754 -165.42 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -61.52 -9.05 12.21 Favored 'Trans proline' 0 CA--C 1.547 1.13 0 C-N-CA 123.667 2.911 . . . . 0.0 116.296 -166.553 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 41.3 p90 -82.89 -15.15 52.58 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 126.267 1.827 . . . . 0.0 114.812 174.433 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 20.6 tp -60.54 134.82 57.45 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 114.514 1.301 . . . . 0.0 114.514 -162.612 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 6.7 mmp_? -74.92 155.0 37.91 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.753 1.221 . . . . 0.0 112.619 177.222 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.42 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -136.16 126.84 27.19 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 126.374 1.87 . . . . 0.0 109.989 -177.244 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 55.1 t0 -147.47 122.99 10.42 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.726 0.81 . . . . 0.0 110.738 171.663 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 3.4 ptt? -137.79 31.83 2.49 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.955 1.702 . . . . 0.0 111.707 173.888 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 27.1 t -62.12 152.62 32.41 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 121.582 -0.699 . . . . 0.0 110.143 161.529 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -53.82 -37.32 63.45 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 121.027 -1.046 . . . . 0.0 113.525 -169.831 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -61.32 -33.4 73.53 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.007 0.923 . . . . 0.0 112.729 176.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.4 -39.01 93.03 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 123.505 0.722 . . . . 0.0 111.777 173.778 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.98 -45.36 64.2 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 123.482 0.713 . . . . 0.0 109.301 179.246 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 10.8 m-30 -55.09 -46.46 75.49 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.032 0.533 . . . . 0.0 112.17 175.025 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.55 -31.02 41.96 Favored 'General case' 0 C--N 1.343 0.306 0 C-N-CA 124.712 1.205 . . . . 0.0 113.771 -172.683 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 86.0 mtt180 -82.78 -32.54 27.71 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.818 0.847 . . . . 0.0 112.854 173.853 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -126.86 73.93 75.95 Favored Pre-proline 0 CA--C 1.543 0.702 0 C-N-CA 125.723 1.609 . . . . 0.0 110.874 -173.737 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -66.71 -12.7 36.99 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 123.2 2.6 . . . . 0.0 113.874 -176.413 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 15.0 p-80 -73.65 -23.87 59.91 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.041 0.936 . . . . 0.0 113.258 170.482 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -85.79 -34.06 21.22 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.814 1.646 . . . . 0.0 112.102 -168.395 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 2.9 tmm_? . . . . . 0 C--O 1.256 1.397 0 C-N-CA 125.71 1.604 . . . . 0.0 111.117 176.681 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.3 t . . . . . 0 N--CA 1.474 0.756 0 CA-C-O 120.242 0.068 . . . . 0.0 110.881 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.6 p -151.85 141.16 15.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 124.651 1.18 . . . . 0.0 111.877 176.611 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 68.5 m -141.99 140.5 32.7 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.779 1.632 . . . . 0.0 110.82 175.777 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 55.4 p90 -153.47 163.52 39.8 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.67 1.188 . . . . 0.0 112.758 -179.494 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 85.5 134.3 3.27 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 125.502 1.525 . . . . 0.0 114.156 178.041 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -150.85 65.98 7.16 Favored Pre-proline 0 CA--C 1.554 1.1 0 C-N-CA 125.443 1.497 . . . . 0.0 111.208 178.334 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -68.23 143.97 60.87 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 123.508 2.805 . . . . 0.0 113.062 -174.495 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 59.3 p -148.98 47.68 0.52 Allowed Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 125.088 1.355 . . . . 0.0 113.83 178.555 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -64.24 139.92 68.41 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 123.118 2.545 . . . . 0.0 112.838 -176.562 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.8 tt -152.15 118.85 5.72 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.171 1.388 . . . . 0.0 110.01 179.432 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 23.2 t -152.02 146.4 25.54 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.477 1.111 . . . . 0.0 111.776 170.978 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 79.2 p -145.16 12.64 1.4 Allowed 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.476 1.51 . . . . 0.0 113.797 -178.796 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -111.86 157.77 20.23 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.028 1.331 . . . . 0.0 113.355 -170.872 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 8.6 t -146.75 165.82 28.49 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.576 1.55 . . . . 0.0 111.436 176.984 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 61.15 -8.01 0.08 Allowed 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 127.732 2.413 . . . . 0.0 116.998 -179.64 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -68.07 -13.88 62.54 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.066 1.346 . . . . 0.0 114.249 -177.689 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 . . . . . 0 CA--C 1.549 0.941 0 C-N-CA 125.811 1.644 . . . . 0.0 113.107 173.971 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.578 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -87.43 158.55 18.96 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.156 1.382 . . . . 0.0 111.227 167.204 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 96.6 mt -133.7 156.81 47.27 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.927 1.291 . . . . 0.0 112.379 -175.27 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 -79.41 137.48 37.28 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.438 0.695 . . . . 0.0 110.125 163.437 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -95.66 -15.11 22.93 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 -174.46 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -150.04 169.3 21.55 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.888 1.275 . . . . 0.0 112.944 -173.01 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.16 -164.5 54.91 Favored Glycine 0 CA--C 1.54 1.641 0 C-N-CA 124.107 0.861 . . . . 0.0 114.054 179.793 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -67.71 -17.42 47.66 Favored 'Trans proline' 0 CA--C 1.541 0.83 0 C-N-CA 123.312 2.675 . . . . 0.0 113.827 -176.091 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 98.0 mt -94.31 6.85 47.4 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.553 1.141 . . . . 0.0 113.878 175.225 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -54.67 122.06 9.83 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 120.829 1.649 . . . . 0.0 112.037 -178.262 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 82.3 8.32 86.49 Favored Glycine 0 CA--C 1.541 1.702 0 C-N-CA 125.138 1.351 . . . . 0.0 115.453 -175.409 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.453 ' HB3' ' HD2' ' A' ' 73' ' ' PRO . 25.4 mt -106.44 160.62 25.61 Favored Pre-proline 0 CA--C 1.558 1.256 0 C-N-CA 126.557 1.943 . . . . 0.0 111.189 178.954 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.453 ' HD2' ' HB3' ' A' ' 72' ' ' LEU . 50.1 Cg_endo -69.55 163.77 36.84 Favored 'Trans proline' 0 C--N 1.354 0.866 0 C-N-CA 124.386 3.391 . . . . 0.0 113.591 -169.975 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 11.3 t -105.83 -30.24 2.68 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 O-C-N 121.454 -0.779 . . . . 0.0 112.177 174.782 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 23.2 p -126.65 171.54 11.05 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 125.184 1.394 . . . . 0.0 114.099 -178.212 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 39.0 ttm180 -61.64 -37.98 86.0 Favored 'General case' 0 N--CA 1.48 1.054 0 O-C-N 121.487 -0.758 . . . . 0.0 110.947 171.879 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 10.1 t -59.47 -48.74 80.49 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 123.613 0.765 . . . . 0.0 110.331 172.845 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -60.44 -47.35 86.48 Favored 'General case' 0 CA--C 1.537 0.47 0 O-C-N 122.137 -0.352 . . . . 0.0 111.1 177.74 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.89 -44.32 97.03 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 118.733 0.697 . . . . 0.0 112.778 -179.592 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 57.8 ttm-85 -62.41 -46.98 86.1 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 119.112 0.869 . . . . 0.0 111.513 176.43 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 54.0 t -63.42 -46.23 95.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.055 0.942 . . . . 0.0 111.489 178.957 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 52.0 mt -60.66 -45.69 93.16 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 118.194 -0.908 . . . . 0.0 112.003 176.566 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 61.4 mt -54.58 -51.54 49.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 CA-C-N 119.263 0.938 . . . . 0.0 109.975 173.912 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.44 ' HB2' ' HE1' ' A' ' 101' ' ' MET . 17.5 t80 -62.91 -47.04 84.97 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -178.268 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 57.6 m-20 -69.7 -46.27 66.39 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.947 0.899 . . . . 0.0 112.051 -176.217 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -63.25 -44.62 94.66 Favored 'General case' 0 N--CA 1.465 0.303 0 O-C-N 121.993 -0.442 . . . . 0.0 111.551 176.343 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.444 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 66.7 t90 -61.11 -47.73 84.9 Favored 'General case' 0 C--O 1.219 -0.517 0 CA-C-O 117.622 -1.18 . . . . 0.0 111.226 172.988 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -54.48 -44.5 72.66 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 120.907 1.685 . . . . 0.0 112.883 178.916 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -67.44 -53.87 25.27 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 119.492 1.042 . . . . 0.0 112.632 176.157 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 77.2 mtm-85 -64.47 -35.0 79.52 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 121.275 -0.89 . . . . 0.0 111.885 -177.546 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.8 tmtt? -74.09 -30.13 62.2 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.359 1.464 . . . . 0.0 113.594 174.543 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -61.75 -35.27 77.63 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 120.051 1.296 . . . . 0.0 110.929 165.599 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 8.2 t -74.46 -34.27 63.1 Favored 'General case' 0 CA--C 1.553 1.086 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 167.425 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -133.78 80.65 55.0 Favored Pre-proline 0 CA--C 1.549 0.905 0 C-N-CA 127.029 2.132 . . . . 0.0 111.749 -168.212 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -61.8 -6.31 7.34 Favored 'Trans proline' 0 CA--C 1.546 1.091 0 C-N-CA 123.604 2.869 . . . . 0.0 116.345 -168.791 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 44.1 p90 -88.9 -3.93 58.6 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.694 1.998 . . . . 0.0 114.828 174.534 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.6 tp -66.57 133.38 50.2 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 120.09 1.313 . . . . 0.0 113.255 -173.607 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 50.9 ttp180 -85.11 152.27 23.52 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.233 1.413 . . . . 0.0 112.723 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.444 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -132.28 130.92 41.49 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.985 2.114 . . . . 0.0 109.826 -174.504 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -143.87 136.04 26.65 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.151 0.98 . . . . 0.0 110.754 176.818 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.44 ' HE1' ' HB2' ' A' ' 84' ' ' PHE . 66.4 mtt -132.63 15.71 4.4 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.769 1.228 . . . . 0.0 113.567 -177.193 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 74.7 m -69.37 154.18 42.43 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.457 -0.777 . . . . 0.0 110.925 172.533 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -56.94 -34.54 68.12 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 121.018 -1.051 . . . . 0.0 113.709 -168.572 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -61.64 -32.77 72.94 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 176.235 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.8 -39.72 92.74 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 119.182 0.901 . . . . 0.0 111.665 174.287 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -74.11 -46.57 44.83 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 C-N-CA 124.536 1.134 . . . . 0.0 109.478 179.831 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 13.8 m-30 -54.94 -45.21 74.83 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 119.064 0.847 . . . . 0.0 112.416 175.865 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -76.6 -38.3 55.02 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.909 1.284 . . . . 0.0 112.227 -173.915 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 72.6 mtt85 -70.14 -39.14 75.56 Favored 'General case' 0 N--CA 1.483 1.213 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 171.342 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 29.7 m-85 -130.59 82.81 63.91 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 125.435 1.494 . . . . 0.0 110.988 -165.61 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -69.05 -5.74 16.51 Favored 'Trans proline' 0 CA--C 1.54 0.788 0 C-N-CA 123.728 2.952 . . . . 0.0 114.726 -172.262 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 7.6 p-80 -86.92 -20.51 27.27 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.144 1.378 . . . . 0.0 113.801 170.787 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -92.39 -14.1 29.14 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 125.881 1.673 . . . . 0.0 113.679 -171.968 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 14.0 ptt180 . . . . . 0 C--O 1.253 1.261 0 C-N-CA 125.251 1.42 . . . . 0.0 113.515 173.297 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 66.1 m . . . . . 0 N--CA 1.475 0.812 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 23.9 m -138.29 152.95 26.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 125.636 1.574 . . . . 0.0 111.66 176.027 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 21.3 t -151.4 146.82 26.24 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.075 1.35 . . . . 0.0 110.916 175.083 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -138.96 148.57 43.69 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.888 1.275 . . . . 0.0 112.328 -172.959 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 81.89 129.93 1.2 Allowed Glycine 0 CA--C 1.538 1.492 0 C-N-CA 125.201 1.381 . . . . 0.0 113.26 -175.973 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -150.39 73.12 9.14 Favored Pre-proline 0 CA--C 1.553 1.06 0 C-N-CA 124.905 1.282 . . . . 0.0 111.336 -178.007 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -66.54 146.65 80.33 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 123.298 2.665 . . . . 0.0 112.481 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 33.3 p -146.17 60.54 6.39 Favored Pre-proline 0 N--CA 1.477 0.903 0 C-N-CA 124.782 1.233 . . . . 0.0 113.051 -174.531 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -62.16 142.85 93.41 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 123.17 2.58 . . . . 0.0 112.138 177.489 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -136.3 12.77 3.28 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 115.448 1.647 . . . . 0.0 115.448 -168.615 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 37.1 t -146.17 145.25 30.4 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.678 1.191 . . . . 0.0 112.157 178.754 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.4 t -141.12 19.07 2.27 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.914 1.685 . . . . 0.0 111.601 171.241 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.4 mp0 -105.56 153.21 22.08 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.798 1.639 . . . . 0.0 112.629 -168.218 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 6.7 t -137.07 53.39 1.89 Allowed 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.718 1.607 . . . . 0.0 110.663 179.135 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 58.67 14.18 3.0 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 126.246 1.819 . . . . 0.0 114.882 -174.522 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -81.01 -14.27 58.07 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.994 1.718 . . . . 0.0 114.959 -173.595 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 . . . . . 0 CA--C 1.55 0.952 0 C-N-CA 125.58 1.552 . . . . 0.0 113.03 176.985 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.615 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -91.33 155.78 18.26 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.152 1.381 . . . . 0.0 111.466 166.811 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 88.0 mt -132.5 158.03 43.14 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 125.05 1.34 . . . . 0.0 112.31 -174.201 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 -85.3 142.28 29.46 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.901 0.88 . . . . 0.0 110.042 163.001 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -102.48 -11.47 18.54 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 -171.783 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -149.19 167.12 26.83 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.658 1.183 . . . . 0.0 113.166 -172.794 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.02 -161.01 53.21 Favored Glycine 0 CA--C 1.541 1.709 0 C-N-CA 124.062 0.839 . . . . 0.0 113.854 179.645 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -67.63 -16.41 46.69 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 123.163 2.575 . . . . 0.0 113.563 -177.851 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 97.7 mt -93.3 5.22 52.27 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.657 1.183 . . . . 0.0 113.95 176.015 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.61 120.84 8.44 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-N 121.114 1.779 . . . . 0.0 112.025 -178.655 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 82.55 7.23 87.76 Favored Glycine 0 CA--C 1.54 1.652 0 C-N-CA 125.402 1.477 . . . . 0.0 115.45 -174.802 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.455 ' HB3' ' HD2' ' A' ' 73' ' ' PRO . 16.3 mt -104.68 159.86 27.92 Favored Pre-proline 0 CA--C 1.558 1.287 0 C-N-CA 126.371 1.868 . . . . 0.0 111.445 -178.66 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.455 ' HD2' ' HB3' ' A' ' 72' ' ' LEU . 68.5 Cg_endo -71.9 163.92 37.3 Favored 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 124.63 3.554 . . . . 0.0 114.163 -168.029 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 10.5 t -108.88 -26.55 3.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 123.902 0.881 . . . . 0.0 112.52 176.299 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 22.3 p -127.05 172.0 10.87 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 125.508 1.523 . . . . 0.0 113.924 178.292 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -64.83 -36.8 85.51 Favored 'General case' 0 N--CA 1.484 1.264 0 O-C-N 121.183 -0.948 . . . . 0.0 111.251 173.835 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 32.5 m -61.59 -46.82 88.24 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.948 0.899 . . . . 0.0 111.017 171.095 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -59.36 -46.55 88.33 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 118.776 0.716 . . . . 0.0 111.014 175.824 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.47 -41.55 98.85 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.692 0.797 . . . . 0.0 112.698 -178.671 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 60.6 mtp85 -67.81 -39.15 84.01 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.517 0.727 . . . . 0.0 112.396 175.401 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 73.4 t -64.15 -46.56 93.24 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.112 0 CA-C-N 118.847 0.748 . . . . 0.0 111.312 174.255 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.7 mp -60.29 -45.3 93.83 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 118.417 -0.802 . . . . 0.0 112.506 175.439 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 51.1 mt -54.4 -49.86 61.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 CA-C-N 118.969 0.804 . . . . 0.0 110.187 172.303 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 13.8 t80 -63.39 -51.25 66.62 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -177.305 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -67.11 -43.88 81.33 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 119.103 0.865 . . . . 0.0 112.455 -177.965 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -56.44 -52.69 63.72 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.237 0.615 . . . . 0.0 110.127 174.551 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.4 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 62.9 t90 -59.01 -47.76 84.03 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-O 117.09 -1.433 . . . . 0.0 111.631 176.59 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -56.62 -47.58 79.34 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 121.262 1.846 . . . . 0.0 113.249 -179.76 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -68.26 -47.7 67.03 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 119.516 1.053 . . . . 0.0 111.938 179.264 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 15.8 mmp_? -61.47 -44.57 96.86 Favored 'General case' 0 C--O 1.216 -0.702 0 O-C-N 121.642 -0.661 . . . . 0.0 110.596 178.507 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -61.75 -35.64 78.69 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 126.102 1.761 . . . . 0.0 113.147 174.335 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 63.0 tttm -62.34 -34.64 77.04 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 119.225 0.92 . . . . 0.0 111.263 170.945 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 7.9 t -77.72 -29.69 51.35 Favored 'General case' 0 CA--C 1.555 1.168 0 N-CA-C 114.762 1.393 . . . . 0.0 114.762 166.914 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -133.39 81.21 55.87 Favored Pre-proline 0 N--CA 1.476 0.86 0 C-N-CA 127.511 2.324 . . . . 0.0 111.94 -165.643 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -63.94 7.37 0.21 Allowed 'Trans proline' 0 CA--C 1.551 1.337 0 C-N-CA 124.456 3.437 . . . . 0.0 117.009 -169.762 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 39.5 p90 -105.24 -6.01 20.12 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 127.199 2.2 . . . . 0.0 114.785 176.33 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 12.9 tp -66.61 139.46 57.89 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.65 1.352 . . . . 0.0 114.65 -168.327 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 18.2 mmt85 -97.98 158.17 15.69 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 125.342 1.457 . . . . 0.0 112.908 -178.154 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.4 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -139.16 129.81 25.98 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 126.333 1.853 . . . . 0.0 110.297 -167.813 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -147.3 134.33 20.35 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.208 1.003 . . . . 0.0 111.19 177.475 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 64.4 mtt -131.14 3.65 4.36 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -172.183 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 70.4 m -63.84 153.25 37.28 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.541 0.736 . . . . 0.0 110.904 172.068 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -55.34 -33.25 63.19 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 -166.554 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 57.6 mtmt -59.4 -35.46 74.01 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.851 0.86 . . . . 0.0 113.285 174.979 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.52 -39.59 94.05 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.209 0.913 . . . . 0.0 111.723 173.836 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.77 -46.48 61.18 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 C-N-CA 124.212 1.005 . . . . 0.0 109.276 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 13.2 m-30 -56.66 -45.55 81.58 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 118.737 0.699 . . . . 0.0 112.511 174.907 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.4 tmt_? -75.74 -37.18 59.57 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.482 1.113 . . . . 0.0 112.255 -172.639 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 37.3 mtp85 -70.99 -38.83 72.7 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 118.587 0.63 . . . . 0.0 112.665 169.397 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -131.27 83.57 59.36 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 125.23 1.412 . . . . 0.0 111.263 -167.638 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -66.88 -18.52 52.59 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 122.846 2.364 . . . . 0.0 113.977 -172.742 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 8.8 p-80 -72.29 -24.56 61.35 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.901 0.88 . . . . 0.0 113.187 173.329 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.14 -14.01 48.37 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 126.004 1.722 . . . . 0.0 113.296 -175.837 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.326 0 C-N-CA 124.821 1.249 . . . . 0.0 112.723 178.578 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 85.0 p . . . . . 0 N--CA 1.478 0.975 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 12.7 p -156.71 -42.61 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.197 0 C-N-CA 124.54 1.136 . . . . 0.0 112.492 171.654 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 39.3 m 61.85 149.28 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 127.423 2.289 . . . . 0.0 115.377 -174.716 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -141.82 -15.66 0.8 Allowed 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 115.046 1.498 . . . . 0.0 115.046 -175.676 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -66.84 132.53 31.57 Favored Glycine 0 CA--C 1.536 1.377 0 O-C-N 121.108 -0.995 . . . . 0.0 113.5 -177.363 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -147.85 68.61 10.74 Favored Pre-proline 0 CA--C 1.553 1.074 0 C-N-CA 125.098 1.359 . . . . 0.0 111.479 -179.255 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -69.64 153.1 69.89 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 123.47 2.78 . . . . 0.0 112.775 -179.411 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 70.4 m -135.32 67.31 67.58 Favored Pre-proline 0 N--CA 1.475 0.812 0 C-N-CA 125.054 1.342 . . . . 0.0 111.926 -177.193 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -65.66 141.74 67.66 Favored 'Trans proline' 0 CA--C 1.542 0.904 0 C-N-CA 123.2 2.6 . . . . 0.0 111.939 177.863 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 27.0 tp -135.25 -10.69 2.21 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 114.336 1.235 . . . . 0.0 114.336 -171.882 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 32.1 p -79.15 141.54 37.16 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.362 1.065 . . . . 0.0 113.082 -178.76 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 47.4 m -139.27 19.42 2.58 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.841 1.256 . . . . 0.0 113.697 -174.301 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 54.76 30.94 14.48 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 125.241 1.417 . . . . 0.0 113.527 -173.093 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 29.9 p -87.95 154.77 20.25 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.123 1.769 . . . . 0.0 112.932 -179.589 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 59.41 15.44 4.42 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 115.734 1.753 . . . . 0.0 115.734 179.758 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -77.29 96.47 4.6 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 121.15 -0.969 . . . . 0.0 110.127 169.06 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 . . . . . 0 N--CA 1.477 0.899 0 C-N-CA 126.546 1.938 . . . . 0.0 115.91 177.434 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.588 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -87.01 146.33 26.16 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.725 1.21 . . . . 0.0 110.922 166.11 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.9 mt -128.13 157.54 40.48 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.449 1.1 . . . . 0.0 112.707 -169.785 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -77.82 138.11 38.78 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.901 0.88 . . . . 0.0 110.428 166.904 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -95.25 -15.13 23.44 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 114.478 1.288 . . . . 0.0 114.478 -175.21 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -150.19 169.72 20.65 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.876 1.27 . . . . 0.0 113.088 -172.54 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.2 -164.75 54.91 Favored Glycine 0 CA--C 1.54 1.605 0 C-N-CA 124.184 0.897 . . . . 0.0 114.138 179.385 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -67.69 -17.13 47.69 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 123.325 2.683 . . . . 0.0 113.788 -176.324 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.8 mt -94.58 6.61 48.34 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.785 1.234 . . . . 0.0 113.815 175.824 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -54.57 123.33 12.81 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 120.952 1.705 . . . . 0.0 112.256 -177.228 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 82.41 3.13 90.65 Favored Glycine 0 CA--C 1.541 1.678 0 C-N-CA 125.501 1.524 . . . . 0.0 115.378 -174.981 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.419 ' HB3' ' HD2' ' A' ' 73' ' ' PRO . 20.9 mt -102.01 163.54 17.56 Favored Pre-proline 0 CA--C 1.555 1.156 0 C-N-CA 126.265 1.826 . . . . 0.0 110.888 179.411 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.419 ' HD2' ' HB3' ' A' ' 72' ' ' LEU . 73.7 Cg_endo -76.33 157.33 37.21 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 124.186 3.257 . . . . 0.0 113.383 -164.943 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 35.3 t -92.99 -35.88 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 O-C-N 121.533 -0.729 . . . . 0.0 112.502 174.511 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 19.6 p -123.29 172.67 8.47 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 114.716 1.376 . . . . 0.0 114.716 -177.501 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 15.0 ptp180 -61.73 -36.66 81.61 Favored 'General case' 0 N--CA 1.482 1.162 0 O-C-N 121.448 -0.783 . . . . 0.0 111.934 173.148 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 25.3 m -66.07 -44.31 84.88 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.895 0.878 . . . . 0.0 110.705 173.16 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -61.23 -42.21 98.22 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 121.714 -0.616 . . . . 0.0 111.401 175.914 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.09 -44.48 92.23 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.105 0.962 . . . . 0.0 112.831 177.639 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 81.1 mtp180 -66.12 -40.7 90.9 Favored 'General case' 0 N--CA 1.478 0.974 0 O-C-N 121.415 -0.803 . . . . 0.0 112.262 176.967 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 78.4 t -63.79 -45.85 96.06 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 123.356 0.663 . . . . 0.0 111.071 174.159 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 15.8 mt -57.26 -48.88 77.75 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 118.466 -0.778 . . . . 0.0 112.035 174.11 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 52.8 mt -54.48 -49.42 65.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 CA-C-N 118.736 0.698 . . . . 0.0 110.294 176.907 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.405 ' HB2' ' HE1' ' A' ' 101' ' ' MET . 13.6 t80 -64.79 -51.62 61.23 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -179.32 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.9 t30 -66.36 -43.8 84.96 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 118.639 0.654 . . . . 0.0 112.544 -176.908 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -60.62 -51.27 70.11 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 118.845 -0.598 . . . . 0.0 110.025 174.044 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.405 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 62.5 t90 -56.26 -46.26 79.71 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-O 118.001 -0.999 . . . . 0.0 112.5 176.216 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -56.38 -51.31 68.78 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 120.053 1.297 . . . . 0.0 112.491 177.288 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -70.09 -45.58 66.66 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 119.75 1.159 . . . . 0.0 112.488 -178.112 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 58.1 mmt-85 -55.91 -44.01 77.88 Favored 'General case' 0 N--CA 1.475 0.789 0 O-C-N 121.839 -0.538 . . . . 0.0 109.642 174.327 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 78.8 tttt -69.24 -33.24 72.97 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 178.388 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -59.32 -32.5 70.12 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 119.941 1.246 . . . . 0.0 111.137 167.537 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 67.1 m -81.6 -24.26 36.57 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 115.374 1.62 . . . . 0.0 115.374 166.334 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -145.77 78.93 11.46 Favored Pre-proline 0 CA--C 1.552 1.029 0 C-N-CA 126.758 2.023 . . . . 0.0 111.974 -164.787 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_endo -60.87 -7.51 7.81 Favored 'Trans proline' 0 CA--C 1.548 1.209 0 C-N-CA 123.605 2.87 . . . . 0.0 116.682 -167.56 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 42.2 p90 -86.46 -2.8 58.76 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 126.996 2.118 . . . . 0.0 115.25 176.036 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.35 133.28 52.74 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 124.714 1.206 . . . . 0.0 114.153 -173.975 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -88.77 152.18 21.94 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 125.278 1.431 . . . . 0.0 113.0 176.628 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.405 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.3 tm? -133.36 129.22 37.15 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.63 1.572 . . . . 0.0 110.494 -174.06 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -145.99 134.98 22.61 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.319 1.048 . . . . 0.0 110.843 174.63 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.405 ' HE1' ' HB2' ' A' ' 84' ' ' PHE . 66.8 mtt -129.81 12.48 5.77 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.739 1.216 . . . . 0.0 113.818 -176.284 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 75.3 m -66.99 153.62 43.19 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 121.345 -0.847 . . . . 0.0 111.11 174.247 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -55.17 -36.08 65.47 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -169.802 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 59.2 mtmt -61.41 -33.19 73.27 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.052 0.941 . . . . 0.0 113.323 176.068 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.01 -40.43 97.73 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 119.194 0.906 . . . . 0.0 111.632 173.206 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.86 -46.14 61.93 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 C-N-CA 123.833 0.853 . . . . 0.0 109.541 -179.819 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 16.5 m-30 -55.58 -47.01 77.14 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.364 0.666 . . . . 0.0 112.641 174.699 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.4 tmt_? -77.51 -36.77 52.24 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 124.292 1.037 . . . . 0.0 112.254 -172.254 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 51.1 ttt85 -75.73 -34.56 60.35 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.831 0.852 . . . . 0.0 112.629 174.632 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 35.6 m-85 -130.74 88.64 45.75 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 125.588 1.555 . . . . 0.0 110.871 -175.316 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -67.51 -19.77 48.35 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 123.057 2.504 . . . . 0.0 114.6 -168.201 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 7.9 p-80 -73.78 -22.48 59.82 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.783 0.833 . . . . 0.0 113.07 173.789 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.5 4.96 37.61 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 126.571 1.948 . . . . 0.0 113.636 -177.773 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.256 1.402 0 C-N-CA 125.412 1.485 . . . . 0.0 111.433 172.255 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 79.6 p . . . . . 0 N--CA 1.475 0.785 0 CA-C-O 120.835 0.35 . . . . 0.0 111.617 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.3 p -151.54 140.94 15.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 124.492 1.117 . . . . 0.0 111.595 175.644 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.6 p -156.02 153.66 29.83 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.448 1.499 . . . . 0.0 111.797 174.074 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -153.69 156.09 37.19 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.028 1.331 . . . . 0.0 112.295 177.041 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 78.46 148.52 3.93 Favored Glycine 0 CA--C 1.54 1.614 0 C-N-CA 125.1 1.333 . . . . 0.0 114.228 -178.219 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -150.36 64.45 6.67 Favored Pre-proline 0 CA--C 1.555 1.142 0 C-N-CA 124.996 1.318 . . . . 0.0 111.941 179.133 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -68.68 131.09 21.99 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 123.19 2.594 . . . . 0.0 112.082 -179.29 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 73.2 m -140.58 68.97 31.55 Favored Pre-proline 0 N--CA 1.477 0.898 0 C-N-CA 125.162 1.385 . . . . 0.0 111.101 -178.497 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_endo -67.69 154.73 72.51 Favored 'Trans proline' 0 CA--C 1.543 0.96 0 C-N-CA 123.362 2.708 . . . . 0.0 112.492 179.581 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.1 mp -77.38 -21.38 53.31 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.893 0.877 . . . . 0.0 113.23 -176.499 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 14.0 t -151.97 159.6 43.72 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.636 1.575 . . . . 0.0 111.493 175.579 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.6 t -150.14 -42.51 0.13 Allowed 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.364 1.066 . . . . 0.0 112.458 178.566 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.6 mp0 -70.84 119.38 14.89 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.521 1.128 . . . . 0.0 112.274 -177.013 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 3.4 t -149.41 36.32 0.73 Allowed 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.627 1.171 . . . . 0.0 112.234 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -136.76 4.59 2.81 Favored 'General case' 0 N--CA 1.478 0.925 0 N-CA-C 114.989 1.477 . . . . 0.0 114.989 -169.491 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -72.86 -24.67 60.9 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 -173.103 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 . . . . . 0 CA--C 1.549 0.912 0 C-N-CA 125.935 1.694 . . . . 0.0 113.786 179.035 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.587 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -87.2 143.44 27.29 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.426 1.091 . . . . 0.0 110.938 169.722 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 59.9 mt -127.9 157.51 40.33 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.517 1.127 . . . . 0.0 112.482 -170.696 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 93.5 m-70 -79.1 139.15 38.15 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.939 0.896 . . . . 0.0 110.242 167.483 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -94.19 -23.68 17.81 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -174.663 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -141.14 166.44 24.76 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.192 1.397 . . . . 0.0 112.61 -170.664 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 74.18 -163.86 54.6 Favored Glycine 0 CA--C 1.539 1.574 0 C-N-CA 124.277 0.942 . . . . 0.0 114.166 178.056 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -67.41 -17.21 49.1 Favored 'Trans proline' 0 CA--C 1.541 0.86 0 C-N-CA 123.281 2.654 . . . . 0.0 113.778 -175.988 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.9 mt -93.49 5.11 52.7 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.656 1.182 . . . . 0.0 113.81 175.377 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.26 123.61 14.33 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 120.954 1.707 . . . . 0.0 112.318 -176.783 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 81.98 2.9 90.69 Favored Glycine 0 CA--C 1.541 1.681 0 C-N-CA 125.71 1.624 . . . . 0.0 115.339 -174.831 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 17.0 mt -101.63 162.49 20.27 Favored Pre-proline 0 CA--C 1.557 1.224 0 C-N-CA 126.07 1.748 . . . . 0.0 110.951 -179.107 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -77.69 155.29 31.14 Favored 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 124.113 3.209 . . . . 0.0 113.751 -164.107 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 45.1 t -91.53 -36.44 7.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 CA-C-O 118.514 -0.755 . . . . 0.0 112.574 175.271 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 16.9 p -124.68 172.77 9.01 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 115.038 1.496 . . . . 0.0 115.038 -177.425 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 56.5 ttt180 -59.26 -41.36 88.63 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 125.253 1.421 . . . . 0.0 111.192 174.605 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.3 t -62.71 -47.32 84.09 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 123.612 0.765 . . . . 0.0 110.832 171.939 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 69.0 m-20 -60.08 -42.21 94.12 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.418 -0.801 . . . . 0.0 111.862 178.341 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.04 -43.52 92.06 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.63 0.772 . . . . 0.0 112.696 177.486 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 92.5 mtt180 -66.63 -38.33 86.69 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 121.163 -0.961 . . . . 0.0 113.005 175.55 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 77.6 t -66.31 -43.49 91.48 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 CA-C-N 118.835 0.743 . . . . 0.0 111.321 174.498 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 16.5 mt -56.82 -48.39 78.1 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 118.595 0.634 . . . . 0.0 112.173 172.542 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 59.9 mt -54.83 -51.26 54.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 122.943 0.497 . . . . 0.0 110.082 175.364 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.466 ' HB2' ' HE1' ' A' ' 101' ' ' MET . 15.0 t80 -65.09 -48.0 75.25 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -177.001 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 20.1 t30 -69.64 -45.04 69.36 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.502 0.721 . . . . 0.0 112.246 -176.43 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 48.0 tt0 -66.04 -44.96 83.13 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 118.113 -0.946 . . . . 0.0 110.849 175.771 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.428 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 66.1 t90 -58.35 -46.0 87.11 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 119.987 1.267 . . . . 0.0 111.588 173.4 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -55.3 -46.15 76.23 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 120.71 1.595 . . . . 0.0 112.768 177.415 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -68.54 -52.24 34.18 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 119.533 1.061 . . . . 0.0 112.766 177.237 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 38.6 mmt180 -57.01 -45.34 83.12 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.447 0.699 . . . . 0.0 110.281 179.243 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.8 tmtt? -70.8 -29.49 65.68 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.785 1.634 . . . . 0.0 113.477 178.451 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 65.4 tttm -60.71 -35.34 76.07 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 120.237 1.381 . . . . 0.0 110.933 165.714 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 61.1 m -80.04 -23.47 41.39 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 115.226 1.565 . . . . 0.0 115.226 167.265 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -140.0 75.39 29.71 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 126.883 2.073 . . . . 0.0 111.8 -167.795 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -61.35 -6.23 6.49 Favored 'Trans proline' 0 CA--C 1.547 1.147 0 C-N-CA 123.947 3.098 . . . . 0.0 116.59 -167.246 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 41.3 p90 -87.44 -8.3 56.66 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 126.648 1.979 . . . . 0.0 114.938 174.977 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 16.2 tp -65.24 136.55 56.75 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 119.857 1.208 . . . . 0.0 114.048 -168.851 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 82.3 mtt85 -83.44 155.97 23.15 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.894 1.277 . . . . 0.0 113.084 179.094 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.428 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.4 tm? -138.8 128.29 24.54 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 126.606 1.962 . . . . 0.0 109.841 -174.672 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -146.5 137.48 24.23 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.111 0.964 . . . . 0.0 110.849 174.407 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.466 ' HE1' ' HB2' ' A' ' 84' ' ' PHE . 65.6 mtt -126.03 12.34 7.76 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.776 1.23 . . . . 0.0 113.713 -175.284 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 32.9 t -61.24 143.87 54.82 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.488 -0.758 . . . . 0.0 110.405 172.782 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 32.7 m-20 -60.51 -24.95 65.74 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 121.011 -1.056 . . . . 0.0 113.517 -172.527 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -56.25 -38.45 71.13 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.038 0.935 . . . . 0.0 112.609 169.782 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.42 -38.65 91.78 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.745 0.818 . . . . 0.0 112.035 173.856 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -70.38 -46.28 71.66 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 123.806 0.842 . . . . 0.0 109.396 -179.277 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 10.2 m-30 -58.83 -45.91 88.89 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 118.545 0.612 . . . . 0.0 112.284 174.448 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.09 -29.24 60.57 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 124.276 1.031 . . . . 0.0 113.267 -173.654 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -78.85 -38.91 36.76 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.085 0.954 . . . . 0.0 112.374 169.385 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -130.9 83.06 62.34 Favored Pre-proline 0 CA--C 1.546 0.814 0 C-N-CA 125.635 1.574 . . . . 0.0 110.84 -168.658 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.69 -15.46 44.53 Favored 'Trans proline' 0 CA--C 1.539 0.767 0 C-N-CA 123.067 2.511 . . . . 0.0 114.212 -170.706 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 12.5 p-80 -74.2 -22.71 59.26 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.083 0.953 . . . . 0.0 113.219 173.418 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -81.02 -25.63 37.03 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.389 1.475 . . . . 0.0 112.622 -171.435 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 69.9 ttp85 . . . . . 0 C--O 1.254 1.319 0 C-N-CA 124.585 1.154 . . . . 0.0 112.506 177.711 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 70.9 p . . . . . 0 N--CA 1.474 0.771 0 CA-C-O 121.133 0.492 . . . . 0.0 111.479 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 9.5 p -158.69 155.59 4.36 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 C-N-CA 125.091 1.357 . . . . 0.0 111.296 -178.183 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.2 p -143.14 149.39 38.01 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.923 1.289 . . . . 0.0 112.491 173.416 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -144.23 169.21 18.31 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 126.023 1.729 . . . . 0.0 111.815 -177.61 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 89.01 82.97 1.29 Allowed Glycine 0 CA--C 1.532 1.141 0 C-N-CA 124.712 1.149 . . . . 0.0 113.441 174.15 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.16 63.19 28.83 Favored Pre-proline 0 CA--C 1.554 1.119 0 C-N-CA 125.329 1.452 . . . . 0.0 111.434 175.093 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -68.38 150.26 75.79 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 123.606 2.87 . . . . 0.0 113.136 -175.625 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 54.1 p -146.51 50.78 1.05 Allowed Pre-proline 0 CA--C 1.552 1.023 0 C-N-CA 125.037 1.335 . . . . 0.0 113.841 -179.459 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -63.49 140.81 77.79 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 123.151 2.568 . . . . 0.0 112.447 -179.54 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -139.8 6.18 2.21 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 115.547 1.684 . . . . 0.0 115.547 -174.523 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.2 t -76.48 130.18 37.59 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 121.366 -0.834 . . . . 0.0 111.79 -178.235 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.4 t -158.09 150.22 21.98 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.33 1.452 . . . . 0.0 111.354 178.195 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -149.81 151.36 33.42 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.108 1.363 . . . . 0.0 112.236 175.118 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 12.3 t -152.58 99.68 2.49 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.763 1.225 . . . . 0.0 109.804 176.235 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -149.81 30.48 0.73 Allowed 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.28 1.032 . . . . 0.0 113.623 -168.652 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -75.51 61.11 1.26 Allowed 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.931 1.693 . . . . 0.0 112.268 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 . . . . . 0 N--CA 1.475 0.797 0 C-N-CA 126.413 1.885 . . . . 0.0 112.425 -170.907 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.488 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -86.58 155.06 20.61 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.523 1.129 . . . . 0.0 110.837 164.394 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 91.3 mt -132.99 157.32 45.49 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.803 1.241 . . . . 0.0 112.105 -175.129 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -81.81 137.53 35.28 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 123.352 0.661 . . . . 0.0 109.615 162.627 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -96.48 -21.59 17.63 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 114.426 1.269 . . . . 0.0 114.426 -173.422 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -140.8 165.53 27.27 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.202 1.401 . . . . 0.0 112.373 -171.535 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.17 -162.72 54.79 Favored Glycine 0 CA--C 1.54 1.629 0 C-N-CA 124.162 0.887 . . . . 0.0 114.124 178.296 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -67.85 -17.36 46.92 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 123.251 2.634 . . . . 0.0 113.809 -175.168 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 97.8 mt -94.13 6.26 49.15 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.557 1.143 . . . . 0.0 113.901 175.273 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.45 122.01 10.28 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 120.798 1.636 . . . . 0.0 112.123 -178.04 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.15 6.28 88.23 Favored Glycine 0 CA--C 1.541 1.693 0 C-N-CA 125.447 1.499 . . . . 0.0 115.432 -175.18 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.457 ' HB3' ' HD2' ' A' ' 73' ' ' PRO . 18.2 mt -103.99 160.77 25.0 Favored Pre-proline 0 CA--C 1.559 1.293 0 C-N-CA 126.137 1.775 . . . . 0.0 111.33 -179.208 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.457 ' HD2' ' HB3' ' A' ' 72' ' ' LEU . 67.9 Cg_endo -72.24 164.73 34.75 Favored 'Trans proline' 0 C--N 1.354 0.832 0 C-N-CA 124.307 3.338 . . . . 0.0 113.553 -168.497 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 10.6 t -110.12 -27.38 2.89 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 O-C-N 121.288 -0.883 . . . . 0.0 112.458 176.583 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 17.7 p -125.87 172.65 9.71 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 125.385 1.474 . . . . 0.0 114.203 179.726 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 10.1 mmt180 -60.19 -40.96 91.9 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 121.378 -0.826 . . . . 0.0 111.442 170.965 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 8.6 t -63.15 -44.28 95.98 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 122.617 0.367 . . . . 0.0 110.761 174.815 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -60.01 -45.14 93.74 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.717 -0.614 . . . . 0.0 111.417 175.739 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.72 -41.82 95.7 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.595 0.758 . . . . 0.0 112.67 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 34.0 mtp-105 -61.42 -45.8 92.8 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 118.803 0.729 . . . . 0.0 111.773 173.051 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 55.4 t -60.96 -49.78 83.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 124.046 0.938 . . . . 0.0 111.199 177.826 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.6 mp -60.13 -49.83 76.08 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 118.6 -0.714 . . . . 0.0 112.562 177.811 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 60.8 mt -54.47 -52.61 38.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-N 118.859 0.754 . . . . 0.0 110.199 175.75 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -65.44 -47.41 76.26 Favored 'General case' 0 C--O 1.224 -0.267 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -176.482 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -67.61 -45.95 73.99 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 119.47 1.032 . . . . 0.0 112.528 -178.071 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -64.86 -44.44 89.7 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 118.957 -0.544 . . . . 0.0 110.722 178.606 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.436 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 71.3 t90 -60.29 -46.0 91.4 Favored 'General case' 0 C--O 1.219 -0.545 0 CA-C-O 117.787 -1.102 . . . . 0.0 111.897 171.298 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -55.72 -49.2 73.67 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 121.042 1.747 . . . . 0.0 112.637 179.576 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -65.53 -53.71 38.42 Favored 'General case' 0 C--O 1.245 0.835 0 O-C-N 121.067 -1.02 . . . . 0.0 111.931 178.324 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 9.8 mmm180 -58.32 -47.12 84.72 Favored 'General case' 0 C--O 1.215 -0.739 0 C-N-CA 122.435 0.294 . . . . 0.0 111.039 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 13.7 tmtt? -67.37 -30.96 70.89 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.32 1.048 . . . . 0.0 113.192 178.859 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 8.9 mtpm? -66.64 -26.56 67.12 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 120.194 1.361 . . . . 0.0 112.531 168.565 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 79.8 p -91.06 -9.18 46.71 Favored 'General case' 0 N--CA 1.486 1.34 0 N-CA-C 116.185 1.92 . . . . 0.0 116.185 163.104 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -144.64 72.55 15.48 Favored Pre-proline 0 CA--C 1.552 1.02 0 C-N-CA 127.353 2.261 . . . . 0.0 111.4 -172.103 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -61.1 -7.78 8.72 Favored 'Trans proline' 0 CA--C 1.546 1.114 0 C-N-CA 123.835 3.024 . . . . 0.0 116.577 -166.277 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 41.0 p90 -84.31 -10.49 57.58 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 126.502 1.921 . . . . 0.0 115.037 174.506 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.4 tp -64.84 137.08 57.55 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.674 1.124 . . . . 0.0 113.747 -169.589 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 23.3 mmt85 -90.06 156.46 18.37 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.593 1.157 . . . . 0.0 112.78 -179.107 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.436 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.4 tm? -137.69 131.81 31.96 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 126.996 2.119 . . . . 0.0 109.266 -171.772 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 52.5 t0 -141.85 130.65 22.92 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.68 0.792 . . . . 0.0 111.041 175.923 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 65.0 mtt -122.8 9.23 9.45 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.836 1.654 . . . . 0.0 112.841 -179.732 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 28.9 t -64.52 153.73 38.14 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.026 0.93 . . . . 0.0 111.507 172.516 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -51.4 -38.28 52.64 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.238 1.015 . . . . 0.0 112.79 -179.496 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -58.78 -39.1 80.04 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.531 1.133 . . . . 0.0 112.914 176.998 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.24 -42.38 99.26 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 123.25 0.62 . . . . 0.0 111.551 175.788 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.02 -46.92 64.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.297 0 C-N-CA 123.651 0.781 . . . . 0.0 109.902 -179.036 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 18.8 m-30 -55.35 -46.48 76.4 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 118.869 0.759 . . . . 0.0 112.599 175.394 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 1.5 ttp85 -78.2 -35.18 48.87 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.906 0.882 . . . . 0.0 112.93 -172.053 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 61.7 ttm-85 -80.71 -37.24 30.98 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 124.433 1.093 . . . . 0.0 112.847 175.495 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -129.71 76.96 77.77 Favored Pre-proline 0 CA--C 1.547 0.846 0 C-N-CA 126.54 1.936 . . . . 0.0 110.893 -173.32 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -65.41 -17.67 58.26 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 123.109 2.54 . . . . 0.0 114.281 -172.598 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 7.6 p-80 -74.15 -23.98 59.34 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.078 0.951 . . . . 0.0 113.32 172.795 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -85.53 -4.79 59.26 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 126.278 1.831 . . . . 0.0 113.496 -178.795 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 57.5 ttp180 . . . . . 0 C--O 1.254 1.302 0 C-N-CA 125.405 1.482 . . . . 0.0 111.843 173.777 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 8.8 t . . . . . 0 N--CA 1.475 0.797 0 CA-C-O 120.666 0.269 . . . . 0.0 111.662 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.9 p -140.86 139.27 34.36 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 125.381 1.472 . . . . 0.0 111.354 175.767 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 80.2 p -154.01 162.14 41.42 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.726 1.611 . . . . 0.0 111.618 179.535 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 84.1 m-85 -133.43 132.43 41.11 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.632 1.173 . . . . 0.0 111.363 -177.885 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 72.5 165.08 8.05 Favored Glycine 0 CA--C 1.54 1.619 0 C-N-CA 124.605 1.097 . . . . 0.0 114.235 -172.961 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -146.95 55.31 2.39 Favored Pre-proline 0 CA--C 1.555 1.14 0 C-N-CA 124.617 1.167 . . . . 0.0 112.984 178.037 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -66.83 141.48 59.32 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.097 2.532 . . . . 0.0 112.378 -179.806 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 9.6 t -152.08 80.88 5.84 Favored Pre-proline 0 CA--C 1.545 0.773 0 C-N-CA 124.479 1.112 . . . . 0.0 110.88 176.893 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -78.13 95.72 1.08 Allowed 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 123.659 2.906 . . . . 0.0 111.562 -176.498 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 97.9 mt -115.69 -3.26 12.29 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.963 1.305 . . . . 0.0 114.397 -175.897 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 21.1 t -81.52 134.61 35.54 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.751 0.82 . . . . 0.0 112.054 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 81.4 p -158.42 163.15 37.48 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.525 1.53 . . . . 0.0 112.353 179.44 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -131.05 144.55 51.52 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.217 1.407 . . . . 0.0 111.181 173.244 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 59.8 m -142.44 151.47 41.8 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.745 1.218 . . . . 0.0 112.85 -172.477 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 57.01 25.64 10.94 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.983 1.713 . . . . 0.0 115.467 172.266 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -70.95 -22.42 62.22 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 114.29 1.218 . . . . 0.0 114.29 -174.339 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 . . . . . 0 CA--C 1.551 1.017 0 C-N-CA 125.906 1.682 . . . . 0.0 113.014 -179.239 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.566 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -92.93 154.54 18.13 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.128 1.371 . . . . 0.0 111.639 168.152 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 81.4 mt -129.25 157.12 42.75 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.145 1.378 . . . . 0.0 112.051 -176.284 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 79.3 m-70 -82.94 143.34 30.76 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.716 0.806 . . . . 0.0 109.584 162.347 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -107.13 -9.56 16.12 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 114.898 1.444 . . . . 0.0 114.898 -170.225 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -148.53 165.72 30.38 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.745 1.218 . . . . 0.0 112.957 -174.299 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 68.52 -158.9 52.32 Favored Glycine 0 CA--C 1.541 1.658 0 C-N-CA 123.931 0.777 . . . . 0.0 113.83 -179.81 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_endo -68.05 -15.45 43.26 Favored 'Trans proline' 0 CA--C 1.541 0.865 0 C-N-CA 123.268 2.645 . . . . 0.0 113.746 -177.441 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.0 mt -94.46 5.5 51.62 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.765 1.226 . . . . 0.0 113.949 176.301 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.93 114.12 2.41 Favored 'General case' 0 CA--C 1.549 0.907 0 CA-C-N 121.276 1.853 . . . . 0.0 111.995 -179.28 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.17 1.81 71.95 Favored Glycine 0 CA--C 1.542 1.763 0 C-N-CA 125.682 1.611 . . . . 0.0 115.694 -174.209 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 6.7 mp -98.61 157.17 34.74 Favored Pre-proline 0 CA--C 1.556 1.198 0 C-N-CA 126.792 2.037 . . . . 0.0 111.563 179.57 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -68.06 160.13 49.98 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 124.748 3.632 . . . . 0.0 113.664 -172.003 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 15.2 t -103.95 -30.77 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 O-C-N 121.445 -0.784 . . . . 0.0 112.2 175.857 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 22.3 p -124.96 170.31 11.24 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 125.143 1.377 . . . . 0.0 114.144 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 43.0 ttt-85 -59.97 -40.1 87.94 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.033 0.933 . . . . 0.0 111.119 173.967 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 37.4 m -62.77 -43.9 97.59 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.019 0.927 . . . . 0.0 111.291 172.838 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -60.59 -46.46 90.17 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 118.866 0.757 . . . . 0.0 111.274 175.069 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.19 -42.22 98.2 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 118.623 0.647 . . . . 0.0 112.55 179.587 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 74.5 mtp180 -64.45 -43.16 95.13 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 121.525 -0.735 . . . . 0.0 112.376 175.449 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 53.4 t -62.91 -48.33 88.55 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 C-N-CA 123.79 0.836 . . . . 0.0 111.142 176.195 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.7 mp -59.67 -45.15 92.91 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 118.45 -0.786 . . . . 0.0 112.602 176.542 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 49.7 mt -54.76 -51.49 51.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 CA-C-N 118.884 0.765 . . . . 0.0 110.157 173.346 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -65.44 -48.46 72.65 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 113.318 0.859 . . . . 0.0 113.318 -176.865 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 23.7 t30 -69.43 -42.78 74.56 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 118.627 0.648 . . . . 0.0 112.49 -176.704 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -65.01 -45.96 83.37 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 118.772 -0.633 . . . . 0.0 110.778 175.861 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.455 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 64.7 t90 -58.99 -47.34 85.53 Favored 'General case' 0 C--O 1.22 -0.454 0 CA-C-O 117.919 -1.039 . . . . 0.0 111.658 173.05 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -57.93 -45.22 86.9 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 120.645 1.566 . . . . 0.0 112.927 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -66.86 -52.76 39.77 Favored 'General case' 0 C--O 1.245 0.824 0 CA-C-N 119.599 1.09 . . . . 0.0 112.435 177.234 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -55.84 -48.51 75.36 Favored 'General case' 0 C--O 1.218 -0.595 0 O-C-N 121.776 -0.578 . . . . 0.0 110.16 177.513 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 18.5 ttpt -63.04 -34.02 76.67 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.214 1.405 . . . . 0.0 113.397 177.197 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -59.64 -33.66 71.81 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 119.998 1.272 . . . . 0.0 111.001 169.171 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 63.0 m -84.37 -17.66 38.69 Favored 'General case' 0 N--CA 1.484 1.234 0 N-CA-C 116.106 1.891 . . . . 0.0 116.106 165.861 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -143.09 72.89 18.29 Favored Pre-proline 0 CA--C 1.553 1.073 0 C-N-CA 127.266 2.226 . . . . 0.0 111.738 -165.278 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -61.84 -5.23 5.7 Favored 'Trans proline' 0 CA--C 1.547 1.166 0 C-N-CA 123.934 3.089 . . . . 0.0 116.649 -167.301 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 38.9 p90 -88.12 -9.11 54.27 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 126.921 2.088 . . . . 0.0 114.965 175.721 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.3 tp -65.43 137.5 57.51 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 114.725 1.38 . . . . 0.0 114.725 -164.969 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 34.4 mmt180 -84.21 155.01 22.71 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 125.139 1.376 . . . . 0.0 113.128 178.79 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.455 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -138.77 131.98 29.94 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.898 2.079 . . . . 0.0 109.681 -174.991 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 53.5 t0 -143.86 132.44 22.33 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.894 0.877 . . . . 0.0 111.152 174.901 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 66.7 mtt -125.9 2.21 7.35 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.313 1.445 . . . . 0.0 113.729 -176.884 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 73.4 m -62.73 144.7 56.14 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 118.96 0.8 . . . . 0.0 110.216 169.797 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -61.26 -25.04 66.82 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 -165.038 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -56.32 -34.48 66.58 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.86 0.864 . . . . 0.0 112.966 171.492 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.31 -40.04 95.0 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.508 0.723 . . . . 0.0 111.922 173.141 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.6 mp -73.28 -45.42 53.07 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 C-N-CA 124.204 1.001 . . . . 0.0 109.261 -179.621 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 11.7 m-30 -55.59 -46.15 77.29 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 118.618 0.644 . . . . 0.0 112.235 175.679 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.4 tmt_? -77.66 -39.92 43.45 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.65 1.18 . . . . 0.0 112.523 -173.524 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 62.2 ttm-85 -76.89 -35.69 57.24 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.144 0.978 . . . . 0.0 112.994 177.123 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 45.1 m-85 -127.19 72.68 76.96 Favored Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 125.991 1.717 . . . . 0.0 111.115 -174.534 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -66.68 -11.08 30.42 Favored 'Trans proline' 0 CA--C 1.542 0.898 0 C-N-CA 123.348 2.699 . . . . 0.0 114.171 -175.904 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 16.1 p-80 -74.83 -23.48 58.46 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.003 0.921 . . . . 0.0 113.343 171.296 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -81.04 -45.66 16.2 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.82 1.248 . . . . 0.0 111.892 -164.462 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 20.8 mmt85 . . . . . 0 C--O 1.253 1.268 0 C-N-CA 127.054 2.142 . . . . 0.0 111.121 172.794 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 70.4 p . . . . . 0 N--CA 1.477 0.91 0 N-CA-C 114.972 1.471 . . . . 0.0 114.972 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.0 m -84.92 -1.38 6.64 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 N-CA-C 115.294 1.59 . . . . 0.0 115.294 -169.627 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 30.2 m -73.4 -13.42 61.08 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 115.71 1.745 . . . . 0.0 115.71 -168.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -79.24 149.36 31.9 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -176.708 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 86.59 134.51 3.86 Favored Glycine 0 CA--C 1.538 1.476 0 C-N-CA 125.693 1.616 . . . . 0.0 114.341 175.554 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -151.78 67.26 7.15 Favored Pre-proline 0 CA--C 1.556 1.177 0 C-N-CA 125.099 1.36 . . . . 0.0 112.152 -179.824 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -70.32 146.65 57.35 Favored 'Trans proline' 0 CA--C 1.543 0.948 0 C-N-CA 123.369 2.712 . . . . 0.0 112.725 179.56 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 67.3 m -139.47 62.43 24.01 Favored Pre-proline 0 N--CA 1.479 1.014 0 C-N-CA 124.933 1.293 . . . . 0.0 112.637 -177.618 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -67.77 132.15 26.03 Favored 'Trans proline' 0 CA--C 1.542 0.923 0 C-N-CA 123.169 2.579 . . . . 0.0 112.095 179.629 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.3 tt -153.92 115.56 4.2 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.901 1.28 . . . . 0.0 110.341 179.067 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 76.2 p -155.41 148.48 24.61 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.787 1.235 . . . . 0.0 112.304 172.028 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.9 t -159.69 128.72 5.17 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.682 1.193 . . . . 0.0 111.269 172.801 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -155.97 124.59 5.93 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.981 1.312 . . . . 0.0 110.353 172.963 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 11.0 t -160.44 151.77 19.36 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.425 1.09 . . . . 0.0 112.426 177.976 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 47.54 63.05 2.15 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.634 1.974 . . . . 0.0 114.364 170.925 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -76.54 43.02 0.3 Allowed 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 124.914 1.285 . . . . 0.0 112.27 172.218 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 . . . . . 0 CA--C 1.548 0.892 0 C-N-CA 126.918 2.087 . . . . 0.0 113.575 -168.307 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.579 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -92.41 150.96 20.49 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.612 1.165 . . . . 0.0 111.681 168.844 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 99.5 mt -131.34 157.49 43.21 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.678 1.591 . . . . 0.0 111.28 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -79.23 143.37 35.38 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.809 0.843 . . . . 0.0 109.91 166.552 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -106.83 -9.01 16.51 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 -172.002 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -148.39 165.7 30.31 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.85 1.26 . . . . 0.0 112.924 -174.802 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 69.53 -161.16 52.68 Favored Glycine 0 CA--C 1.541 1.701 0 C-N-CA 123.942 0.782 . . . . 0.0 113.9 -179.33 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -68.07 -16.03 44.17 Favored 'Trans proline' 0 CA--C 1.541 0.851 0 C-N-CA 123.191 2.594 . . . . 0.0 113.72 -177.059 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.1 mt -92.91 4.28 54.2 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 124.813 1.245 . . . . 0.0 113.971 175.999 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.39 113.94 2.2 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-N 121.107 1.776 . . . . 0.0 112.088 -178.099 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 92.55 4.27 66.0 Favored Glycine 0 CA--C 1.544 1.864 0 C-N-CA 125.642 1.591 . . . . 0.0 115.704 -173.631 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 5.9 mp -105.45 154.77 38.83 Favored Pre-proline 0 CA--C 1.555 1.173 0 C-N-CA 126.831 2.052 . . . . 0.0 111.435 179.848 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -71.56 162.55 41.84 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 124.98 3.786 . . . . 0.0 113.859 -167.9 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 14.7 t -105.27 -32.88 2.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 O-C-N 121.441 -0.787 . . . . 0.0 113.09 -179.122 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 25.1 p -123.93 172.75 8.69 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 124.914 1.285 . . . . 0.0 113.988 179.364 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 41.5 mtp-105 -61.68 -40.5 95.21 Favored 'General case' 0 N--CA 1.482 1.156 0 O-C-N 121.378 -0.827 . . . . 0.0 110.562 175.054 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 31.3 m -61.67 -44.61 96.63 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 124.353 1.061 . . . . 0.0 111.237 173.321 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -61.16 -47.29 86.88 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 118.885 0.766 . . . . 0.0 111.233 175.116 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.21 -39.58 90.75 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.616 -0.677 . . . . 0.0 112.216 179.698 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 75.3 ttt180 -65.21 -42.07 93.86 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 121.422 -0.798 . . . . 0.0 112.354 174.14 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 68.1 t -63.07 -48.54 87.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 CA-C-N 118.786 0.721 . . . . 0.0 111.223 175.021 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -60.63 -45.11 95.29 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 118.628 -0.701 . . . . 0.0 111.952 178.178 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 52.9 mt -53.59 -51.69 40.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-N 118.736 0.698 . . . . 0.0 110.33 170.703 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.449 ' HB2' ' HE1' ' A' ' 101' ' ' MET . 20.8 t80 -64.15 -46.5 83.79 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 -176.298 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -70.71 -44.99 65.78 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.033 0.933 . . . . 0.0 112.353 -176.517 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -65.71 -44.01 87.37 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 118.766 -0.635 . . . . 0.0 111.091 176.091 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.437 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 68.3 t90 -60.02 -45.48 92.64 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-O 117.572 -1.204 . . . . 0.0 111.59 171.589 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -54.93 -48.68 72.81 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 120.836 1.653 . . . . 0.0 112.492 178.667 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -65.29 -51.5 60.3 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 119.68 1.127 . . . . 0.0 112.232 177.207 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 38.2 mmt180 -58.54 -46.25 87.22 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 122.99 0.516 . . . . 0.0 110.845 -178.955 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 3.5 tmtm? -69.27 -30.32 68.4 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 126.043 1.737 . . . . 0.0 113.509 178.661 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 90.8 mttt -65.83 -28.23 68.83 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 119.993 1.27 . . . . 0.0 111.98 166.818 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 68.5 m -82.9 -22.65 33.88 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 115.173 1.546 . . . . 0.0 115.173 163.801 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -140.44 75.83 26.48 Favored Pre-proline 0 N--CA 1.477 0.903 0 C-N-CA 127.105 2.162 . . . . 0.0 111.363 -167.332 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -58.63 -16.84 32.29 Favored 'Trans proline' 0 CA--C 1.542 0.907 0 C-N-CA 123.379 2.719 . . . . 0.0 116.039 -165.393 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 39.1 p90 -79.08 -9.78 59.64 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 126.611 1.964 . . . . 0.0 115.463 177.181 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 18.2 tp -64.05 135.42 56.39 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 120.098 1.317 . . . . 0.0 114.35 -167.069 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 7.5 tpm_? -77.9 146.65 35.46 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.939 1.696 . . . . 0.0 112.721 178.9 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.437 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.4 tm? -128.36 133.89 48.74 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 126.886 2.074 . . . . 0.0 109.847 179.533 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -149.62 134.3 17.69 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.901 0.881 . . . . 0.0 111.084 176.487 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.449 ' HE1' ' HB2' ' A' ' 84' ' ' PHE . 63.6 mtt -130.24 1.79 4.67 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.052 1.341 . . . . 0.0 114.288 -171.653 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 69.6 m -63.78 147.34 52.0 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.022 0.828 . . . . 0.0 111.067 173.097 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -58.52 -27.64 64.69 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 114.888 1.44 . . . . 0.0 114.888 -166.396 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -56.85 -37.37 71.2 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 119.035 0.834 . . . . 0.0 112.802 172.468 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.06 -37.1 86.2 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.661 0.784 . . . . 0.0 112.065 174.162 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.6 mp -73.65 -46.4 47.94 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 C-N-CA 124.104 0.962 . . . . 0.0 109.327 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 13.9 m-30 -56.17 -45.81 79.56 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 119.006 0.821 . . . . 0.0 112.334 174.391 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.46 -38.97 62.8 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 124.277 1.031 . . . . 0.0 112.283 -173.943 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 39.7 ttm105 -78.99 -34.78 43.79 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.836 0.854 . . . . 0.0 112.948 176.45 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 -128.21 78.16 75.86 Favored Pre-proline 0 CA--C 1.546 0.827 0 C-N-CA 126.396 1.879 . . . . 0.0 110.757 -174.329 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -66.16 -16.04 50.59 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 123.091 2.527 . . . . 0.0 114.231 -173.4 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 12.9 p-80 -73.99 -24.01 59.53 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.138 0.975 . . . . 0.0 113.444 172.48 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -82.18 -27.31 32.71 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 125.858 1.663 . . . . 0.0 112.252 -171.442 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 59.6 ttp180 . . . . . 0 C--O 1.254 1.311 0 C-N-CA 125.169 1.388 . . . . 0.0 112.291 175.994 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.6 t . . . . . 0 N--CA 1.477 0.906 0 N-CA-C 115.35 1.611 . . . . 0.0 115.35 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 15.1 m -143.33 152.83 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 126.831 2.053 . . . . 0.0 111.819 -174.778 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 26.4 m -73.66 -34.44 64.93 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 113.322 0.86 . . . . 0.0 113.322 -179.074 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 7.3 t80 52.09 37.18 20.81 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 126.289 1.836 . . . . 0.0 114.956 172.745 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -69.84 144.61 40.29 Favored Glycine 0 CA--C 1.537 1.46 0 O-C-N 121.247 -0.908 . . . . 0.0 113.747 -178.775 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -146.22 66.59 11.42 Favored Pre-proline 0 CA--C 1.554 1.124 0 C-N-CA 125.036 1.334 . . . . 0.0 111.878 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_endo -69.35 150.47 70.74 Favored 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 123.677 2.918 . . . . 0.0 113.094 -177.343 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.9 p -148.31 53.53 1.5 Allowed Pre-proline 0 CA--C 1.553 1.07 0 C-N-CA 125.094 1.357 . . . . 0.0 113.472 -179.458 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -66.02 144.77 77.39 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 123.413 2.742 . . . . 0.0 113.358 -176.176 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.4 mt -140.82 153.7 45.9 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.637 1.975 . . . . 0.0 110.939 176.571 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 81.9 p -152.26 161.46 42.57 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.783 1.233 . . . . 0.0 113.171 -179.745 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 63.0 m -137.61 148.67 46.02 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.904 1.682 . . . . 0.0 111.393 178.232 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -150.7 138.09 19.54 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.498 1.119 . . . . 0.0 112.121 -177.211 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 69.0 m -142.02 132.69 25.51 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 125.523 1.529 . . . . 0.0 111.132 177.435 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -146.72 -1.56 0.68 Allowed 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 115.396 1.628 . . . . 0.0 115.396 -177.451 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -70.26 -13.48 62.19 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 115.727 1.751 . . . . 0.0 115.727 -165.698 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 . . . . . 0 CA--C 1.548 0.898 0 C-N-CA 125.371 1.469 . . . . 0.0 113.033 173.061 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.546 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -89.25 159.57 17.36 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.792 1.237 . . . . 0.0 111.275 164.743 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 96.5 mt -135.52 156.17 49.32 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.047 1.339 . . . . 0.0 112.178 -176.059 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 87.3 m-70 -81.67 141.87 33.24 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.731 0.812 . . . . 0.0 109.479 162.12 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -104.82 -16.76 14.81 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 -172.415 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -139.58 162.67 34.53 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.155 1.382 . . . . 0.0 112.373 -173.061 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.84 -161.23 53.97 Favored Glycine 0 CA--C 1.541 1.671 0 C-N-CA 124.075 0.845 . . . . 0.0 113.99 179.065 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -67.81 -16.38 45.86 Favored 'Trans proline' 0 CA--C 1.542 0.902 0 C-N-CA 123.241 2.628 . . . . 0.0 113.835 -176.162 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 98.9 mt -92.82 4.28 54.13 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.697 1.199 . . . . 0.0 113.865 175.245 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.41 113.74 2.12 Favored 'General case' 0 CA--C 1.548 0.896 0 CA-C-N 121.097 1.771 . . . . 0.0 111.999 -179.0 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.93 6.16 65.53 Favored Glycine 0 CA--C 1.543 1.787 0 C-N-CA 125.453 1.501 . . . . 0.0 115.737 -173.84 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 6.0 mp -106.44 157.3 35.32 Favored Pre-proline 0 CA--C 1.558 1.267 0 C-N-CA 126.986 2.114 . . . . 0.0 111.318 178.94 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -71.36 163.9 37.53 Favored 'Trans proline' 0 C--N 1.355 0.882 0 C-N-CA 124.65 3.567 . . . . 0.0 113.833 -168.828 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 11.0 t -107.05 -27.88 2.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 123.658 0.783 . . . . 0.0 112.084 176.889 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 29.1 p -126.89 170.38 12.29 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 125.021 1.328 . . . . 0.0 114.471 -179.902 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 71.8 ttt180 -64.65 -39.36 93.56 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 124.618 1.167 . . . . 0.0 111.116 176.855 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 11.8 p -65.9 -40.58 91.66 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.275 1.03 . . . . 0.0 111.987 170.897 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 85.6 m-20 -58.82 -48.86 79.82 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 120.01 1.277 . . . . 0.0 110.846 172.297 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.22 -40.74 91.24 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 121.573 -0.704 . . . . 0.0 112.504 179.5 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 38.4 mmm-85 -61.55 -46.8 88.37 Favored 'General case' 0 N--CA 1.485 1.292 0 O-C-N 121.38 -0.825 . . . . 0.0 112.778 172.3 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 55.4 t -61.67 -46.07 97.33 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 C-N-CA 123.662 0.785 . . . . 0.0 111.058 177.693 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 56.5 mt -63.11 -43.49 98.28 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 117.839 -1.077 . . . . 0.0 112.107 178.642 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 54.5 mt -53.98 -52.6 34.82 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 CA-C-N 119.591 1.087 . . . . 0.0 110.146 171.976 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -63.33 -46.83 84.79 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 -177.419 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -69.91 -44.8 68.92 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 119.043 0.838 . . . . 0.0 112.233 -177.114 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -54.42 -54.85 35.15 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.951 0.9 . . . . 0.0 109.992 172.947 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.451 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 66.2 t90 -62.39 -42.76 99.67 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-O 117.771 -1.109 . . . . 0.0 112.436 178.805 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -57.56 -46.59 83.74 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 120.723 1.602 . . . . 0.0 112.513 178.408 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -66.65 -49.31 66.64 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 119.347 0.976 . . . . 0.0 112.036 176.399 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 6.1 mmp_? -53.9 -53.88 46.53 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.56 0.744 . . . . 0.0 110.053 177.487 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 45.7 tptt -64.04 -34.26 77.61 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 126.1 1.76 . . . . 0.0 113.374 -178.974 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt -59.7 -37.23 78.29 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.324 0.966 . . . . 0.0 111.086 169.453 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 70.7 m -81.71 -21.97 37.67 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 115.414 1.635 . . . . 0.0 115.414 169.116 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -143.52 84.82 9.78 Favored Pre-proline 0 N--CA 1.477 0.909 0 C-N-CA 125.913 1.685 . . . . 0.0 112.132 -161.063 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -60.45 -12.66 21.51 Favored 'Trans proline' 0 CA--C 1.544 1.019 0 C-N-CA 123.009 2.473 . . . . 0.0 115.288 -172.931 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 40.4 p90 -81.91 -8.07 59.65 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 115.509 1.67 . . . . 0.0 115.509 176.661 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.47 137.74 58.32 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 120.394 1.452 . . . . 0.0 113.444 -176.999 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 84.2 mtp180 -99.99 153.44 19.19 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 125.951 1.7 . . . . 0.0 112.277 175.021 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.451 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.4 tm? -128.4 130.99 48.48 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.769 1.628 . . . . 0.0 110.029 -174.29 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -142.01 131.08 23.23 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.244 1.018 . . . . 0.0 111.049 176.595 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 61.1 mtt -128.32 -0.37 5.7 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.737 1.384 . . . . 0.0 114.737 -171.824 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 63.6 m -65.77 150.86 47.84 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 118.769 0.713 . . . . 0.0 110.467 172.635 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 27.4 m-20 -59.86 -24.45 64.24 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 114.652 1.352 . . . . 0.0 114.652 -165.558 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -55.56 -36.76 67.17 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.678 0.791 . . . . 0.0 112.416 171.674 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.61 -39.31 90.77 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 118.868 0.758 . . . . 0.0 112.101 174.195 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.6 mp -73.14 -47.15 48.51 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 C-N-CA 124.341 1.056 . . . . 0.0 109.071 -179.307 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 11.3 m-30 -57.11 -44.41 83.22 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 118.669 0.668 . . . . 0.0 112.296 176.351 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.3 tmt_? -77.66 -38.29 48.05 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 124.656 1.182 . . . . 0.0 112.595 -173.246 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 46.8 mtt-85 -69.02 -41.92 77.1 Favored 'General case' 0 N--CA 1.483 1.181 0 CA-C-N 118.912 0.778 . . . . 0.0 112.506 169.473 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -130.35 71.15 82.38 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 125.43 1.492 . . . . 0.0 111.544 -164.145 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -66.33 -12.68 36.64 Favored 'Trans proline' 0 CA--C 1.54 0.813 0 C-N-CA 123.171 2.58 . . . . 0.0 113.739 -177.838 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 15.9 p-80 -72.83 -23.86 60.82 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.308 1.043 . . . . 0.0 113.442 172.413 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -80.79 -45.25 17.26 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.193 0.997 . . . . 0.0 112.528 -161.069 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 3.7 tmt_? . . . . . 0 C--O 1.253 1.278 0 C-N-CA 125.968 1.707 . . . . 0.0 110.752 -178.042 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 71.1 m . . . . . 0 N--CA 1.477 0.918 0 N-CA-C 111.529 0.196 . . . . 0.0 111.529 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 62.0 t -133.58 114.96 21.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 C-N-CA 125.179 1.391 . . . . 0.0 109.371 174.666 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.0 m -137.89 15.29 2.88 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 -171.389 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 36.2 p90 -112.54 163.04 14.97 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.512 1.525 . . . . 0.0 113.322 -173.517 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 130.86 89.68 0.51 Allowed Glycine 0 CA--C 1.533 1.163 0 C-N-CA 125.693 1.616 . . . . 0.0 112.236 177.84 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -144.36 64.23 11.97 Favored Pre-proline 0 CA--C 1.556 1.179 0 C-N-CA 124.702 1.201 . . . . 0.0 112.351 -178.475 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -69.52 157.54 60.49 Favored 'Trans proline' 0 CA--C 1.543 0.955 0 C-N-CA 123.65 2.9 . . . . 0.0 112.884 179.388 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 75.4 p -150.3 151.57 31.64 Favored Pre-proline 0 N--CA 1.476 0.844 0 C-N-CA 125.004 1.321 . . . . 0.0 112.732 178.167 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -74.97 156.07 43.11 Favored 'Trans proline' 0 CA--C 1.542 0.919 0 C-N-CA 123.61 2.873 . . . . 0.0 112.721 177.981 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.1 pp -151.19 165.63 33.33 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.142 1.377 . . . . 0.0 112.871 176.795 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.3 t 60.41 178.55 0.1 Allowed 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 126.604 1.962 . . . . 0.0 115.678 177.989 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 61.39 8.4 2.14 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 127.907 2.483 . . . . 0.0 116.566 179.441 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -63.0 -30.97 72.01 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 120.447 -1.408 . . . . 0.0 113.764 -168.565 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 76.7 p -99.22 0.55 43.46 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.368 1.467 . . . . 0.0 114.743 -176.773 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -136.75 -5.81 1.94 Allowed 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 116.215 1.931 . . . . 0.0 116.215 -169.565 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -58.74 -23.57 60.07 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 115.137 1.532 . . . . 0.0 115.137 -173.083 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.546 0.826 0 C-N-CA 126.915 2.086 . . . . 0.0 114.407 177.581 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.573 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -97.15 154.02 17.62 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.312 1.445 . . . . 0.0 111.987 171.194 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 98.2 mt -130.67 157.36 43.0 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 125.64 1.576 . . . . 0.0 111.186 178.518 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 83.2 m-70 -77.87 141.09 39.32 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.587 0.755 . . . . 0.0 109.82 165.425 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -102.89 -16.75 15.79 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 -174.396 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -139.87 163.0 33.81 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.264 1.425 . . . . 0.0 112.373 -173.093 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.86 -162.71 54.43 Favored Glycine 0 CA--C 1.541 1.686 0 C-N-CA 123.978 0.799 . . . . 0.0 114.159 179.02 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -68.0 -17.02 46.11 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 123.279 2.653 . . . . 0.0 113.887 -175.644 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 81.7 mt -92.25 4.88 52.35 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.741 1.216 . . . . 0.0 113.837 174.875 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.88 114.96 2.55 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 121.142 1.792 . . . . 0.0 112.061 -178.313 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 92.12 3.55 67.58 Favored Glycine 0 CA--C 1.543 1.792 0 C-N-CA 125.704 1.621 . . . . 0.0 115.592 -173.845 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 5.6 mp -105.09 155.36 37.81 Favored Pre-proline 0 CA--C 1.555 1.147 0 C-N-CA 126.841 2.056 . . . . 0.0 111.26 178.868 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -68.4 162.22 41.55 Favored 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 124.71 3.606 . . . . 0.0 113.459 -170.423 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 14.9 t -102.15 -33.72 3.49 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 O-C-N 121.428 -0.795 . . . . 0.0 112.706 178.329 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 27.1 p -123.98 173.87 7.96 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 125.053 1.341 . . . . 0.0 114.165 -178.618 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 55.4 ttt85 -61.28 -42.1 98.08 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.128 0.971 . . . . 0.0 110.914 173.054 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 32.9 m -61.16 -45.03 96.29 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.908 0.883 . . . . 0.0 110.941 173.353 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 78.2 m-20 -61.11 -47.02 88.19 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 118.644 0.657 . . . . 0.0 111.273 175.595 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.36 -41.24 88.79 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.458 -0.776 . . . . 0.0 112.708 179.461 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.7 tmt_? -65.38 -45.44 84.06 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 118.661 0.664 . . . . 0.0 111.818 174.524 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 76.6 t -62.21 -46.01 97.43 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 CA-C-N 118.712 0.687 . . . . 0.0 111.38 177.787 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -63.84 -44.93 91.71 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 118.099 -0.953 . . . . 0.0 112.375 177.723 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 50.2 mt -53.94 -51.78 42.28 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 CA-C-N 119.684 1.129 . . . . 0.0 109.819 171.319 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.441 ' HB2' ' HE1' ' A' ' 101' ' ' MET . 13.3 t80 -60.65 -52.41 65.27 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.09 0.556 . . . . 0.0 112.196 -176.561 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -78.63 -34.71 46.31 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -171.641 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -63.32 -44.22 95.56 Favored 'General case' 0 N--CA 1.467 0.377 0 O-C-N 121.807 -0.558 . . . . 0.0 110.051 169.861 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.442 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 68.2 t90 -59.41 -48.72 80.55 Favored 'General case' 0 C--O 1.216 -0.7 0 CA-C-O 116.834 -1.555 . . . . 0.0 111.753 170.658 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -51.59 -47.94 63.37 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 121.756 2.071 . . . . 0.0 112.606 179.394 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -68.12 -50.14 56.64 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 118.941 0.791 . . . . 0.0 112.432 178.705 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 90.0 mmt-85 -59.23 -45.14 91.93 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 121.471 -0.768 . . . . 0.0 110.474 178.825 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 47.1 tptt -61.31 -36.27 79.67 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 127.108 2.163 . . . . 0.0 113.078 174.833 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -61.33 -35.34 77.12 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.531 1.06 . . . . 0.0 111.145 169.985 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 60.6 m -80.31 -19.83 45.71 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 115.472 1.656 . . . . 0.0 115.472 167.096 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -142.07 78.71 16.92 Favored Pre-proline 0 N--CA 1.477 0.892 0 C-N-CA 127.004 2.122 . . . . 0.0 111.88 -166.151 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_endo -59.0 -15.81 29.45 Favored 'Trans proline' 0 CA--C 1.545 1.035 0 C-N-CA 123.121 2.547 . . . . 0.0 114.977 -173.487 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 39.4 p90 -78.89 -10.03 59.68 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.932 1.693 . . . . 0.0 115.3 174.917 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 14.6 tp -67.36 134.24 51.13 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 120.389 1.45 . . . . 0.0 113.849 -169.211 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 80.1 ttt180 -86.45 152.68 22.48 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 126.12 1.768 . . . . 0.0 112.494 178.171 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.442 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -131.4 131.49 43.66 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.824 2.05 . . . . 0.0 109.692 -177.05 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -143.49 135.26 26.48 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.945 0.898 . . . . 0.0 111.006 176.488 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.441 ' HE1' ' HB2' ' A' ' 84' ' ' PHE . 63.2 mtt -130.37 21.89 5.19 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.08 1.352 . . . . 0.0 112.782 -176.978 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 32.4 t -63.86 152.53 39.43 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.626 0.771 . . . . 0.0 111.173 173.315 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -52.02 -39.46 59.52 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.964 0.906 . . . . 0.0 112.329 179.349 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -59.32 -37.54 78.01 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.794 1.238 . . . . 0.0 112.78 176.426 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.3 -42.05 99.03 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 118.767 0.712 . . . . 0.0 111.638 176.388 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.26 -46.98 62.68 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 C-N-CA 123.384 0.674 . . . . 0.0 109.735 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 16.6 m-30 -56.11 -45.75 79.37 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 176.457 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.99 -38.31 37.11 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 124.417 1.087 . . . . 0.0 112.631 -172.098 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 56.0 ttt85 -75.7 -36.88 59.9 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.117 0.967 . . . . 0.0 112.631 175.265 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 38.4 m-85 -124.04 80.49 57.67 Favored Pre-proline 0 CA--C 1.545 0.773 0 C-N-CA 125.683 1.593 . . . . 0.0 110.929 -175.439 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -67.75 -9.54 25.86 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 123.326 2.684 . . . . 0.0 114.442 -173.684 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 10.7 p-80 -80.62 -18.54 47.85 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.343 1.057 . . . . 0.0 113.619 170.383 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.58 -10.8 26.4 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 126.666 1.986 . . . . 0.0 113.546 -172.512 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 6.5 ppt_? . . . . . 0 C--O 1.253 1.255 0 C-N-CA 124.621 1.168 . . . . 0.0 113.48 174.531 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 99.5 mtp . . . . . 0 N--CA 1.498 1.958 0 CA-C-O 119.743 -0.17 . . . . 0.0 110.643 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.32 169.28 22.35 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 124.961 1.305 . . . . 0.0 113.308 177.504 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 115.93 113.4 2.83 Favored Glycine 0 CA--C 1.533 1.215 0 C-N-CA 125.57 1.557 . . . . 0.0 113.559 170.293 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 78.0 p -157.38 154.33 28.72 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 126.096 1.758 . . . . 0.0 111.395 173.841 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 55.6 t-80 -153.77 136.75 15.46 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.392 1.077 . . . . 0.0 112.045 176.524 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 13.8 p80 -157.35 143.27 17.62 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.914 1.286 . . . . 0.0 111.666 165.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -160.81 142.86 12.44 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.118 1.367 . . . . 0.0 111.163 165.669 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -156.91 142.9 17.91 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.494 1.118 . . . . 0.0 112.13 167.159 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 48.7 p-80 -152.11 149.75 29.14 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.301 1.44 . . . . 0.0 111.36 164.192 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 44.1 p-80 -156.4 163.53 39.35 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.448 1.099 . . . . 0.0 113.339 176.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 81.49 154.92 12.86 Favored Glycine 0 CA--C 1.538 1.514 0 C-N-CA 125.232 1.396 . . . . 0.0 116.365 166.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 23.3 t -157.86 146.57 19.28 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 126.484 1.914 . . . . 0.0 110.31 172.161 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 22.2 m -140.19 152.92 21.95 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 125.124 1.37 . . . . 0.0 112.884 -176.78 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.6 m -140.97 155.82 46.17 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 125.967 1.707 . . . . 0.0 111.534 178.622 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 60.2 t80 -138.14 76.9 1.6 Allowed 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.645 1.178 . . . . 0.0 111.286 179.247 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -79.47 43.99 2.63 Favored Glycine 0 CA--C 1.537 1.46 0 C-N-CA 125.518 1.532 . . . . 0.0 114.589 -178.852 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -130.88 67.31 80.59 Favored Pre-proline 0 CA--C 1.553 1.084 0 C-N-CA 125.23 1.412 . . . . 0.0 112.953 -172.294 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -71.21 165.76 31.39 Favored 'Trans proline' 0 CA--C 1.544 1.017 0 C-N-CA 123.703 2.936 . . . . 0.0 112.617 174.232 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 61.8 m -129.42 66.41 76.8 Favored Pre-proline 0 N--CA 1.478 0.93 0 C-N-CA 124.93 1.292 . . . . 0.0 112.308 -178.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -70.4 159.24 53.6 Favored 'Trans proline' 0 CA--C 1.543 0.927 0 C-N-CA 123.559 2.839 . . . . 0.0 112.799 178.301 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 58.6 tp -146.05 130.55 17.79 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.033 1.333 . . . . 0.0 111.356 176.598 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 77.7 p -143.13 18.37 1.93 Allowed 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 125.089 1.356 . . . . 0.0 113.964 -177.125 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.0 t -90.11 2.39 55.32 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 114.633 1.345 . . . . 0.0 114.633 -167.397 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -137.4 127.3 25.69 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.832 1.253 . . . . 0.0 111.939 -176.418 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 69.3 m -136.88 62.48 1.6 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.976 2.11 . . . . 0.0 110.338 178.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 61.84 21.28 12.13 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.778 2.031 . . . . 0.0 115.237 -177.541 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -64.06 -25.78 68.26 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 115.106 1.521 . . . . 0.0 115.106 -171.616 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -126.58 5.41 6.82 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.632 1.573 . . . . 0.0 113.217 -179.137 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 47.8 mm -75.18 -31.82 25.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 O-C-N 120.956 -1.09 . . . . 0.0 111.534 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 45.9 m-20 57.23 -169.93 0.1 Allowed 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 126.465 1.906 . . . . 0.0 113.708 175.688 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 15.7 t80 56.11 32.62 20.44 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 125.697 1.599 . . . . 0.0 114.421 176.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 60.2 ttp -78.94 -40.95 30.55 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 121.297 -0.877 . . . . 0.0 112.359 -177.724 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 19.5 p -138.61 57.56 12.01 Favored Pre-proline 0 N--CA 1.481 1.102 0 C-N-CA 125.729 1.612 . . . . 0.0 112.187 -175.282 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -64.18 146.97 91.28 Favored 'Trans proline' 0 CA--C 1.549 1.263 0 C-N-CA 123.117 2.545 . . . . 0.0 112.579 -178.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -76.92 104.63 1.94 Allowed 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 123.5 2.8 . . . . 0.0 111.686 -178.346 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -141.12 149.82 42.04 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 125.468 1.507 . . . . 0.0 111.721 179.608 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -134.58 8.74 3.63 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 114.512 1.301 . . . . 0.0 114.512 178.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -147.14 160.7 42.12 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 126.218 1.807 . . . . 0.0 110.543 177.58 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -139.81 4.3 2.1 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.626 1.57 . . . . 0.0 114.397 -179.77 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -146.67 71.16 12.65 Favored Pre-proline 0 CA--C 1.546 0.795 0 C-N-CA 125.3 1.44 . . . . 0.0 108.794 173.694 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -79.69 138.18 13.28 Favored 'Trans proline' 0 CA--C 1.543 0.954 0 C-N-CA 122.896 2.397 . . . . 0.0 111.505 -176.896 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 77.53 115.88 0.17 Allowed Glycine 0 CA--C 1.537 1.437 0 C-N-CA 124.764 1.173 . . . . 0.0 112.675 -171.83 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -154.81 162.47 41.1 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.948 1.299 . . . . 0.0 112.226 -176.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.2 pp -130.22 167.95 17.61 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.593 1.957 . . . . 0.0 111.683 173.655 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -130.97 126.25 35.53 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.13 0.972 . . . . 0.0 111.883 174.255 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -83.67 143.95 29.73 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.348 1.059 . . . . 0.0 110.908 169.18 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 59.0 mt -128.08 157.66 40.1 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.336 1.054 . . . . 0.0 112.65 -169.496 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -79.2 138.82 38.0 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.22 1.008 . . . . 0.0 110.193 166.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -95.85 -15.3 22.57 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 114.658 1.355 . . . . 0.0 114.658 -173.773 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -150.28 169.4 21.45 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.721 1.209 . . . . 0.0 113.105 -172.242 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 72.49 -163.67 54.68 Favored Glycine 0 CA--C 1.54 1.65 0 C-N-CA 124.169 0.89 . . . . 0.0 114.041 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -67.63 -16.94 47.82 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 123.173 2.582 . . . . 0.0 113.713 -176.747 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.3 mt -94.01 5.88 50.28 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.723 1.209 . . . . 0.0 113.931 175.668 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.12 123.33 13.31 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 120.91 1.687 . . . . 0.0 112.387 -177.2 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 81.78 3.58 90.56 Favored Glycine 0 CA--C 1.54 1.641 0 C-N-CA 125.523 1.535 . . . . 0.0 115.323 -175.015 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 16.4 mt -101.46 162.1 21.53 Favored Pre-proline 0 CA--C 1.556 1.208 0 C-N-CA 126.145 1.778 . . . . 0.0 110.926 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -76.8 159.35 34.83 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 124.269 3.312 . . . . 0.0 113.562 -164.557 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 42.4 t -96.55 -33.85 4.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 CA-C-O 118.621 -0.704 . . . . 0.0 112.743 174.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 16.2 p -124.5 172.18 9.4 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 114.707 1.373 . . . . 0.0 114.707 -178.157 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 13.6 ptp180 -63.65 -35.03 79.19 Favored 'General case' 0 N--CA 1.482 1.125 0 O-C-N 121.358 -0.839 . . . . 0.0 112.052 174.72 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.0 t -64.98 -46.58 80.86 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.427 0.691 . . . . 0.0 110.411 171.134 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -59.78 -42.64 93.81 Favored 'General case' 0 CA--C 1.539 0.538 0 O-C-N 121.658 -0.651 . . . . 0.0 111.616 177.141 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.01 -43.66 94.98 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 123.957 0.903 . . . . 0.0 113.035 177.191 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.6 tmt_? -64.49 -43.61 93.6 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 119.311 0.959 . . . . 0.0 111.668 176.495 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 77.5 t -63.13 -44.34 99.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 123.605 0.762 . . . . 0.0 110.983 176.803 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 20.4 mt -57.89 -51.26 70.34 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 118.113 -0.946 . . . . 0.0 112.103 173.848 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 65.7 mt -54.37 -50.12 59.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 CA-C-N 119.25 0.932 . . . . 0.0 110.365 177.274 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.438 ' HB2' ' HE1' ' A' ' 101' ' ' MET . 16.0 t80 -64.19 -47.8 78.36 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 -178.104 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -70.45 -42.84 70.98 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 119.131 0.878 . . . . 0.0 112.466 -177.705 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -56.22 -54.79 41.06 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 124.286 1.034 . . . . 0.0 110.073 172.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.443 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 68.4 t90 -61.07 -45.37 95.03 Favored 'General case' 0 C--O 1.219 -0.505 0 CA-C-O 117.755 -1.117 . . . . 0.0 111.934 177.674 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -55.49 -47.69 75.76 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 120.562 1.528 . . . . 0.0 112.433 178.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -70.65 -48.44 54.92 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 119.524 1.056 . . . . 0.0 112.521 178.423 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.5 mmp_? -55.34 -49.8 71.3 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.063 0.545 . . . . 0.0 110.48 177.375 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.8 tmtt? -69.79 -29.23 66.49 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.882 1.673 . . . . 0.0 113.637 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 34.0 ttpt -58.92 -37.1 75.89 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.965 1.257 . . . . 0.0 110.851 165.583 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 68.3 m -81.89 -22.57 36.79 Favored 'General case' 0 N--CA 1.481 1.106 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 168.142 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -139.92 73.06 33.9 Favored Pre-proline 0 N--CA 1.477 0.916 0 C-N-CA 126.669 1.988 . . . . 0.0 111.534 -164.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -62.05 -6.68 8.34 Favored 'Trans proline' 0 CA--C 1.546 1.099 0 C-N-CA 124.095 3.196 . . . . 0.0 116.5 -165.168 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 37.7 p90 -83.9 -11.58 56.71 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 126.458 1.903 . . . . 0.0 114.875 175.203 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.5 tp -65.54 136.55 56.54 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 -167.185 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 27.2 mmm180 -84.23 156.07 22.18 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 124.886 1.275 . . . . 0.0 112.798 179.39 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.443 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -138.75 127.46 23.45 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 126.224 1.81 . . . . 0.0 110.1 -175.636 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -150.17 139.66 21.49 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.604 1.161 . . . . 0.0 111.772 177.349 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.438 ' HE1' ' HB2' ' A' ' 84' ' ' PHE . 62.6 mtt -135.01 11.04 3.6 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 114.098 1.148 . . . . 0.0 114.098 -167.751 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 29.8 m -63.02 155.02 28.8 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.117 0.967 . . . . 0.0 111.541 177.039 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -55.23 -36.31 65.86 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 121.09 -1.007 . . . . 0.0 113.448 -171.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -60.86 -34.16 74.18 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.964 0.905 . . . . 0.0 112.841 175.702 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.05 -41.84 98.55 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 119.071 0.851 . . . . 0.0 111.56 174.712 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.6 mp -71.34 -45.94 67.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 C-N-CA 123.855 0.862 . . . . 0.0 109.413 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 15.5 m-30 -56.21 -47.02 79.22 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 118.746 0.703 . . . . 0.0 112.693 174.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.9 tmt_? -76.0 -38.18 57.64 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.582 1.153 . . . . 0.0 112.366 -172.14 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 6.1 ttm180 -75.18 -41.28 58.32 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.675 0.79 . . . . 0.0 112.249 173.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 38.7 m-85 -124.6 81.43 60.3 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 126.028 1.731 . . . . 0.0 111.027 -173.009 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -66.28 -17.48 54.25 Favored 'Trans proline' 0 CA--C 1.539 0.75 0 C-N-CA 123.114 2.543 . . . . 0.0 114.499 -171.297 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 10.2 p-80 -74.25 -22.89 59.12 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.875 0.87 . . . . 0.0 113.299 173.526 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -84.32 -15.04 47.99 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 125.819 1.648 . . . . 0.0 113.162 -175.748 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 57.8 ttp180 . . . . . 0 C--O 1.254 1.299 0 C-N-CA 124.501 1.12 . . . . 0.0 111.985 174.018 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 99.0 mtp . . . . . 0 N--CA 1.497 1.921 0 N-CA-C 110.852 -0.055 . . . . 0.0 110.852 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 17.9 tpt180 -146.91 149.63 33.6 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 125.086 1.354 . . . . 0.0 111.494 179.496 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 76.65 177.84 45.13 Favored Glycine 0 CA--C 1.54 1.601 0 C-N-CA 124.615 1.102 . . . . 0.0 114.728 179.06 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 71.3 p -81.38 155.02 26.14 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.027 1.331 . . . . 0.0 113.239 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 32.4 p80 -138.48 6.97 2.55 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 114.987 1.477 . . . . 0.0 114.987 -173.289 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 56.2 t-80 -130.32 136.81 49.52 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.907 1.283 . . . . 0.0 112.214 -177.72 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 63.6 m80 -145.24 154.79 42.75 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.971 1.708 . . . . 0.0 111.358 -177.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 58.1 t-80 -148.31 142.2 25.77 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.586 1.154 . . . . 0.0 112.157 177.782 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 77.7 t60 -156.75 147.86 22.04 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.859 1.264 . . . . 0.0 112.647 177.462 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 24.9 m170 -139.13 132.39 29.91 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.964 1.706 . . . . 0.0 110.209 164.118 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -113.37 -1.14 24.9 Favored Glycine 0 CA--C 1.538 1.469 0 N-CA-C 116.613 1.405 . . . . 0.0 116.613 -171.02 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 78.8 p -146.49 153.1 40.03 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 119.401 1.6 . . . . 0.0 114.153 -172.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.8 p -156.4 148.11 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 126.263 1.825 . . . . 0.0 110.718 175.607 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 79.2 p -150.87 151.69 32.59 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.81 1.244 . . . . 0.0 112.552 174.627 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 38.6 t80 -153.9 155.87 36.5 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.082 1.353 . . . . 0.0 111.739 176.883 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -77.1 172.83 55.08 Favored Glycine 0 CA--C 1.539 1.568 0 C-N-CA 124.411 1.005 . . . . 0.0 114.801 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -148.13 148.42 29.41 Favored Pre-proline 0 CA--C 1.551 1.007 0 C-N-CA 125.076 1.35 . . . . 0.0 111.826 174.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -74.53 118.33 5.29 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 123.247 2.632 . . . . 0.0 111.708 178.512 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 68.6 m -139.2 61.63 21.67 Favored Pre-proline 0 N--CA 1.476 0.856 0 C-N-CA 125.068 1.347 . . . . 0.0 111.92 -179.58 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -66.22 126.39 15.63 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 123.2 2.6 . . . . 0.0 111.904 -178.603 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 21.9 tp -141.58 -3.35 1.16 Allowed 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 124.524 1.13 . . . . 0.0 113.963 -175.013 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 21.4 m -64.59 138.35 58.35 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.482 1.113 . . . . 0.0 113.202 -173.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 65.4 p -90.94 -16.56 27.87 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -178.565 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.1 pp20? -77.82 160.84 28.07 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 124.499 1.12 . . . . 0.0 113.6 179.198 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 81.4 p -122.05 20.73 10.68 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 125.816 1.646 . . . . 0.0 114.074 -170.153 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 60.64 -7.92 0.07 Allowed 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 127.805 2.442 . . . . 0.0 116.391 -170.823 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -64.19 -25.49 68.1 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 120.858 -1.151 . . . . 0.0 113.998 -177.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -92.67 -11.16 34.83 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.229 1.412 . . . . 0.0 114.604 176.81 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 44.7 mm -83.7 96.93 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 124.305 1.042 . . . . 0.0 110.031 -173.189 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 26.9 m-80 -106.37 -18.56 13.95 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.733 1.213 . . . . 0.0 113.724 -177.33 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 89.5 m-85 -140.86 157.85 44.8 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.746 1.618 . . . . 0.0 111.417 -177.229 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 44.2 tpp -144.84 -42.83 0.24 Allowed 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 177.597 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 21.1 p -130.46 59.26 44.38 Favored Pre-proline 0 N--CA 1.481 1.078 0 C-N-CA 125.23 1.412 . . . . 0.0 112.719 -177.601 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_endo -64.92 156.44 62.28 Favored 'Trans proline' 0 CA--C 1.55 1.308 0 C-N-CA 123.108 2.539 . . . . 0.0 112.515 176.331 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -69.13 149.13 70.57 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 123.481 2.787 . . . . 0.0 113.041 -178.357 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -140.0 13.5 2.45 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 114.394 1.257 . . . . 0.0 114.394 -175.493 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 61.1 tt0 -63.67 -29.63 70.84 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 120.899 -1.126 . . . . 0.0 113.782 -168.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -86.78 -10.77 52.81 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.204 1.001 . . . . 0.0 113.366 179.079 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -81.62 40.77 0.6 Allowed 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.344 1.458 . . . . 0.0 113.635 -172.43 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -148.28 69.34 10.57 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 125.449 1.5 . . . . 0.0 110.096 -177.214 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -81.03 -17.27 9.48 Favored 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 122.899 2.399 . . . . 0.0 114.198 -170.12 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 69.93 22.18 76.99 Favored Glycine 0 CA--C 1.537 1.443 0 N-CA-C 115.348 0.899 . . . . 0.0 115.348 173.863 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -142.92 154.2 43.85 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.301 1.44 . . . . 0.0 112.326 -176.017 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -122.99 170.5 10.07 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 127.082 2.153 . . . . 0.0 112.324 179.362 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -131.44 139.5 49.4 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.343 1.057 . . . . 0.0 113.217 178.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -91.24 163.47 14.23 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.642 1.577 . . . . 0.0 111.408 165.357 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 96.7 mt -136.64 157.18 47.38 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 125.147 1.379 . . . . 0.0 112.18 -176.337 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 84.8 m-70 -80.82 144.13 32.28 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.681 0.792 . . . . 0.0 109.906 162.362 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -109.01 -6.11 15.79 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.631 1.345 . . . . 0.0 114.631 -173.591 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -147.54 164.59 32.94 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.904 1.282 . . . . 0.0 112.917 -175.33 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 69.23 -161.77 52.07 Favored Glycine 0 CA--C 1.541 1.681 0 C-N-CA 123.888 0.756 . . . . 0.0 113.892 -179.52 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -68.09 -15.93 43.89 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 123.212 2.608 . . . . 0.0 113.752 -177.525 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 81.3 mt -92.49 4.2 53.98 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.815 1.246 . . . . 0.0 113.924 175.501 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.27 113.27 1.87 Allowed 'General case' 0 CA--C 1.548 0.893 0 CA-C-N 121.048 1.749 . . . . 0.0 111.807 -179.561 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.32 9.76 62.95 Favored Glycine 0 CA--C 1.542 1.743 0 C-N-CA 125.179 1.371 . . . . 0.0 115.676 -173.263 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 5.3 mp -111.84 156.56 41.46 Favored Pre-proline 0 CA--C 1.556 1.19 0 C-N-CA 126.911 2.084 . . . . 0.0 111.545 178.804 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -63.17 162.21 27.38 Favored 'Trans proline' 0 C--N 1.356 0.921 0 C-N-CA 125.056 3.837 . . . . 0.0 114.33 -172.809 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 8.2 t -105.5 -30.04 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 123.666 0.786 . . . . 0.0 111.824 172.409 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 26.6 p -126.9 170.71 11.96 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 125.087 1.355 . . . . 0.0 114.237 -178.117 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 42.9 ttm-85 -60.37 -41.4 93.65 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.011 0.924 . . . . 0.0 110.848 172.768 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 28.4 m -60.47 -45.45 93.69 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.903 0.881 . . . . 0.0 111.017 173.718 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -59.78 -49.32 78.19 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 118.443 0.565 . . . . 0.0 110.9 175.427 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.03 -43.73 98.46 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.633 0.773 . . . . 0.0 112.637 -177.847 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 73.0 ttt180 -68.91 -40.94 78.8 Favored 'General case' 0 N--CA 1.478 0.935 0 O-C-N 121.213 -0.929 . . . . 0.0 112.497 178.1 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 77.3 t -64.76 -42.22 94.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 CA-C-N 118.365 0.529 . . . . 0.0 111.192 175.389 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 87.4 mt -65.54 -41.56 92.9 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 118.179 -0.915 . . . . 0.0 112.541 176.267 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 47.7 mt -53.65 -50.89 47.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 CA-C-N 119.368 0.986 . . . . 0.0 109.729 169.794 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -64.19 -46.63 83.1 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 113.255 0.835 . . . . 0.0 113.255 -178.241 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -69.96 -44.41 69.56 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.136 0.975 . . . . 0.0 112.598 -176.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -61.04 -52.11 66.36 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 118.554 -0.736 . . . . 0.0 110.117 172.747 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.422 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 61.7 t90 -56.06 -46.44 78.93 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-N 119.452 1.024 . . . . 0.0 112.126 177.004 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -51.75 -55.36 20.13 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 119.72 1.145 . . . . 0.0 112.459 176.248 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -74.25 -42.97 58.81 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 121.137 -0.977 . . . . 0.0 112.822 -175.647 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 35.7 mmt180 -57.29 -45.34 84.21 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.296 0.638 . . . . 0.0 109.835 174.81 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.9 tmtt? -69.72 -32.18 70.6 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.106 0.962 . . . . 0.0 113.516 178.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 66.4 mttt -61.89 -31.14 71.4 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 119.761 1.164 . . . . 0.0 111.715 167.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 70.6 m -81.82 -24.21 36.01 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 115.14 1.533 . . . . 0.0 115.14 165.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -142.49 78.97 15.86 Favored Pre-proline 0 CA--C 1.55 0.949 0 C-N-CA 126.819 2.048 . . . . 0.0 111.561 -166.136 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -62.21 -5.08 5.97 Favored 'Trans proline' 0 CA--C 1.547 1.161 0 C-N-CA 123.707 2.938 . . . . 0.0 116.566 -167.005 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 39.5 p90 -88.04 -3.53 58.89 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.815 2.046 . . . . 0.0 115.065 175.75 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.84 141.82 43.3 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-N 119.96 1.255 . . . . 0.0 113.447 -177.634 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 1.9 mpp_? -103.24 153.82 19.99 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 125.255 1.422 . . . . 0.0 112.412 174.301 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.422 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.3 tm? -127.37 128.11 45.32 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.837 1.655 . . . . 0.0 110.264 -173.857 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 58.4 t0 -143.25 128.7 19.01 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.355 1.062 . . . . 0.0 110.956 179.203 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 65.3 mtt -127.47 10.76 6.75 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.459 1.504 . . . . 0.0 113.127 -177.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 72.6 m -68.14 152.44 45.48 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 121.42 -0.8 . . . . 0.0 111.383 172.19 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -57.21 -34.58 68.68 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -166.14 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 33.7 mmtp -59.12 -37.28 76.83 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.002 0.921 . . . . 0.0 112.484 177.03 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.38 -37.25 82.7 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.546 0.739 . . . . 0.0 111.844 173.073 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 2.5 mm -75.18 -44.0 43.69 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 C-N-CA 123.374 0.67 . . . . 0.0 109.396 -175.31 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 10.2 m-30 -60.86 -45.39 94.72 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 123.088 0.555 . . . . 0.0 112.106 174.405 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 6.5 tmm_? -74.15 -35.14 64.05 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.126 0.971 . . . . 0.0 112.52 -173.14 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 73.4 mtp85 -74.78 -40.61 61.07 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.702 0.801 . . . . 0.0 112.564 170.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 34.3 m-85 -130.3 77.38 76.29 Favored Pre-proline 0 CA--C 1.545 0.785 0 C-N-CA 125.594 1.558 . . . . 0.0 111.266 -169.164 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -66.51 -16.85 52.31 Favored 'Trans proline' 0 CA--C 1.539 0.767 0 C-N-CA 123.077 2.518 . . . . 0.0 113.979 -173.786 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 12.1 p-80 -74.05 -22.39 59.56 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.278 1.031 . . . . 0.0 113.495 172.763 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.47 -19.57 27.8 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 125.986 1.715 . . . . 0.0 112.753 -172.584 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 . . . . . 0 C--O 1.256 1.411 0 C-N-CA 124.625 1.17 . . . . 0.0 112.202 174.738 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 59.8 ttm . . . . . 0 N--CA 1.496 1.833 0 CA-C-O 119.793 -0.146 . . . . 0.0 110.741 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 39.2 ptt85 -135.19 146.74 49.0 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 125.187 1.395 . . . . 0.0 112.487 175.533 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -82.86 -21.66 59.1 Favored Glycine 0 CA--C 1.536 1.373 0 C-N-CA 124.243 0.925 . . . . 0.0 113.958 173.483 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 45.1 m -82.71 119.37 24.24 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.611 1.164 . . . . 0.0 112.319 -177.01 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 14.0 p80 -154.54 155.76 35.39 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.89 1.676 . . . . 0.0 111.198 168.385 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 71.7 m80 -87.81 67.8 9.21 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.854 1.262 . . . . 0.0 112.11 -172.87 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 55.9 t-80 -64.79 138.73 58.56 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.876 0.87 . . . . 0.0 112.756 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 6.8 p80 -153.64 161.94 41.7 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.041 1.736 . . . . 0.0 110.846 173.149 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 21.3 p80 -69.16 145.72 53.05 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -178.275 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 41.7 t60 -140.17 34.46 1.91 Allowed 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.323 1.049 . . . . 0.0 112.803 -172.118 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -67.76 151.96 52.34 Favored Glycine 0 CA--C 1.538 1.471 0 C-N-CA 124.087 0.851 . . . . 0.0 113.55 178.866 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 88.6 p -147.67 158.79 44.17 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.183 1.393 . . . . 0.0 112.79 -179.284 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.3 p -150.89 148.51 14.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 125.391 1.476 . . . . 0.0 111.027 178.608 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.2 t -148.18 141.74 25.44 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.623 1.169 . . . . 0.0 111.668 175.296 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -152.3 154.51 35.83 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.713 1.605 . . . . 0.0 110.912 176.416 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 173.62 -154.81 20.84 Favored Glycine 0 CA--C 1.534 1.276 0 C-N-CA 123.702 0.668 . . . . 0.0 114.148 -178.837 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . 50.71 56.43 17.23 Favored Pre-proline 0 CA--C 1.557 1.243 0 C-N-CA 126.323 1.849 . . . . 0.0 114.981 -179.563 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -66.75 159.44 51.26 Favored 'Trans proline' 0 CA--C 1.544 0.981 0 C-N-CA 123.242 2.628 . . . . 0.0 112.328 174.346 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 37.3 p -136.57 56.78 14.33 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 124.835 1.254 . . . . 0.0 113.863 -173.775 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -64.67 143.29 80.44 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 123.208 2.605 . . . . 0.0 112.233 177.051 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 58.2 tp -153.34 142.65 21.55 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.86 1.264 . . . . 0.0 111.715 -177.605 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 66.5 p -145.57 140.69 27.6 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.201 1.4 . . . . 0.0 111.354 168.125 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.4 m -141.02 13.22 2.24 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 -169.045 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -148.1 156.35 42.51 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.672 1.189 . . . . 0.0 113.466 -170.435 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 19.4 t -154.55 148.39 25.54 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.471 1.508 . . . . 0.0 111.156 175.014 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 56.95 24.25 9.19 Favored 'General case' 0 CA--C 1.552 1.019 0 C-N-CA 125.676 1.59 . . . . 0.0 114.712 178.114 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -75.7 -24.8 56.26 Favored 'General case' 0 N--CA 1.475 0.799 0 O-C-N 120.816 -1.177 . . . . 0.0 113.918 -174.779 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -130.93 6.0 4.6 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.624 1.57 . . . . 0.0 114.693 -175.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 53.8 mt -81.27 103.94 9.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 O-C-N 121.278 -0.889 . . . . 0.0 109.746 -176.378 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 59.5 t-20 -150.15 130.34 13.62 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.582 1.553 . . . . 0.0 110.486 177.905 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 35.1 t80 -104.42 -5.49 21.62 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.024 1.33 . . . . 0.0 113.851 -179.401 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 93.7 mtp -80.65 -3.93 52.36 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 114.684 1.365 . . . . 0.0 114.684 -170.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.5 t -120.08 111.63 35.35 Favored Pre-proline 0 N--CA 1.476 0.869 0 C-N-CA 124.849 1.26 . . . . 0.0 111.616 -179.302 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -85.12 162.2 11.55 Favored 'Trans proline' 0 CA--C 1.549 1.252 0 C-N-CA 123.703 2.935 . . . . 0.0 112.851 -179.671 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -82.74 14.67 2.25 Favored 'Trans proline' 0 CA--C 1.548 1.214 0 C-N-CA 124.443 3.429 . . . . 0.0 114.788 -175.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -68.21 -23.9 64.88 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 114.76 1.393 . . . . 0.0 114.76 -169.828 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -152.13 145.22 24.56 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.412 1.485 . . . . 0.0 111.238 177.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 31.0 mp0 -68.89 -46.19 68.99 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.088 0.955 . . . . 0.0 112.343 -178.317 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 50.07 37.72 15.0 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 126.013 1.725 . . . . 0.0 115.08 170.034 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 61.7 tt0 -154.65 75.65 5.62 Favored Pre-proline 0 CA--C 1.547 0.837 0 C-N-CA 124.758 1.223 . . . . 0.0 109.697 -173.306 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -81.16 -16.58 9.68 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 122.585 2.19 . . . . 0.0 114.147 -167.373 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 66.75 32.57 81.65 Favored Glycine 0 CA--C 1.537 1.407 0 N-CA-C 115.42 0.928 . . . . 0.0 115.42 167.106 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -134.16 152.69 51.95 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.211 1.404 . . . . 0.0 112.474 -175.208 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -96.87 168.45 10.48 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 126.383 1.873 . . . . 0.0 112.323 172.508 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -118.17 123.66 46.07 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.332 1.053 . . . . 0.0 112.032 173.376 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -84.61 144.05 28.86 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.437 1.095 . . . . 0.0 110.7 166.693 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.4 mt -128.05 157.55 40.38 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.408 1.083 . . . . 0.0 112.441 -169.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -78.07 138.72 38.91 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.896 0.879 . . . . 0.0 110.044 166.846 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -94.09 -22.75 18.3 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 114.321 1.23 . . . . 0.0 114.321 -175.209 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -140.68 165.91 26.19 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.99 1.316 . . . . 0.0 112.855 -170.056 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.37 -163.14 54.81 Favored Glycine 0 CA--C 1.54 1.599 0 C-N-CA 124.247 0.927 . . . . 0.0 114.201 177.618 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -67.49 -17.08 48.62 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 123.314 2.676 . . . . 0.0 113.754 -176.016 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.5 mt -93.94 5.0 53.1 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.662 1.185 . . . . 0.0 113.782 175.641 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.32 123.69 14.64 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 120.936 1.698 . . . . 0.0 112.282 -177.06 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 82.58 3.04 90.68 Favored Glycine 0 CA--C 1.541 1.664 0 C-N-CA 125.631 1.586 . . . . 0.0 115.321 -174.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.402 ' HB3' ' HD2' ' A' ' 73' ' ' PRO . 18.0 mt -102.1 161.63 22.8 Favored Pre-proline 0 CA--C 1.556 1.184 0 C-N-CA 126.057 1.743 . . . . 0.0 111.087 -179.214 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.402 ' HD2' ' HB3' ' A' ' 72' ' ' LEU . 73.5 Cg_endo -77.06 156.65 34.05 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 124.208 3.272 . . . . 0.0 113.837 -164.822 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 39.2 t -94.73 -35.73 6.37 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 O-C-N 121.569 -0.707 . . . . 0.0 112.82 176.45 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 19.9 p -123.44 172.67 8.53 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 125.229 1.412 . . . . 0.0 114.017 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 47.7 ttp180 -64.7 -36.43 84.26 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 121.11 -0.994 . . . . 0.0 110.97 174.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 30.4 m -60.53 -44.27 96.25 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.476 0.71 . . . . 0.0 110.937 170.507 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 -63.19 -43.67 97.56 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.48 -0.762 . . . . 0.0 111.74 176.238 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.6 -41.45 96.22 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 118.79 0.723 . . . . 0.0 112.743 177.372 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 22.9 tpp85 -61.75 -45.89 91.98 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.096 1.359 . . . . 0.0 111.762 175.047 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 73.4 t -65.08 -44.14 95.76 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 123.705 0.802 . . . . 0.0 111.11 177.247 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 17.9 mt -56.46 -49.71 73.81 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 118.603 -0.713 . . . . 0.0 111.997 173.435 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 51.8 mt -54.24 -52.05 42.02 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 CA-C-N 118.573 0.624 . . . . 0.0 110.322 176.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 22.5 t80 -66.6 -47.19 73.45 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -177.347 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -68.33 -45.47 72.82 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 118.722 0.692 . . . . 0.0 112.244 -177.552 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 58.1 mm-40 -60.51 -51.4 69.62 Favored 'General case' 0 C--N 1.342 0.248 0 CA-C-O 118.38 -0.819 . . . . 0.0 109.926 174.278 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.445 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 67.5 t90 -56.6 -43.61 80.3 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 119.797 1.18 . . . . 0.0 112.598 177.63 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -59.04 -49.64 77.1 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 119.849 1.204 . . . . 0.0 113.109 177.009 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -71.56 -46.31 59.78 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 119.673 1.124 . . . . 0.0 112.471 -179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 33.4 mmt180 -58.8 -44.6 90.83 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.752 0.821 . . . . 0.0 109.721 176.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 74.5 tttt -70.8 -29.41 65.59 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 176.46 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -59.47 -35.2 73.64 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 119.922 1.237 . . . . 0.0 110.857 166.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 8.4 t -78.22 -32.9 50.12 Favored 'General case' 0 CA--C 1.553 1.088 0 N-CA-C 114.617 1.34 . . . . 0.0 114.617 167.116 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -132.97 77.82 67.22 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 127.196 2.198 . . . . 0.0 112.198 -166.627 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -63.9 5.79 0.34 Allowed 'Trans proline' 0 CA--C 1.549 1.247 0 C-N-CA 124.697 3.598 . . . . 0.0 117.532 -165.194 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 31.2 p90 -99.78 -6.01 27.67 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 127.306 2.242 . . . . 0.0 114.806 177.88 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 13.1 tp -65.77 139.51 58.35 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 115.224 1.565 . . . . 0.0 115.224 -167.011 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 11.6 ptp85 -90.02 157.74 17.67 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 125.834 1.653 . . . . 0.0 113.788 176.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.445 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.4 tm? -137.95 130.95 30.13 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 126.935 2.094 . . . . 0.0 109.924 -172.348 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -142.03 136.65 30.45 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.288 1.035 . . . . 0.0 110.632 172.398 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 61.9 mtt -123.61 5.76 8.89 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.912 1.285 . . . . 0.0 114.268 -172.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 35.0 t -63.74 148.22 49.7 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 119.011 0.823 . . . . 0.0 111.557 178.479 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -53.82 -31.86 50.76 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 121.202 -0.937 . . . . 0.0 112.813 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 53.8 tptt -54.93 -41.24 70.78 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.956 1.302 . . . . 0.0 112.623 172.748 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.68 -36.41 83.77 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.159 0.983 . . . . 0.0 112.263 176.363 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.9 mp -74.35 -46.51 43.6 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 C-N-CA 124.185 0.994 . . . . 0.0 109.458 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -56.43 -44.74 80.69 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 119.076 0.853 . . . . 0.0 112.132 174.596 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.3 tmt_? -72.4 -40.55 67.12 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 124.576 1.15 . . . . 0.0 112.26 -174.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 73.4 mtt85 -72.04 -38.75 69.46 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 173.091 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -131.48 79.39 69.54 Favored Pre-proline 0 CA--C 1.545 0.753 0 C-N-CA 125.584 1.553 . . . . 0.0 110.822 -166.6 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -66.85 -16.05 48.88 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 123.064 2.509 . . . . 0.0 113.986 -173.606 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 12.1 p-80 -73.49 -23.94 60.11 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.052 0.941 . . . . 0.0 113.134 172.507 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.44 -27.99 37.83 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.579 1.552 . . . . 0.0 112.3 -173.201 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 51.8 ttt85 . . . . . 0 C--O 1.255 1.359 0 C-N-CA 124.69 1.196 . . . . 0.0 112.288 175.357 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.9 ptt? . . . . . 0 N--CA 1.498 1.96 0 CA-C-O 121.043 0.449 . . . . 0.0 111.786 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -150.67 164.18 36.73 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.944 1.298 . . . . 0.0 112.883 178.347 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 83.01 154.57 16.52 Favored Glycine 0 CA--C 1.537 1.434 0 C-N-CA 125.24 1.4 . . . . 0.0 114.412 179.094 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 66.5 m -145.15 160.96 40.62 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 125.798 1.639 . . . . 0.0 112.15 -175.046 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 63.9 m80 -128.57 152.45 48.3 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.531 1.532 . . . . 0.0 111.352 175.233 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 34.6 p-80 -136.62 175.86 9.22 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.388 1.475 . . . . 0.0 113.402 -168.855 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 45.3 t60 55.87 48.46 18.01 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 125.849 1.66 . . . . 0.0 113.842 177.281 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 93.4 m-70 -77.76 -20.66 53.03 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.27 1.028 . . . . 0.0 113.642 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 51.3 m80 -78.11 140.32 39.05 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.104 1.362 . . . . 0.0 113.055 -170.487 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 21.4 p80 -153.89 160.62 42.22 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.445 1.498 . . . . 0.0 111.565 174.371 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 162.48 164.5 17.6 Favored Glycine 0 CA--C 1.535 1.297 0 C-N-CA 124.069 0.842 . . . . 0.0 114.123 176.312 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.6 t -152.89 154.66 35.52 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 125.507 1.523 . . . . 0.0 111.088 174.131 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 9.7 p -83.73 143.77 11.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 124.444 1.098 . . . . 0.0 112.02 -178.726 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 50.4 m -79.44 152.94 30.02 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.04 0.936 . . . . 0.0 112.379 175.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -124.55 146.8 48.81 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.937 1.295 . . . . 0.0 111.566 176.403 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 72.56 177.19 30.65 Favored Glycine 0 CA--C 1.539 1.546 0 C-N-CA 123.993 0.806 . . . . 0.0 113.73 -169.449 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -149.27 151.32 33.66 Favored Pre-proline 0 CA--C 1.55 0.952 0 C-N-CA 125.033 1.333 . . . . 0.0 111.929 179.402 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.48 149.33 68.54 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 123.209 2.606 . . . . 0.0 112.219 175.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 49.8 m -75.01 147.58 83.76 Favored Pre-proline 0 N--CA 1.474 0.728 0 C-N-CA 123.921 0.888 . . . . 0.0 112.791 -178.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -71.06 164.82 34.43 Favored 'Trans proline' 0 CA--C 1.543 0.95 0 C-N-CA 123.522 2.815 . . . . 0.0 112.322 172.254 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.3 tt -136.34 127.71 28.4 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.975 1.31 . . . . 0.0 110.836 178.159 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 31.2 m -139.8 29.71 2.1 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.286 1.435 . . . . 0.0 112.591 -173.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.5 m -74.39 -10.07 59.21 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 115.921 1.823 . . . . 0.0 115.921 -164.076 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -129.08 136.09 49.78 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.939 1.296 . . . . 0.0 111.884 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 81.7 p -158.54 166.66 31.61 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.425 1.49 . . . . 0.0 112.575 -177.361 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 61.12 21.35 11.76 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 115.35 1.611 . . . . 0.0 115.35 172.292 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -74.45 -19.61 60.33 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 120.769 -1.207 . . . . 0.0 114.158 -175.009 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -137.89 13.37 2.9 Favored 'General case' 0 CA--C 1.553 1.058 0 C-N-CA 125.416 1.486 . . . . 0.0 113.41 -177.656 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 44.8 mm -100.03 136.77 29.93 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.816 1.247 . . . . 0.0 111.796 -171.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 54.3 t30 58.15 49.06 11.94 Favored 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 126.207 1.803 . . . . 0.0 114.679 174.5 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -114.55 29.35 8.09 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.295 1.438 . . . . 0.0 113.169 175.168 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 1.5 pmm? -130.1 153.15 48.78 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 126.064 1.746 . . . . 0.0 112.607 -179.349 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 18.3 p -137.57 65.35 47.5 Favored Pre-proline 0 N--CA 1.481 1.104 0 C-N-CA 125.173 1.389 . . . . 0.0 112.685 -170.618 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -63.66 156.14 59.04 Favored 'Trans proline' 0 CA--C 1.549 1.274 0 C-N-CA 123.039 2.492 . . . . 0.0 112.646 174.575 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -74.18 119.39 5.79 Favored 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 123.27 2.647 . . . . 0.0 112.304 -176.699 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -138.45 144.82 40.28 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.656 1.582 . . . . 0.0 111.55 179.454 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 82.6 mt-30 -131.25 15.23 5.09 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 124.819 1.248 . . . . 0.0 113.488 -178.106 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 55.52 29.89 14.2 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 125.544 1.538 . . . . 0.0 113.895 -175.44 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -130.38 69.59 1.45 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.11 1.764 . . . . 0.0 110.709 -174.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -146.25 73.66 13.09 Favored Pre-proline 0 CA--C 1.545 0.778 0 C-N-CA 125.254 1.422 . . . . 0.0 109.129 -178.127 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -81.28 73.93 5.7 Favored 'Trans proline' 0 CA--C 1.542 0.912 0 C-N-CA 123.973 3.116 . . . . 0.0 110.8 -171.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 92.58 151.63 27.91 Favored Glycine 0 CA--C 1.538 1.491 0 C-N-CA 125.423 1.487 . . . . 0.0 112.253 -163.645 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -125.46 21.71 7.81 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.971 1.308 . . . . 0.0 113.894 -169.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -72.79 154.9 40.44 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.997 1.319 . . . . 0.0 111.348 176.32 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -143.16 151.51 40.74 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.406 1.483 . . . . 0.0 112.804 175.417 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -95.23 150.52 20.14 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.981 1.312 . . . . 0.0 112.137 173.686 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 91.5 mt -130.43 157.62 42.11 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.623 1.569 . . . . 0.0 111.675 -179.164 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -79.06 141.26 37.55 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.102 0.961 . . . . 0.0 110.463 168.004 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -100.25 -11.85 20.02 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 -173.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -149.41 167.83 25.08 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.791 1.236 . . . . 0.0 113.233 -172.781 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.41 -163.62 54.11 Favored Glycine 0 CA--C 1.54 1.647 0 C-N-CA 124.16 0.886 . . . . 0.0 114.014 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -67.64 -16.56 46.97 Favored 'Trans proline' 0 CA--C 1.542 0.882 0 C-N-CA 123.262 2.642 . . . . 0.0 113.686 -177.653 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.0 mt -92.89 4.66 53.51 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.702 1.201 . . . . 0.0 113.873 175.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.63 122.62 11.76 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 120.874 1.67 . . . . 0.0 112.016 -177.661 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.2 5.06 89.35 Favored Glycine 0 CA--C 1.541 1.704 0 C-N-CA 125.399 1.476 . . . . 0.0 115.404 -174.537 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 18.7 mt -104.74 159.07 30.55 Favored Pre-proline 0 CA--C 1.556 1.177 0 C-N-CA 126.227 1.811 . . . . 0.0 111.263 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -79.38 160.12 25.89 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 124.523 3.482 . . . . 0.0 113.805 -164.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 19.1 t -102.36 -33.15 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 N-CA-C 113.381 0.882 . . . . 0.0 113.381 -175.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 19.7 p -123.44 171.28 9.59 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 114.3 1.222 . . . . 0.0 114.3 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 46.3 ttt180 -61.83 -40.14 94.24 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 124.356 1.063 . . . . 0.0 110.767 177.384 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 31.4 m -63.6 -44.42 94.06 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 124.683 1.193 . . . . 0.0 111.552 171.634 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 78.5 m-20 -60.1 -47.0 87.72 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.007 0.821 . . . . 0.0 110.993 174.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.66 -39.56 91.82 Favored 'General case' 0 CA--C 1.541 0.596 0 O-C-N 121.405 -0.81 . . . . 0.0 112.575 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 78.9 ttt180 -64.49 -43.66 93.46 Favored 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 119.24 0.927 . . . . 0.0 112.344 172.742 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 54.9 t -60.62 -49.24 85.25 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 CA-C-N 118.797 0.726 . . . . 0.0 111.182 175.494 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -62.64 -42.66 99.73 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 118.22 -0.895 . . . . 0.0 112.15 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 56.0 mt -55.86 -51.37 61.1 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 CA-C-N 119.408 1.004 . . . . 0.0 110.471 170.383 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 20.2 t80 -63.67 -47.63 80.44 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -175.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 12.3 t30 -68.99 -44.07 73.57 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 118.913 0.779 . . . . 0.0 112.169 -179.354 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -56.21 -53.5 56.46 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 122.701 0.401 . . . . 0.0 110.059 174.285 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.448 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 62.6 t90 -59.37 -46.8 87.64 Favored 'General case' 0 C--O 1.218 -0.587 0 CA-C-O 117.415 -1.278 . . . . 0.0 111.793 177.226 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -55.91 -48.76 75.09 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 120.928 1.694 . . . . 0.0 113.306 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -69.01 -47.4 65.59 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.171 0.896 . . . . 0.0 111.982 179.279 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 38.8 mmm-85 -59.16 -47.63 84.59 Favored 'General case' 0 C--O 1.216 -0.67 0 O-C-N 121.645 -0.659 . . . . 0.0 110.699 177.518 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 18.9 tptm -62.42 -35.09 78.15 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 126.07 1.748 . . . . 0.0 113.043 176.337 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 14.9 tmtt? -59.44 -36.82 76.65 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 119.603 1.092 . . . . 0.0 111.126 168.458 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 66.5 m -81.7 -18.34 44.73 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 115.926 1.824 . . . . 0.0 115.926 168.691 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -140.13 84.07 15.19 Favored Pre-proline 0 N--CA 1.477 0.903 0 C-N-CA 126.603 1.961 . . . . 0.0 111.88 -165.467 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -62.04 -0.92 1.91 Allowed 'Trans proline' 0 CA--C 1.549 1.256 0 C-N-CA 124.274 3.316 . . . . 0.0 116.598 -171.559 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 31.3 p90 -98.25 -10.96 23.17 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.667 1.987 . . . . 0.0 115.161 177.616 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 11.1 tp -66.82 137.73 56.82 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 114.671 1.36 . . . . 0.0 114.671 -166.854 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 18.6 mmt85 -99.37 159.25 15.15 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 126.05 1.74 . . . . 0.0 112.44 -179.638 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.448 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.4 tm? -137.07 133.51 35.5 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.573 1.949 . . . . 0.0 109.958 -169.556 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 54.0 t0 -141.43 130.53 23.34 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.186 0.994 . . . . 0.0 111.079 176.781 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 65.4 mtt -124.47 6.88 8.3 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.259 1.423 . . . . 0.0 113.409 -179.002 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 68.7 m -64.18 147.25 52.76 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 121.496 -0.753 . . . . 0.0 110.547 168.746 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.4 -26.23 67.71 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 113.526 0.935 . . . . 0.0 113.526 -166.009 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 61.0 mtpt -56.95 -34.79 68.37 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.76 1.224 . . . . 0.0 113.248 172.677 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.92 -39.69 92.93 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 118.914 0.779 . . . . 0.0 111.613 173.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.6 mp -73.62 -46.13 48.94 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 C-N-CA 124.299 1.039 . . . . 0.0 109.24 -179.647 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.4 m-30 -55.87 -46.13 78.34 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 119.152 0.887 . . . . 0.0 112.464 175.39 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.72 -41.59 44.53 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.387 1.075 . . . . 0.0 112.532 -173.087 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 6.9 ttm180 -75.27 -39.81 59.4 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.642 0.777 . . . . 0.0 112.447 176.563 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -124.73 74.58 64.19 Favored Pre-proline 0 CA--C 1.547 0.854 0 C-N-CA 125.999 1.72 . . . . 0.0 111.214 -172.521 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -67.09 -10.25 27.91 Favored 'Trans proline' 0 CA--C 1.538 0.694 0 C-N-CA 123.521 2.814 . . . . 0.0 114.626 -173.619 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 14.7 p-80 -77.98 -24.55 47.99 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.341 1.056 . . . . 0.0 113.407 172.079 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -77.76 -48.84 15.64 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.292 1.037 . . . . 0.0 112.057 -161.447 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 10.7 mmt180 . . . . . 0 C--O 1.254 1.301 0 C-N-CA 126.442 1.897 . . . . 0.0 112.923 179.633 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 99.5 mtp . . . . . 0 N--CA 1.497 1.921 0 N-CA-C 110.888 -0.041 . . . . 0.0 110.888 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -146.42 160.8 41.6 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 125.165 1.386 . . . . 0.0 113.427 177.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -160.08 16.49 0.21 Allowed Glycine 0 CA--C 1.539 1.557 0 C-N-CA 124.528 1.061 . . . . 0.0 115.461 176.593 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 79.4 p -83.67 158.51 21.81 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.011 1.325 . . . . 0.0 113.85 -175.072 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 46.8 p-80 -137.95 160.51 39.13 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.557 1.543 . . . . 0.0 111.596 172.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 20.9 t60 -142.98 82.86 1.78 Allowed 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.209 1.004 . . . . 0.0 111.418 -178.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 57.3 t-80 -151.96 144.16 23.95 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.848 1.259 . . . . 0.0 111.665 175.107 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 48.1 p-80 -151.62 146.57 25.92 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.248 1.419 . . . . 0.0 111.51 173.003 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 66.9 t60 -156.91 155.46 31.42 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.237 1.415 . . . . 0.0 111.687 177.097 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 46.7 t-80 -147.47 141.22 25.68 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.975 1.31 . . . . 0.0 111.688 170.643 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -172.25 31.27 0.12 Allowed Glycine 0 CA--C 1.537 1.425 0 N-CA-C 115.218 0.847 . . . . 0.0 115.218 178.384 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.2 t -148.51 142.66 26.03 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 118.642 1.221 . . . . 0.0 113.021 -176.142 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 13.1 p -153.75 142.94 14.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 126.0 1.72 . . . . 0.0 110.271 174.236 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 82.1 p -155.62 159.95 40.04 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.331 1.053 . . . . 0.0 113.366 -178.85 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 90.7 t80 -148.08 151.37 35.54 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.458 1.503 . . . . 0.0 111.252 170.016 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -179.71 47.33 0.08 OUTLIER Glycine 0 CA--C 1.532 1.156 0 C-N-CA 123.848 0.737 . . . . 0.0 113.772 177.608 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -129.09 62.11 60.63 Favored Pre-proline 0 CA--C 1.554 1.117 0 C-N-CA 124.429 1.092 . . . . 0.0 113.944 -171.744 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -69.97 168.74 20.95 Favored 'Trans proline' 0 CA--C 1.545 1.054 0 C-N-CA 123.379 2.72 . . . . 0.0 112.163 169.755 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 14.8 t -134.88 83.8 39.76 Favored Pre-proline 0 N--CA 1.474 0.764 0 C-N-CA 124.465 1.106 . . . . 0.0 111.316 176.093 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -80.22 64.03 8.82 Favored 'Trans proline' 0 CA--C 1.546 1.115 0 C-N-CA 124.454 3.436 . . . . 0.0 111.475 -179.413 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -75.77 -6.61 51.45 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 115.784 1.772 . . . . 0.0 115.784 -170.675 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.2 m -64.11 139.67 58.79 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.633 1.173 . . . . 0.0 113.132 -175.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 77.9 p -133.41 15.05 4.11 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 125.19 1.396 . . . . 0.0 114.291 -171.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -64.03 -27.92 69.45 Favored 'General case' 0 N--CA 1.476 0.871 0 O-C-N 120.901 -1.125 . . . . 0.0 113.691 -171.8 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 31.1 p -79.84 -45.89 17.89 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.579 1.151 . . . . 0.0 112.214 171.664 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 57.8 mt-10 -60.21 -27.0 66.82 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.78 1.232 . . . . 0.0 112.868 179.649 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -67.37 -14.18 62.69 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.018 1.327 . . . . 0.0 114.239 175.43 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -135.54 -3.28 2.37 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 115.624 1.713 . . . . 0.0 115.624 179.583 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 91.8 mt -123.4 115.29 45.01 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 125.987 1.715 . . . . 0.0 109.642 176.811 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -87.48 51.15 2.15 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 124.831 1.252 . . . . 0.0 111.188 177.77 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 56.26 24.4 8.15 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 126.55 1.94 . . . . 0.0 115.779 177.214 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 14.5 ttt -136.02 20.36 3.24 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.761 1.225 . . . . 0.0 113.722 -170.326 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 16.7 m -128.46 80.8 71.84 Favored Pre-proline 0 N--CA 1.482 1.147 0 C-N-CA 124.209 1.003 . . . . 0.0 110.899 -176.06 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -71.53 159.56 50.91 Favored 'Trans proline' 0 CA--C 1.548 1.185 0 C-N-CA 123.391 2.727 . . . . 0.0 112.374 175.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -69.35 153.82 70.24 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 123.434 2.756 . . . . 0.0 112.755 176.805 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -132.29 10.98 4.53 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 114.537 1.31 . . . . 0.0 114.537 -175.428 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 31.0 tt0 -77.89 -27.88 49.75 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 113.547 0.943 . . . . 0.0 113.547 -174.326 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 60.78 -28.25 0.05 OUTLIER 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 128.838 2.855 . . . . 0.0 117.095 -177.071 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 52.75 37.6 24.21 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 126.782 2.033 . . . . 0.0 115.296 172.092 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -143.86 51.02 1.43 Allowed Pre-proline 0 CA--C 1.555 1.136 0 C-N-CA 124.888 1.275 . . . . 0.0 113.383 -178.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -76.88 164.82 29.43 Favored 'Trans proline' 0 CA--C 1.544 0.984 0 C-N-CA 123.699 2.933 . . . . 0.0 114.4 -170.369 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 87.76 148.18 14.41 Favored Glycine 0 CA--C 1.538 1.478 0 C-N-CA 125.545 1.545 . . . . 0.0 115.906 168.564 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -150.6 143.3 24.54 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.145 1.778 . . . . 0.0 110.989 173.108 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -124.55 158.03 33.96 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 125.575 1.55 . . . . 0.0 111.597 -177.025 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -128.16 124.54 37.11 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.006 1.322 . . . . 0.0 111.34 168.616 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -84.36 143.71 29.3 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.318 1.047 . . . . 0.0 111.22 170.759 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 58.3 mt -126.88 157.46 39.3 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.718 1.207 . . . . 0.0 112.629 -170.295 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -79.41 137.47 37.28 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.01 0.924 . . . . 0.0 110.24 166.53 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -93.74 -16.9 23.74 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 -174.211 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -150.65 170.31 19.49 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.772 1.229 . . . . 0.0 113.005 -172.423 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.59 -163.99 54.79 Favored Glycine 0 CA--C 1.54 1.655 0 C-N-CA 124.155 0.883 . . . . 0.0 114.049 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -67.58 -17.11 48.2 Favored 'Trans proline' 0 CA--C 1.542 0.882 0 C-N-CA 123.265 2.643 . . . . 0.0 113.752 -176.075 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.7 mt -95.32 6.89 47.8 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.699 1.199 . . . . 0.0 113.834 175.849 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -54.7 123.46 13.34 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 120.853 1.66 . . . . 0.0 112.442 -176.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 81.63 3.0 90.72 Favored Glycine 0 CA--C 1.54 1.625 0 C-N-CA 125.577 1.561 . . . . 0.0 115.387 -175.109 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.431 ' HB3' ' HD2' ' A' ' 73' ' ' PRO . 19.0 mt -100.57 161.21 24.68 Favored Pre-proline 0 CA--C 1.555 1.144 0 C-N-CA 126.062 1.745 . . . . 0.0 111.0 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.431 ' HD2' ' HB3' ' A' ' 72' ' ' LEU . 71.8 Cg_endo -75.24 157.24 41.87 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 124.197 3.265 . . . . 0.0 113.63 -165.74 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 52.0 t -92.5 -36.27 7.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 O-C-N 121.434 -0.791 . . . . 0.0 112.719 175.382 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 16.4 p -122.41 172.36 8.39 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 124.999 1.319 . . . . 0.0 114.496 -178.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 34.6 ptt-85 -63.48 -34.4 77.69 Favored 'General case' 0 N--CA 1.483 1.193 0 O-C-N 121.298 -0.876 . . . . 0.0 112.26 172.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 17.7 t -66.4 -44.96 81.57 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.16 0.584 . . . . 0.0 110.605 171.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -60.4 -43.16 96.94 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.619 -0.676 . . . . 0.0 111.397 175.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.47 -43.97 97.53 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.775 0.83 . . . . 0.0 112.78 176.627 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 60.3 ttp180 -65.34 -41.75 93.6 Favored 'General case' 0 N--CA 1.477 0.917 0 O-C-N 121.341 -0.849 . . . . 0.0 112.233 177.115 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 71.0 t -63.73 -45.0 98.52 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 C-N-CA 123.65 0.78 . . . . 0.0 111.073 175.42 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 21.4 mt -58.61 -48.96 79.22 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 118.56 -0.733 . . . . 0.0 112.335 174.148 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 57.2 mt -54.2 -51.12 50.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-N 118.598 0.636 . . . . 0.0 109.915 176.232 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.406 ' HB2' ' HE1' ' A' ' 101' ' ' MET . 12.7 t80 -64.17 -50.65 67.33 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.856 0.687 . . . . 0.0 112.856 -177.695 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -66.46 -45.79 78.58 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 119.193 0.906 . . . . 0.0 112.395 -177.666 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -62.2 -45.83 91.6 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 119.135 -0.459 . . . . 0.0 110.505 178.247 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 68.6 t90 -60.09 -46.58 89.12 Favored 'General case' 0 C--O 1.217 -0.617 0 CA-C-O 117.506 -1.235 . . . . 0.0 111.953 172.542 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -57.35 -45.15 84.64 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 121.149 1.795 . . . . 0.0 113.042 179.794 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -69.53 -50.02 48.94 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 119.559 1.072 . . . . 0.0 112.187 178.213 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -56.64 -49.74 74.11 Favored 'General case' 0 C--O 1.216 -0.672 0 O-C-N 121.789 -0.569 . . . . 0.0 110.602 176.622 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.9 tmtt? -66.44 -30.92 71.38 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.664 1.586 . . . . 0.0 113.634 179.271 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 2.4 tmpt? -58.73 -37.92 77.22 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 120.015 1.279 . . . . 0.0 110.756 165.615 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 51.5 m -83.03 -16.94 45.07 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 115.575 1.694 . . . . 0.0 115.575 169.459 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -142.91 72.11 18.99 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 127.328 2.251 . . . . 0.0 111.194 -166.724 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -61.56 -6.26 6.87 Favored 'Trans proline' 0 CA--C 1.548 1.185 0 C-N-CA 123.921 3.081 . . . . 0.0 116.545 -165.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 38.9 p90 -86.13 -9.78 56.02 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 126.76 2.024 . . . . 0.0 115.032 174.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.6 tp -65.76 138.06 57.68 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 114.762 1.393 . . . . 0.0 114.762 -165.463 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 82.0 mtp180 -84.26 155.23 22.55 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 125.737 1.615 . . . . 0.0 112.997 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -138.52 129.87 27.34 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 126.608 1.963 . . . . 0.0 109.947 -173.69 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 50.8 t0 -147.4 131.54 17.35 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.084 0.954 . . . . 0.0 111.439 -179.382 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.406 ' HE1' ' HB2' ' A' ' 84' ' ' PHE . 65.6 mtt -132.3 6.03 4.14 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 114.526 1.306 . . . . 0.0 114.526 -171.199 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 66.6 m -63.44 155.87 27.83 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 121.313 -0.867 . . . . 0.0 111.591 174.576 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 24.1 p-10 -48.62 -43.41 36.28 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.288 1.218 . . . . 0.0 114.288 -176.601 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 62.1 mtpt -55.5 -38.02 68.64 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.858 1.263 . . . . 0.0 113.52 173.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.87 -40.73 96.39 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 119.26 0.936 . . . . 0.0 111.931 176.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -73.75 -45.96 48.64 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 C-N-CA 124.617 1.167 . . . . 0.0 109.73 -179.105 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 14.9 m-30 -56.93 -45.13 82.96 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 118.806 0.73 . . . . 0.0 112.61 175.094 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -74.51 -36.4 63.2 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.44 1.096 . . . . 0.0 111.99 -174.641 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 72.1 mtt85 -70.16 -40.28 74.83 Favored 'General case' 0 N--CA 1.484 1.229 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 169.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 35.3 m-85 -132.22 88.41 40.4 Favored Pre-proline 0 CA--C 1.546 0.792 0 C-N-CA 125.398 1.479 . . . . 0.0 110.87 -167.503 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -68.05 -19.96 44.88 Favored 'Trans proline' 0 CA--C 1.538 0.711 0 C-N-CA 122.795 2.33 . . . . 0.0 114.013 -170.508 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 8.4 p-80 -71.94 -23.63 61.49 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 123.619 0.767 . . . . 0.0 112.919 173.01 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -85.31 1.93 46.27 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 126.56 1.944 . . . . 0.0 113.593 -179.873 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? . . . . . 0 C--O 1.253 1.256 0 C-N-CA 125.715 1.606 . . . . 0.0 110.84 172.404 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.4 mtt . . . . . 0 N--CA 1.498 1.958 0 CA-C-O 120.148 0.023 . . . . 0.0 110.969 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 94.8 mtt-85 -129.69 165.5 21.71 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 125.886 1.674 . . . . 0.0 112.392 -179.214 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 92.98 142.2 11.38 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 125.751 1.643 . . . . 0.0 113.737 178.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 13.6 t -155.45 156.76 35.87 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.939 1.695 . . . . 0.0 110.947 178.654 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -135.31 154.7 51.44 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.202 1.401 . . . . 0.0 112.654 -175.515 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 33.1 t-80 -143.94 158.9 43.4 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.723 1.609 . . . . 0.0 111.387 179.444 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 25.4 p80 -141.34 161.57 37.57 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 125.03 1.332 . . . . 0.0 113.046 -175.186 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 62.3 m80 -135.74 153.69 51.48 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.096 1.359 . . . . 0.0 112.367 -172.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -147.78 146.93 29.37 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.129 1.372 . . . . 0.0 111.384 174.071 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 34.0 t-80 -148.49 136.16 20.66 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.823 1.249 . . . . 0.0 111.155 175.026 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -88.13 146.71 19.84 Favored Glycine 0 CA--C 1.538 1.486 0 C-N-CA 124.341 0.972 . . . . 0.0 113.985 -179.112 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 69.9 m -133.01 144.64 50.22 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.497 1.519 . . . . 0.0 111.748 179.142 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.6 p -152.2 146.3 15.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 C-N-CA 124.751 1.221 . . . . 0.0 111.803 179.773 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.1 p -148.01 149.92 33.03 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.74 1.616 . . . . 0.0 111.292 171.728 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -154.63 164.33 38.9 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.41 1.084 . . . . 0.0 112.756 -175.497 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 101.74 132.82 7.86 Favored Glycine 0 CA--C 1.535 1.317 0 C-N-CA 125.673 1.606 . . . . 0.0 113.908 173.347 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -155.24 154.65 28.94 Favored Pre-proline 0 CA--C 1.552 1.034 0 C-N-CA 126.321 1.849 . . . . 0.0 111.137 178.363 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo -69.9 153.1 68.67 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 123.142 2.562 . . . . 0.0 112.343 174.171 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 67.8 m -134.53 66.17 69.23 Favored Pre-proline 0 N--CA 1.477 0.894 0 C-N-CA 124.709 1.204 . . . . 0.0 112.445 -175.826 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -66.97 135.68 38.57 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 123.102 2.535 . . . . 0.0 111.567 175.301 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 90.0 mt -142.85 152.47 42.2 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.474 1.509 . . . . 0.0 112.158 -176.249 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 54.7 p -80.41 161.2 25.07 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.204 1.402 . . . . 0.0 112.353 169.107 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 88.6 p -145.96 -4.73 0.63 Allowed 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.565 1.32 . . . . 0.0 114.565 -178.821 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -121.6 -3.14 9.32 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 126.322 1.849 . . . . 0.0 114.765 -171.507 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 42.3 m -73.17 141.32 47.4 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.059 0.944 . . . . 0.0 113.481 -173.906 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 60.42 10.04 2.28 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 116.859 2.17 . . . . 0.0 116.859 171.453 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -69.46 -20.58 63.75 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 114.789 1.403 . . . . 0.0 114.789 -174.678 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -142.39 11.99 1.93 Allowed 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 124.991 1.317 . . . . 0.0 114.532 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 19.1 mt -137.85 127.22 34.45 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 124.797 1.239 . . . . 0.0 110.918 -172.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 15.1 t-20 41.91 50.17 4.11 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 126.697 1.999 . . . . 0.0 114.165 167.166 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 65.3 t80 -56.57 -51.61 67.97 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -161.561 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 40.7 ttp -157.87 52.25 0.45 Allowed 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.654 1.182 . . . . 0.0 111.005 176.141 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 19.7 p -125.3 51.85 5.84 Favored Pre-proline 0 N--CA 1.484 1.235 0 N-CA-C 115.203 1.557 . . . . 0.0 115.203 -168.341 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -73.73 162.0 40.55 Favored 'Trans proline' 0 CA--C 1.551 1.337 0 C-N-CA 123.218 2.612 . . . . 0.0 112.583 170.244 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -72.22 167.03 27.98 Favored 'Trans proline' 0 CA--C 1.546 1.097 0 C-N-CA 123.628 2.886 . . . . 0.0 112.475 170.119 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -141.13 150.06 42.33 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.835 1.254 . . . . 0.0 112.895 176.892 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -166.12 167.18 16.54 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 126.315 1.846 . . . . 0.0 111.452 174.041 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -134.46 162.39 32.38 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 126.305 1.842 . . . . 0.0 110.711 175.167 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 51.76 55.91 8.62 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 125.937 1.695 . . . . 0.0 114.015 175.395 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -135.25 46.78 1.91 Allowed Pre-proline 0 CA--C 1.553 1.091 0 C-N-CA 124.884 1.274 . . . . 0.0 113.036 178.326 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -72.4 158.51 51.23 Favored 'Trans proline' 0 CA--C 1.542 0.891 0 C-N-CA 123.048 2.499 . . . . 0.0 112.909 -172.642 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 70.86 23.77 77.65 Favored Glycine 0 CA--C 1.539 1.555 0 C-N-CA 123.732 0.682 . . . . 0.0 114.795 177.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.16 113.94 5.51 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.72 1.208 . . . . 0.0 111.881 -177.62 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 97.1 mt -133.8 164.7 26.67 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 127.187 2.195 . . . . 0.0 110.83 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -121.33 122.25 39.45 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.328 1.051 . . . . 0.0 112.142 176.062 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -82.78 146.35 29.02 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.218 1.007 . . . . 0.0 110.898 167.88 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 61.5 mt -128.9 157.78 40.63 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.57 1.148 . . . . 0.0 112.712 -169.53 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 -80.8 141.62 34.53 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.074 0.95 . . . . 0.0 110.206 166.765 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -100.16 -13.1 19.08 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 114.811 1.411 . . . . 0.0 114.811 -171.901 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -149.56 167.74 25.46 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.586 1.154 . . . . 0.0 113.221 -172.464 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.69 -162.03 53.72 Favored Glycine 0 CA--C 1.541 1.704 0 C-N-CA 124.17 0.891 . . . . 0.0 113.916 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -67.52 -16.44 47.25 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 123.194 2.596 . . . . 0.0 113.649 -177.838 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 97.2 mt -92.68 4.22 54.12 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.756 1.222 . . . . 0.0 113.915 175.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.1 122.21 11.17 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 120.941 1.7 . . . . 0.0 112.139 -177.683 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 82.64 4.62 90.02 Favored Glycine 0 CA--C 1.539 1.593 0 C-N-CA 125.457 1.503 . . . . 0.0 115.372 -174.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.421 ' HB3' ' HD2' ' A' ' 73' ' ' PRO . 16.5 mt -102.1 159.86 28.12 Favored Pre-proline 0 CA--C 1.555 1.14 0 C-N-CA 126.15 1.78 . . . . 0.0 111.271 -179.172 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.421 ' HD2' ' HB3' ' A' ' 72' ' ' LEU . 74.4 Cg_endo -75.78 160.45 37.56 Favored 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 124.317 3.344 . . . . 0.0 113.884 -165.296 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 29.6 t -103.24 -32.01 2.99 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 178.282 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 18.1 p -124.51 170.42 10.91 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 125.181 1.393 . . . . 0.0 113.898 177.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 39.3 ttm180 -66.03 -34.58 78.42 Favored 'General case' 0 N--CA 1.48 1.046 0 O-C-N 121.019 -1.05 . . . . 0.0 111.113 178.359 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 34.2 m -61.51 -46.54 89.54 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.028 0.931 . . . . 0.0 111.255 168.332 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -60.22 -44.51 95.13 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 119.14 0.882 . . . . 0.0 111.426 176.733 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.39 -41.1 96.84 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.439 0.696 . . . . 0.0 112.538 178.749 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 20.7 ttp180 -67.88 -40.51 83.53 Favored 'General case' 0 N--CA 1.479 1.005 0 O-C-N 121.114 -0.991 . . . . 0.0 112.344 176.357 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 72.2 t -62.74 -45.18 99.47 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 C-N-CA 123.486 0.715 . . . . 0.0 110.799 175.033 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 23.7 mt -58.27 -49.05 78.5 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 118.389 -0.815 . . . . 0.0 112.193 173.617 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 51.9 mt -52.76 -52.12 30.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 CA-C-N 118.796 0.726 . . . . 0.0 110.043 176.012 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -65.95 -50.83 63.0 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 -176.764 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -68.57 -43.03 77.44 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 118.933 0.788 . . . . 0.0 112.511 -175.259 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -64.85 -45.88 84.23 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 118.639 -0.696 . . . . 0.0 110.48 175.425 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.413 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 68.1 t90 -58.98 -47.35 85.47 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-O 117.08 -1.438 . . . . 0.0 111.579 173.21 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -55.15 -49.32 72.11 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 121.329 1.877 . . . . 0.0 112.771 178.88 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -64.47 -51.73 61.57 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 121.124 -0.985 . . . . 0.0 112.427 179.015 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 10.3 mmm180 -58.22 -47.47 83.4 Favored 'General case' 0 C--O 1.213 -0.829 0 C-N-CA 123.114 0.566 . . . . 0.0 110.51 177.783 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 18.8 tptp -60.17 -37.33 79.85 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 125.936 1.695 . . . . 0.0 113.143 177.414 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 61.1 mtpt -62.89 -31.16 72.16 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 119.194 0.906 . . . . 0.0 111.866 170.099 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 68.7 m -83.15 -20.06 35.45 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 115.922 1.823 . . . . 0.0 115.922 165.449 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -145.16 77.81 12.72 Favored Pre-proline 0 N--CA 1.479 0.988 0 C-N-CA 127.06 2.144 . . . . 0.0 111.254 -162.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -56.77 -24.25 54.48 Favored 'Trans proline' 0 CA--C 1.546 1.077 0 C-N-CA 122.624 2.216 . . . . 0.0 114.756 -170.481 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 44.8 p90 -71.85 -6.55 42.54 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 116.043 1.868 . . . . 0.0 116.043 177.532 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 14.0 tp -70.58 131.83 44.57 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 120.981 1.719 . . . . 0.0 114.101 -170.444 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 41.4 ptt180 -87.79 160.07 18.18 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 124.904 1.282 . . . . 0.0 113.735 176.584 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.413 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.4 tm? -139.17 129.83 25.99 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.741 2.016 . . . . 0.0 109.995 -169.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -147.87 135.04 20.43 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.287 1.035 . . . . 0.0 111.332 178.147 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 63.8 mtt -129.82 1.48 4.87 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 114.731 1.382 . . . . 0.0 114.731 -169.456 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 66.2 m -62.36 151.1 37.74 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 119.057 0.844 . . . . 0.0 111.613 175.812 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 43.2 p-10 -50.74 -37.81 44.0 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 114.65 1.352 . . . . 0.0 114.65 -174.823 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt -52.97 -40.05 63.42 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.408 1.483 . . . . 0.0 113.167 173.317 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.5 -39.01 89.41 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 123.625 0.77 . . . . 0.0 112.042 176.226 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.6 mp -73.83 -45.19 50.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 C-N-CA 123.391 0.677 . . . . 0.0 109.3 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 9.9 m-30 -55.94 -44.51 78.45 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 118.779 0.718 . . . . 0.0 112.214 175.199 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.0 -39.72 55.19 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.975 1.31 . . . . 0.0 112.49 -174.497 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 94.5 mtt-85 -74.89 -36.52 62.24 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.888 0.875 . . . . 0.0 112.704 175.268 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 48.3 m-85 -131.68 75.92 75.56 Favored Pre-proline 0 CA--C 1.546 0.816 0 C-N-CA 125.958 1.703 . . . . 0.0 110.834 -170.033 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -66.12 -14.92 46.55 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.083 2.522 . . . . 0.0 114.031 -175.303 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 13.2 p-80 -73.52 -24.39 60.14 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.198 0.999 . . . . 0.0 113.279 171.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.71 -53.71 5.99 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.861 1.265 . . . . 0.0 112.061 -162.591 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 65.7 ttt-85 . . . . . 0 C--O 1.253 1.28 0 C-N-CA 126.635 1.974 . . . . 0.0 112.737 -176.181 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.497 1.903 0 N-CA-C 110.625 -0.139 . . . . 0.0 110.625 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 53.9 ptt85 -144.29 159.92 41.89 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 125.262 1.425 . . . . 0.0 112.946 179.271 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 139.75 133.45 3.01 Favored Glycine 0 CA--C 1.536 1.353 0 C-N-CA 125.623 1.582 . . . . 0.0 112.811 175.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 65.7 m -144.18 146.48 32.74 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.425 1.49 . . . . 0.0 111.766 -177.125 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 20.3 p80 -151.54 152.89 33.55 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.028 1.331 . . . . 0.0 112.093 174.413 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 54.8 t-80 -157.16 145.46 19.43 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.074 1.349 . . . . 0.0 111.602 175.084 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 51.9 p-80 -151.06 144.71 25.02 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.959 1.304 . . . . 0.0 111.482 168.26 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 38.0 t-80 -156.4 151.33 26.16 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.05 1.34 . . . . 0.0 111.285 174.716 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 24.8 p80 -153.21 166.31 32.95 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.538 1.135 . . . . 0.0 113.175 -178.712 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 60.1 m80 -133.73 149.33 51.48 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.842 1.657 . . . . 0.0 111.267 172.769 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 158.26 125.61 0.84 Allowed Glycine 0 CA--C 1.534 1.23 0 C-N-CA 124.119 0.866 . . . . 0.0 113.358 172.391 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 21.5 t -158.01 145.78 18.49 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.238 1.415 . . . . 0.0 111.256 174.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 48.3 t -138.98 130.23 34.85 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 C-N-CA 125.469 1.507 . . . . 0.0 109.777 177.112 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 68.4 m -140.26 135.87 32.73 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.024 1.329 . . . . 0.0 111.427 178.253 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -154.04 155.32 35.28 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.135 1.374 . . . . 0.0 111.69 176.281 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -172.41 130.1 1.85 Allowed Glycine 0 CA--C 1.533 1.216 0 C-N-CA 124.345 0.974 . . . . 0.0 112.421 171.067 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -146.65 61.32 6.7 Favored Pre-proline 0 CA--C 1.553 1.092 0 C-N-CA 124.91 1.284 . . . . 0.0 111.757 178.701 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -67.75 150.18 78.94 Favored 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 123.371 2.714 . . . . 0.0 112.834 -177.826 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 75.1 p -153.23 153.78 29.91 Favored Pre-proline 0 N--CA 1.474 0.757 0 C-N-CA 125.324 1.449 . . . . 0.0 112.131 178.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.11 152.08 67.35 Favored 'Trans proline' 0 CA--C 1.54 0.82 0 C-N-CA 123.106 2.537 . . . . 0.0 112.178 175.047 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 60.5 tp -146.82 134.78 21.41 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.747 1.219 . . . . 0.0 111.529 -179.297 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.8 t -151.47 146.2 25.75 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.981 1.312 . . . . 0.0 110.996 169.175 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 78.9 p -141.92 9.13 1.92 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.144 1.378 . . . . 0.0 113.987 -176.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -112.43 120.46 41.73 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.799 1.24 . . . . 0.0 112.34 -172.695 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 40.4 m -124.23 3.85 8.52 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.942 1.297 . . . . 0.0 113.755 176.741 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 58.09 17.03 4.19 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 126.452 1.901 . . . . 0.0 115.539 -178.855 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -76.12 -24.14 54.93 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 114.036 1.125 . . . . 0.0 114.036 -174.864 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -118.29 -0.22 11.55 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.702 1.601 . . . . 0.0 114.472 -179.218 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 13.3 mt -90.73 57.42 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 C-N-CA 124.78 1.232 . . . . 0.0 109.728 -173.23 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -91.68 -26.94 18.4 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.008 1.323 . . . . 0.0 113.484 -175.797 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 95.0 m-85 -93.67 133.69 36.76 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.161 0.984 . . . . 0.0 113.072 -171.129 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 40.3 tpp -149.78 34.93 0.68 Allowed 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.932 1.693 . . . . 0.0 110.097 171.768 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 3.4 p -140.04 68.78 35.09 Favored Pre-proline 0 N--CA 1.477 0.898 0 C-N-CA 125.033 1.333 . . . . 0.0 112.357 -153.722 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -65.94 158.63 53.09 Favored 'Trans proline' 0 CA--C 1.549 1.235 0 C-N-CA 123.204 2.603 . . . . 0.0 112.367 173.376 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -70.01 151.37 67.59 Favored 'Trans proline' 0 CA--C 1.542 0.88 0 C-N-CA 123.51 2.807 . . . . 0.0 113.036 179.766 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 -125.61 21.1 7.81 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 125.348 1.459 . . . . 0.0 112.809 -177.5 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 23.0 mm-40 -134.02 157.38 46.24 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.903 1.681 . . . . 0.0 111.746 -179.599 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -117.22 39.08 3.35 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.276 1.43 . . . . 0.0 111.909 -175.279 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 52.13 40.09 27.98 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 126.202 1.801 . . . . 0.0 114.766 175.401 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -144.1 49.14 1.0 Allowed Pre-proline 0 CA--C 1.552 1.038 0 C-N-CA 124.897 1.279 . . . . 0.0 112.839 -178.413 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -71.03 159.09 53.5 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 123.306 2.671 . . . . 0.0 112.823 -173.494 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 70.03 28.43 71.72 Favored Glycine 0 CA--C 1.537 1.463 0 C-N-CA 123.619 0.628 . . . . 0.0 114.233 179.738 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.35 119.94 11.27 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.933 1.293 . . . . 0.0 112.21 -176.025 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 94.3 mt -133.66 168.5 18.57 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 127.565 2.346 . . . . 0.0 110.64 177.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -128.66 142.13 51.12 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.285 1.034 . . . . 0.0 113.411 177.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -88.48 154.89 19.99 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.757 1.223 . . . . 0.0 111.114 164.282 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 91.6 mt -132.59 157.55 44.45 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.952 1.301 . . . . 0.0 112.112 -175.786 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -81.24 138.61 35.76 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.468 0.707 . . . . 0.0 109.974 163.218 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -97.26 -20.57 17.8 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 -174.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -140.66 165.47 27.4 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.211 1.405 . . . . 0.0 112.428 -171.405 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.17 -163.27 54.89 Favored Glycine 0 CA--C 1.54 1.648 0 C-N-CA 124.246 0.927 . . . . 0.0 114.13 178.115 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -67.74 -17.14 47.42 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 123.267 2.645 . . . . 0.0 113.833 -175.624 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.2 mt -94.08 5.95 50.09 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 124.612 1.165 . . . . 0.0 113.935 175.462 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.42 122.37 11.05 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 120.875 1.67 . . . . 0.0 112.123 -177.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.25 5.66 88.68 Favored Glycine 0 CA--C 1.541 1.718 0 C-N-CA 125.568 1.556 . . . . 0.0 115.469 -175.104 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.461 ' HB3' ' HD2' ' A' ' 73' ' ' PRO . 20.3 mt -104.02 160.71 25.2 Favored Pre-proline 0 CA--C 1.557 1.228 0 C-N-CA 126.348 1.859 . . . . 0.0 111.295 -179.481 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.461 ' HD2' ' HB3' ' A' ' 72' ' ' LEU . 60.8 Cg_endo -71.36 164.95 34.01 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 124.318 3.346 . . . . 0.0 113.408 -169.165 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.9 t -107.53 -29.58 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 O-C-N 121.324 -0.86 . . . . 0.0 112.468 175.867 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 22.1 p -125.73 172.12 10.07 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 125.31 1.444 . . . . 0.0 114.056 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 34.6 ptt-85 -63.42 -35.6 80.97 Favored 'General case' 0 N--CA 1.48 1.071 0 O-C-N 121.284 -0.885 . . . . 0.0 111.92 173.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 37.2 m -65.39 -44.08 88.62 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.971 0.909 . . . . 0.0 110.95 172.491 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 76.3 m-20 -60.52 -46.42 90.19 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 118.522 0.601 . . . . 0.0 111.066 175.043 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.94 -42.3 98.95 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.61 0.764 . . . . 0.0 112.611 179.512 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 62.8 ttp85 -64.55 -42.84 95.43 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 118.962 0.801 . . . . 0.0 112.234 175.504 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 54.5 t -62.39 -47.87 91.01 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 123.752 0.821 . . . . 0.0 111.078 176.128 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.2 mp -58.95 -48.63 80.82 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 118.519 -0.753 . . . . 0.0 112.791 175.393 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 55.2 mt -55.49 -51.03 61.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 CA-C-N 118.775 0.716 . . . . 0.0 110.173 176.356 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -65.62 -49.19 69.62 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -177.399 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -66.72 -46.61 74.97 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 118.986 0.812 . . . . 0.0 112.299 -177.446 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -60.31 -49.71 76.51 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 118.458 -0.782 . . . . 0.0 110.25 175.044 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.424 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 64.3 t90 -56.44 -47.12 79.78 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-O 117.719 -1.134 . . . . 0.0 112.116 176.385 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -57.15 -48.26 79.13 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 120.792 1.633 . . . . 0.0 113.078 178.346 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -68.92 -48.52 63.08 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 119.902 1.228 . . . . 0.0 112.399 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 34.2 mmt180 -60.54 -39.62 88.57 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.673 0.789 . . . . 0.0 110.175 178.429 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -72.64 -30.13 64.04 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 125.057 1.343 . . . . 0.0 113.581 176.302 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.7 mmtp -62.29 -31.46 72.06 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 120.135 1.334 . . . . 0.0 111.412 165.412 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 60.2 m -80.0 -25.76 40.16 Favored 'General case' 0 N--CA 1.483 1.193 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 165.587 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -139.85 78.58 24.87 Favored Pre-proline 0 N--CA 1.478 0.961 0 C-N-CA 126.775 2.03 . . . . 0.0 111.667 -168.41 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -59.93 -11.78 16.43 Favored 'Trans proline' 0 CA--C 1.546 1.121 0 C-N-CA 123.539 2.826 . . . . 0.0 116.495 -166.718 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 40.6 p90 -85.08 -7.11 59.24 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 126.778 2.031 . . . . 0.0 115.21 176.716 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.4 tp -62.32 137.73 58.31 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 114.515 1.302 . . . . 0.0 114.515 -167.56 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 30.1 mmm180 -83.83 154.74 23.33 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 125.258 1.423 . . . . 0.0 113.113 179.107 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.424 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -137.62 130.35 29.98 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.826 2.05 . . . . 0.0 109.671 -175.85 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 59.2 t0 -143.74 129.61 19.43 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.011 0.924 . . . . 0.0 111.004 176.762 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 66.1 mtt -124.98 13.54 8.45 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.476 1.511 . . . . 0.0 112.952 -179.814 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 38.8 t -59.9 148.45 34.91 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.568 -0.707 . . . . 0.0 110.906 170.196 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -54.66 -35.25 63.33 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.21 -0.931 . . . . 0.0 112.437 -178.205 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -60.3 -36.19 77.33 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.369 1.067 . . . . 0.0 113.039 175.024 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.49 -41.06 98.55 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 118.95 0.795 . . . . 0.0 111.429 174.771 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.79 -46.91 59.16 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 C-N-CA 123.791 0.837 . . . . 0.0 109.758 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 16.9 m-30 -55.08 -46.42 75.44 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 118.89 0.768 . . . . 0.0 112.575 175.206 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.7 tmt_? -76.71 -38.47 54.27 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.508 1.123 . . . . 0.0 112.332 -172.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 19.9 ttm180 -75.9 -37.13 59.12 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.804 0.842 . . . . 0.0 112.646 175.328 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 34.9 m-85 -128.1 82.81 67.73 Favored Pre-proline 0 CA--C 1.547 0.864 0 C-N-CA 126.13 1.772 . . . . 0.0 110.648 -173.279 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -66.01 -19.68 57.63 Favored 'Trans proline' 0 CA--C 1.539 0.738 0 C-N-CA 122.971 2.447 . . . . 0.0 114.174 -172.051 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 8.1 p-80 -72.09 -20.6 61.62 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.917 0.887 . . . . 0.0 113.294 172.81 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -91.88 -0.91 57.52 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 127.015 2.126 . . . . 0.0 113.578 -178.531 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.231 0 C-N-CA 124.769 1.228 . . . . 0.0 111.211 170.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.0 ttt . . . . . 0 N--CA 1.495 1.803 0 N-CA-C 110.66 -0.126 . . . . 0.0 110.66 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 16.2 ptm180 -88.13 162.98 16.43 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 124.528 1.131 . . . . 0.0 113.636 -179.549 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 85.16 148.06 9.79 Favored Glycine 0 CA--C 1.537 1.447 0 C-N-CA 125.462 1.506 . . . . 0.0 114.379 177.583 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.6 t -157.58 166.62 32.41 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.079 1.752 . . . . 0.0 110.883 177.871 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 52.4 p-80 -141.19 151.38 43.77 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.271 1.428 . . . . 0.0 112.548 179.254 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 63.6 m80 -143.11 157.43 44.53 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.441 1.496 . . . . 0.0 111.915 -174.643 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 21.5 p80 -147.01 160.02 42.87 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.998 1.319 . . . . 0.0 111.878 173.796 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 65.1 m80 -140.02 153.02 46.7 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.198 1.399 . . . . 0.0 111.807 -176.625 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 55.3 p-80 -148.51 165.51 30.99 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.17 1.388 . . . . 0.0 112.548 -179.374 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 54.5 p-80 -145.54 163.61 34.21 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.767 1.627 . . . . 0.0 111.76 178.35 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 175.37 -175.28 47.17 Favored Glycine 0 CA--C 1.537 1.414 0 C-N-CA 123.958 0.789 . . . . 0.0 114.337 179.306 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 64.1 m -133.36 161.06 35.53 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.923 1.689 . . . . 0.0 111.784 -178.498 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 27.0 m -126.7 155.38 37.28 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 125.221 1.408 . . . . 0.0 112.547 -178.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 79.8 p -145.02 155.7 43.51 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.689 1.595 . . . . 0.0 111.988 177.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 51.1 p90 -153.54 165.58 35.42 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.057 1.343 . . . . 0.0 112.535 -175.768 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 81.94 162.53 30.41 Favored Glycine 0 CA--C 1.538 1.507 0 C-N-CA 124.992 1.282 . . . . 0.0 114.742 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -152.34 154.15 31.71 Favored Pre-proline 0 CA--C 1.55 0.97 0 C-N-CA 125.852 1.661 . . . . 0.0 111.723 -179.553 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -69.44 160.35 50.13 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 123.353 2.702 . . . . 0.0 112.447 174.637 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 37.2 p -132.62 56.43 22.62 Favored Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 125.158 1.383 . . . . 0.0 113.98 -173.756 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -68.03 156.09 67.14 Favored 'Trans proline' 0 CA--C 1.542 0.925 0 C-N-CA 123.368 2.712 . . . . 0.0 112.891 178.629 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.5 pp -146.12 157.53 43.85 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.548 1.539 . . . . 0.0 111.784 173.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 83.5 p -140.0 -11.3 1.13 Allowed 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 115.876 1.806 . . . . 0.0 115.876 -173.112 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.2 t -152.92 154.1 34.36 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.409 1.084 . . . . 0.0 112.616 -178.187 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -129.95 9.42 5.34 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 127.233 2.213 . . . . 0.0 113.257 179.443 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 6.9 t -142.77 -178.53 5.84 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.272 1.429 . . . . 0.0 113.067 -172.136 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 56.23 50.02 14.22 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 126.315 1.846 . . . . 0.0 113.3 -179.349 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 25.8 m-20 -76.69 56.34 1.14 Allowed 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.536 1.535 . . . . 0.0 111.702 174.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 57.06 29.84 17.19 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 126.57 1.948 . . . . 0.0 114.16 -176.24 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 1.4 pp -68.66 -3.05 2.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 N-CA-C 116.0 1.852 . . . . 0.0 116.0 -169.409 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 -84.69 2.03 43.69 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 124.907 1.283 . . . . 0.0 113.982 175.213 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 37.3 p90 -55.13 -26.8 40.85 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 115.46 1.652 . . . . 0.0 115.46 -174.684 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 25.6 ptp -76.42 -2.83 33.91 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 115.769 1.766 . . . . 0.0 115.769 -167.415 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.0 t -137.04 75.48 47.71 Favored Pre-proline 0 N--CA 1.478 0.949 0 C-N-CA 124.165 0.986 . . . . 0.0 112.745 -176.226 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -71.19 152.34 61.72 Favored 'Trans proline' 0 CA--C 1.549 1.264 0 C-N-CA 123.193 2.595 . . . . 0.0 112.086 173.365 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -77.14 140.03 19.52 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 123.243 2.629 . . . . 0.0 112.881 -177.618 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -147.94 1.75 0.67 Allowed 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -105.33 6.61 32.86 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 114.609 1.337 . . . . 0.0 114.609 -160.167 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -133.91 134.83 43.11 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.908 1.283 . . . . 0.0 111.434 -178.283 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 49.77 44.16 24.83 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 125.982 1.713 . . . . 0.0 114.039 177.843 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -144.69 55.24 3.05 Favored Pre-proline 0 CA--C 1.551 0.987 0 C-N-CA 124.365 1.066 . . . . 0.0 111.88 -172.699 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -75.55 131.11 13.33 Favored 'Trans proline' 0 CA--C 1.542 0.877 0 C-N-CA 122.871 2.381 . . . . 0.0 112.099 -171.74 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 61.55 -158.94 31.22 Favored Glycine 0 CA--C 1.54 1.627 0 C-N-CA 124.043 0.83 . . . . 0.0 113.872 -175.141 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -141.49 93.04 2.52 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.23 1.012 . . . . 0.0 111.52 172.141 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 5.1 mp -134.35 150.39 50.92 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 126.524 1.929 . . . . 0.0 110.386 176.266 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -140.45 130.19 24.39 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.928 0.891 . . . . 0.0 112.266 173.227 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -85.32 159.13 20.1 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.774 1.23 . . . . 0.0 111.294 167.758 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 95.1 mt -133.94 157.02 47.07 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.871 1.269 . . . . 0.0 112.529 -174.501 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 -82.09 140.31 33.92 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 123.908 0.883 . . . . 0.0 109.944 163.205 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -98.19 -20.3 17.36 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 -174.423 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -140.45 165.13 28.28 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.124 1.369 . . . . 0.0 112.492 -171.273 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 72.92 -162.93 54.9 Favored Glycine 0 CA--C 1.541 1.674 0 C-N-CA 124.2 0.905 . . . . 0.0 114.074 178.4 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -67.54 -17.0 48.36 Favored 'Trans proline' 0 CA--C 1.541 0.865 0 C-N-CA 123.325 2.683 . . . . 0.0 113.763 -176.243 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.0 mt -93.85 5.66 50.93 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.701 1.2 . . . . 0.0 113.915 175.406 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.86 121.53 9.46 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 120.823 1.647 . . . . 0.0 111.909 -178.58 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.37 8.09 85.61 Favored Glycine 0 CA--C 1.54 1.631 0 C-N-CA 125.358 1.456 . . . . 0.0 115.5 -174.793 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.43 ' HB3' ' HD2' ' A' ' 73' ' ' PRO . 18.3 mt -107.84 159.51 30.19 Favored Pre-proline 0 CA--C 1.558 1.258 0 C-N-CA 126.42 1.888 . . . . 0.0 111.469 -179.176 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.43 ' HD2' ' HB3' ' A' ' 72' ' ' LEU . 58.3 Cg_endo -71.75 166.27 30.0 Favored 'Trans proline' 0 C--N 1.354 0.853 0 C-N-CA 124.655 3.57 . . . . 0.0 113.968 -169.322 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 5.7 t -111.58 -26.35 3.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 123.856 0.862 . . . . 0.0 112.486 177.655 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 29.8 p -127.87 172.6 10.72 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 125.296 1.439 . . . . 0.0 114.236 179.478 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -68.51 -36.93 79.57 Favored 'General case' 0 N--CA 1.482 1.157 0 O-C-N 121.167 -0.958 . . . . 0.0 111.358 176.354 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 10.2 p -63.56 -42.6 98.34 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 118.492 -0.765 . . . . 0.0 111.761 169.428 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 84.5 m-20 -58.37 -50.98 71.73 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 119.582 1.083 . . . . 0.0 110.809 173.668 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.01 -41.19 97.8 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.565 0.746 . . . . 0.0 112.531 -178.229 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 33.6 ttt85 -65.58 -43.58 89.3 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.08 0.952 . . . . 0.0 112.063 177.513 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 70.4 t -64.47 -45.79 94.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 C-N-CA 123.756 0.822 . . . . 0.0 111.227 175.538 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 54.6 mt -61.28 -43.92 98.09 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 118.309 -0.853 . . . . 0.0 112.406 176.414 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 47.7 mt -55.5 -51.57 56.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 CA-C-N 119.143 0.883 . . . . 0.0 109.949 173.28 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -63.3 -46.97 84.25 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -178.106 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 55.4 m-20 -68.91 -45.9 69.67 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.84 0.856 . . . . 0.0 112.189 -177.131 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -63.62 -46.45 85.66 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 119.131 -0.461 . . . . 0.0 110.793 177.402 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.434 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 66.8 t90 -60.03 -46.04 90.83 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-O 117.657 -1.163 . . . . 0.0 111.658 172.945 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -56.19 -45.72 79.68 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 120.873 1.67 . . . . 0.0 112.877 179.182 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -67.75 -52.06 41.89 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 119.644 1.111 . . . . 0.0 112.401 177.103 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 13.1 mmm180 -56.84 -48.41 78.12 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 121.759 -0.588 . . . . 0.0 110.626 178.809 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.9 tmtt? -67.21 -30.14 69.99 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.593 1.557 . . . . 0.0 113.562 178.435 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -60.77 -36.52 79.15 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 120.293 1.406 . . . . 0.0 111.096 166.257 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 64.9 m -79.95 -20.69 45.03 Favored 'General case' 0 N--CA 1.482 1.166 0 N-CA-C 115.343 1.609 . . . . 0.0 115.343 167.603 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -141.5 73.34 24.82 Favored Pre-proline 0 CA--C 1.548 0.894 0 C-N-CA 127.084 2.153 . . . . 0.0 111.469 -166.078 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -61.31 -7.98 9.52 Favored 'Trans proline' 0 CA--C 1.546 1.084 0 C-N-CA 123.744 2.963 . . . . 0.0 116.325 -166.83 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 41.2 p90 -84.64 -10.17 57.58 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.586 1.954 . . . . 0.0 114.88 174.666 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 16.5 tp -65.48 135.47 55.21 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 119.862 1.21 . . . . 0.0 113.952 -167.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -83.57 156.08 22.95 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.761 1.225 . . . . 0.0 113.021 178.67 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.434 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -137.23 130.98 31.75 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 127.027 2.131 . . . . 0.0 109.228 -174.23 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -137.81 129.66 28.57 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.233 1.013 . . . . 0.0 110.829 178.062 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 63.8 mtt -126.72 16.21 7.5 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.469 1.508 . . . . 0.0 113.53 -178.077 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 47.6 t -63.3 148.97 46.81 Favored 'General case' 0 N--CA 1.47 0.575 0 O-C-N 121.573 -0.704 . . . . 0.0 110.615 165.569 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -56.51 -32.02 64.67 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 121.118 -0.989 . . . . 0.0 112.329 178.773 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 60.3 mtpt -59.78 -33.43 71.69 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.31 1.044 . . . . 0.0 112.997 174.326 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.27 -40.81 97.46 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 119.161 0.891 . . . . 0.0 111.486 173.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.87 -46.99 58.21 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 C-N-CA 123.814 0.846 . . . . 0.0 109.405 179.852 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.7 m-30 -56.24 -45.54 79.94 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 118.759 0.708 . . . . 0.0 112.568 176.479 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.09 -38.55 52.13 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 124.409 1.084 . . . . 0.0 112.121 -173.589 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 62.1 ttm-85 -75.61 -35.57 60.49 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.934 0.893 . . . . 0.0 112.494 175.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 46.7 m-85 -128.53 82.93 67.61 Favored Pre-proline 0 CA--C 1.546 0.795 0 C-N-CA 126.088 1.755 . . . . 0.0 110.724 -174.397 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -66.03 -18.54 57.06 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 123.088 2.526 . . . . 0.0 114.092 -172.51 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' HIS . . . . . 0.452 ' CE1' HD23 ' A' ' 113' ' ' LEU . 7.8 p-80 -73.83 -21.63 60.06 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.022 0.929 . . . . 0.0 113.333 173.009 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.452 HD23 ' CE1' ' A' ' 112' ' ' HIS . 0.1 OUTLIER -90.17 -8.36 51.38 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 126.113 1.765 . . . . 0.0 113.86 -173.163 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? . . . . . 0 C--O 1.254 1.311 0 C-N-CA 125.109 1.363 . . . . 0.0 110.977 175.418 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.3 mtt . . . . . 0 N--CA 1.499 1.986 0 N-CA-C 110.414 -0.217 . . . . 0.0 110.414 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 74.7 ttt180 -148.96 151.23 34.24 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 125.074 1.35 . . . . 0.0 111.981 -178.279 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 87.86 151.38 21.83 Favored Glycine 0 CA--C 1.537 1.425 0 C-N-CA 125.378 1.466 . . . . 0.0 114.378 176.625 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 77.4 p -157.01 163.54 38.98 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 125.908 1.683 . . . . 0.0 112.285 -177.391 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -145.6 134.97 23.06 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.001 1.32 . . . . 0.0 111.243 177.449 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 50.8 m80 -138.78 1.12 2.07 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.604 1.162 . . . . 0.0 114.103 -176.293 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 46.8 m80 -75.19 139.6 42.75 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.474 1.11 . . . . 0.0 112.748 -167.909 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 15.8 t60 -151.22 166.44 30.87 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.124 1.37 . . . . 0.0 111.982 -175.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 20.2 p80 -140.23 154.16 46.79 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.535 1.534 . . . . 0.0 112.348 178.694 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 28.8 p80 -150.16 167.04 28.02 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.829 1.251 . . . . 0.0 112.923 -175.723 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 83.19 159.93 28.46 Favored Glycine 0 CA--C 1.538 1.48 0 C-N-CA 124.985 1.279 . . . . 0.0 114.667 179.539 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 12.3 t -155.16 158.33 38.78 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.579 1.552 . . . . 0.0 111.458 179.08 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.1 p -149.11 146.67 17.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 125.308 1.443 . . . . 0.0 111.503 178.1 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.1 m -132.08 132.74 43.6 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.17 1.388 . . . . 0.0 111.013 177.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 54.6 p90 -154.93 162.86 40.96 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.084 1.354 . . . . 0.0 112.445 -177.141 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 173.6 147.66 6.06 Favored Glycine 0 CA--C 1.536 1.383 0 C-N-CA 124.693 1.14 . . . . 0.0 113.171 174.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -147.29 60.58 5.71 Favored Pre-proline 0 CA--C 1.554 1.122 0 C-N-CA 124.712 1.205 . . . . 0.0 112.534 -179.459 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -67.82 152.22 77.66 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 123.356 2.704 . . . . 0.0 112.586 179.399 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 9.3 t -147.3 73.52 11.88 Favored Pre-proline 0 N--CA 1.475 0.802 0 C-N-CA 124.548 1.139 . . . . 0.0 111.379 177.743 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -73.17 155.3 52.06 Favored 'Trans proline' 0 CA--C 1.542 0.896 0 C-N-CA 123.621 2.881 . . . . 0.0 112.824 -179.422 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -150.27 154.73 38.4 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.496 1.518 . . . . 0.0 112.307 174.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 32.9 m -127.24 -4.3 6.17 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 115.088 1.514 . . . . 0.0 115.088 -173.158 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 49.5 m -142.24 150.94 41.58 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.859 1.264 . . . . 0.0 112.606 -172.428 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -151.41 137.8 18.55 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.11 1.364 . . . . 0.0 111.467 177.333 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 75.6 p -111.25 -7.17 14.45 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 125.415 1.486 . . . . 0.0 114.801 -178.224 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -67.71 -12.3 60.21 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 -173.444 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -68.68 -21.81 64.41 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.683 1.193 . . . . 0.0 113.543 172.722 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -119.54 -14.85 9.08 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.511 1.524 . . . . 0.0 113.605 177.253 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 33.0 mt -120.04 77.78 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 126.516 1.926 . . . . 0.0 108.697 -179.615 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -111.37 -6.18 14.53 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 114.698 1.37 . . . . 0.0 114.698 -168.076 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 56.8 t80 -138.79 134.25 33.18 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.473 1.509 . . . . 0.0 112.118 -178.072 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 10.4 tpt -155.86 35.65 0.35 Allowed 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.101 1.361 . . . . 0.0 111.67 172.87 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 13.4 p -129.65 65.02 73.83 Favored Pre-proline 0 N--CA 1.482 1.162 0 C-N-CA 124.486 1.114 . . . . 0.0 113.974 -163.632 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -66.27 161.52 40.17 Favored 'Trans proline' 0 CA--C 1.551 1.331 0 C-N-CA 123.44 2.76 . . . . 0.0 112.52 171.28 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -67.22 148.72 81.0 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 123.472 2.782 . . . . 0.0 112.991 178.448 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -106.68 -5.5 18.55 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 114.516 1.302 . . . . 0.0 114.516 -171.611 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -138.23 128.78 26.4 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.565 1.146 . . . . 0.0 112.155 -175.391 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -159.46 165.58 32.79 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 126.446 1.899 . . . . 0.0 111.148 174.217 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 50.77 50.04 19.8 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 125.706 1.602 . . . . 0.0 115.015 168.056 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 7.2 tp-100 -139.6 66.65 35.68 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 124.766 1.227 . . . . 0.0 110.416 178.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -83.22 157.57 14.98 Favored 'Trans proline' 0 CA--C 1.542 0.92 0 C-N-CA 123.531 2.82 . . . . 0.0 113.778 -167.739 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 76.35 163.49 15.83 Favored Glycine 0 CA--C 1.539 1.564 0 C-N-CA 125.243 1.401 . . . . 0.0 115.308 176.046 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -151.55 141.64 22.19 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.235 1.414 . . . . 0.0 111.707 176.133 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 5.0 mp -136.74 157.24 47.21 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.978 1.711 . . . . 0.0 110.902 176.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -132.19 128.31 37.71 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.419 1.087 . . . . 0.0 111.885 169.568 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -85.04 156.89 20.91 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.539 1.136 . . . . 0.0 111.443 168.687 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 98.2 mt -131.97 156.27 46.49 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.028 1.331 . . . . 0.0 112.381 -175.259 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 84.9 m-70 -83.04 142.82 31.04 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.057 0.943 . . . . 0.0 109.755 163.41 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -103.14 -18.17 15.05 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 114.695 1.368 . . . . 0.0 114.695 -172.397 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -139.8 163.05 33.65 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.114 1.365 . . . . 0.0 112.459 -172.369 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.05 -160.91 54.12 Favored Glycine 0 CA--C 1.539 1.572 0 C-N-CA 124.137 0.875 . . . . 0.0 114.001 178.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -67.63 -16.4 46.7 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 123.339 2.693 . . . . 0.0 113.763 -176.536 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 98.6 mt -92.95 4.87 53.2 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.647 1.179 . . . . 0.0 113.807 174.829 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.84 114.0 2.33 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 121.233 1.833 . . . . 0.0 111.91 -179.081 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.68 5.86 68.41 Favored Glycine 0 CA--C 1.543 1.785 0 C-N-CA 125.322 1.439 . . . . 0.0 115.57 -173.771 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 6.0 mp -104.97 156.24 36.35 Favored Pre-proline 0 CA--C 1.556 1.191 0 C-N-CA 126.807 2.043 . . . . 0.0 111.63 178.595 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -67.87 163.29 36.09 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 124.912 3.741 . . . . 0.0 113.987 -170.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.8 t -105.42 -30.18 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 O-C-N 121.373 -0.829 . . . . 0.0 112.319 175.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 17.8 p -125.87 170.05 12.03 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 125.235 1.414 . . . . 0.0 114.266 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 37.5 ttt180 -62.07 -39.13 91.36 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.593 1.157 . . . . 0.0 111.084 174.451 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 18.5 t -62.62 -46.71 87.01 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.843 0.857 . . . . 0.0 111.101 171.474 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 78.5 m-20 -57.99 -48.94 78.51 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 118.852 0.751 . . . . 0.0 111.069 176.284 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.58 -42.87 97.56 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -179.573 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 70.2 ttp85 -67.07 -41.99 85.46 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 121.199 -0.938 . . . . 0.0 112.597 176.909 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 78.5 t -63.84 -43.4 97.84 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.034 0 C-N-CA 123.603 0.761 . . . . 0.0 111.14 175.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 55.1 mt -60.49 -47.19 87.21 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 118.169 -0.92 . . . . 0.0 112.102 175.062 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 60.6 mt -53.4 -50.28 49.2 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 CA-C-N 119.064 0.847 . . . . 0.0 110.111 173.619 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.414 ' HB2' ' HE1' ' A' ' 101' ' ' MET . 12.3 t80 -62.89 -51.16 68.06 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 112.916 0.709 . . . . 0.0 112.916 -178.135 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -70.87 -41.44 71.37 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -174.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 57.4 mm-40 -58.7 -53.52 57.41 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 118.574 -0.727 . . . . 0.0 110.057 169.906 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.42 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 61.4 t90 -55.9 -44.58 78.35 Favored 'General case' 0 C--O 1.218 -0.577 0 CA-C-O 117.444 -1.265 . . . . 0.0 112.081 178.124 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -56.33 -51.05 69.66 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 120.755 1.616 . . . . 0.0 112.856 176.919 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -68.13 -45.29 74.02 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 119.879 1.218 . . . . 0.0 112.618 179.469 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 31.4 mmt180 -59.79 -44.48 93.92 Favored 'General case' 0 C--O 1.218 -0.583 0 C-N-CA 123.773 0.829 . . . . 0.0 109.952 177.832 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -63.69 -36.55 84.21 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 126.055 1.742 . . . . 0.0 112.819 175.329 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -62.3 -30.82 71.41 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 119.381 0.992 . . . . 0.0 111.845 170.012 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 68.4 m -82.91 -20.97 34.38 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 115.44 1.644 . . . . 0.0 115.44 166.077 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -140.53 79.0 20.86 Favored Pre-proline 0 CA--C 1.547 0.86 0 C-N-CA 127.077 2.151 . . . . 0.0 111.419 -167.346 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -63.81 6.03 0.31 Allowed 'Trans proline' 0 CA--C 1.55 1.311 0 C-N-CA 124.252 3.301 . . . . 0.0 116.878 -169.184 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 40.5 p90 -103.55 -6.76 21.4 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 127.402 2.281 . . . . 0.0 114.668 175.425 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 13.7 tp -64.82 135.5 55.85 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 -165.381 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 85.0 mtp180 -86.21 156.57 20.25 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.593 1.557 . . . . 0.0 113.063 178.597 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.42 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -138.38 131.49 30.02 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.726 2.01 . . . . 0.0 110.043 -173.846 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 33.3 t0 -146.6 135.96 22.83 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.066 0.946 . . . . 0.0 111.432 177.045 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.414 ' HE1' ' HB2' ' A' ' 84' ' ' PHE . 66.3 mtt -133.3 3.41 3.64 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 114.467 1.284 . . . . 0.0 114.467 -173.503 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 72.5 m -60.6 145.05 50.33 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 119.166 0.894 . . . . 0.0 110.96 173.082 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.416 ' HA ' HG12 ' A' ' 106' ' ' ILE . 17.2 m-20 -61.82 -25.39 67.47 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 114.813 1.412 . . . . 0.0 114.813 -163.137 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -56.11 -38.38 70.69 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.091 0.956 . . . . 0.0 112.719 171.734 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.77 -35.75 75.28 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 123.8 0.84 . . . . 0.0 112.05 172.743 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.416 HG12 ' HA ' ' A' ' 103' ' ' ASP . 4.8 mm -78.35 -43.61 26.88 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 C-N-CA 123.85 0.86 . . . . 0.0 109.544 -175.052 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -59.5 -43.53 93.33 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.255 0.622 . . . . 0.0 111.932 173.463 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.72 -39.27 57.63 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.52 1.128 . . . . 0.0 112.774 -174.52 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 88.2 mtt-85 -69.63 -40.3 76.62 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.749 0.82 . . . . 0.0 112.478 172.029 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -127.67 77.89 75.57 Favored Pre-proline 0 CA--C 1.544 0.748 0 C-N-CA 125.094 1.358 . . . . 0.0 111.142 -168.208 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -68.02 -10.1 27.82 Favored 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 123.389 2.726 . . . . 0.0 114.097 -175.736 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 14.2 p-80 -78.9 -21.9 46.7 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.144 0.977 . . . . 0.0 113.469 169.89 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -89.7 -32.52 16.99 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.774 1.63 . . . . 0.0 112.462 -168.844 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 . . . . . 0 C--O 1.254 1.335 0 C-N-CA 124.723 1.209 . . . . 0.0 113.715 174.811 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.5 mpp? . . . . . 0 N--CA 1.497 1.91 0 CA-C-O 120.7 0.286 . . . . 0.0 111.486 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 14.0 ptt180 -69.19 152.47 45.05 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 125.314 1.445 . . . . 0.0 113.657 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 171.46 116.48 0.39 Allowed Glycine 0 CA--C 1.534 1.232 0 C-N-CA 125.018 1.294 . . . . 0.0 112.26 176.776 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 78.7 p -110.94 -0.29 16.82 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 125.48 1.512 . . . . 0.0 114.601 -173.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -120.75 148.39 44.04 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.628 1.571 . . . . 0.0 112.344 -177.447 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 53.6 p-80 -148.38 160.5 42.95 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.97 1.708 . . . . 0.0 111.683 178.532 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 39.8 t-80 -143.45 152.68 41.82 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.552 1.141 . . . . 0.0 111.723 175.753 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 46.2 p-80 -87.92 -18.74 28.49 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 115.003 1.483 . . . . 0.0 115.003 -172.561 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 58.0 t-80 -95.9 135.65 37.37 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 119.169 0.895 . . . . 0.0 113.261 -173.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 64.5 t60 -155.58 150.21 26.19 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.598 1.559 . . . . 0.0 111.132 169.383 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 158.44 160.34 10.23 Favored Glycine 0 CA--C 1.535 1.322 0 C-N-CA 124.503 1.049 . . . . 0.0 114.264 173.639 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.7 t -153.63 145.03 23.11 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.065 1.346 . . . . 0.0 111.816 173.227 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.9 m -131.47 11.47 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 C-N-CA 125.809 1.644 . . . . 0.0 112.99 178.252 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 40.0 m -82.37 54.24 2.52 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 125.678 1.591 . . . . 0.0 113.276 -169.544 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 82.4 m-85 -133.72 166.13 23.33 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.907 1.683 . . . . 0.0 112.99 -172.114 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 104.87 107.38 3.21 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 125.732 1.635 . . . . 0.0 112.77 178.409 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -153.39 153.06 28.75 Favored Pre-proline 0 CA--C 1.552 1.037 0 C-N-CA 126.157 1.783 . . . . 0.0 111.049 177.033 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -71.17 140.94 38.48 Favored 'Trans proline' 0 CA--C 1.543 0.957 0 C-N-CA 123.148 2.565 . . . . 0.0 112.373 177.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 71.2 m -138.82 63.57 32.31 Favored Pre-proline 0 N--CA 1.477 0.888 0 C-N-CA 125.193 1.397 . . . . 0.0 111.847 -179.388 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -67.78 131.7 24.88 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 C-N-CA 123.337 2.691 . . . . 0.0 112.387 -177.071 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 62.3 tp -155.76 134.2 11.67 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.309 1.443 . . . . 0.0 111.051 178.265 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 31.6 t -154.83 131.35 10.54 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.648 1.179 . . . . 0.0 111.22 170.862 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.3 t -158.99 82.52 0.79 Allowed 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.849 1.259 . . . . 0.0 110.416 175.166 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -140.62 -11.81 1.02 Allowed 'General case' 0 N--CA 1.479 1.016 0 N-CA-C 115.797 1.777 . . . . 0.0 115.797 -174.556 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 21.3 t -65.39 111.98 3.31 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 119.516 1.053 . . . . 0.0 111.407 -171.645 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 53.63 20.46 2.17 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 125.867 1.667 . . . . 0.0 114.583 -173.535 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -75.3 -27.45 59.34 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 -169.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -137.82 12.22 2.91 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 125.893 1.677 . . . . 0.0 113.898 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 23.2 mm -87.93 67.64 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 124.495 1.118 . . . . 0.0 110.484 -170.519 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 64.4 t-20 -146.74 127.63 14.46 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.585 1.554 . . . . 0.0 110.73 177.004 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 21.0 t80 -133.87 14.29 3.97 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.898 1.279 . . . . 0.0 113.292 177.075 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 23.7 ptp -104.63 3.03 31.2 Favored 'General case' 0 N--CA 1.48 1.028 0 N-CA-C 115.041 1.497 . . . . 0.0 115.041 -171.564 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.9 t -142.0 74.25 21.88 Favored Pre-proline 0 N--CA 1.477 0.891 0 C-N-CA 124.433 1.093 . . . . 0.0 111.675 179.052 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -70.97 156.84 59.47 Favored 'Trans proline' 0 CA--C 1.55 1.281 0 C-N-CA 123.39 2.727 . . . . 0.0 112.488 177.89 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -71.09 153.55 62.71 Favored 'Trans proline' 0 CA--C 1.542 0.916 0 C-N-CA 123.588 2.858 . . . . 0.0 112.869 178.372 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -126.49 9.46 7.17 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 124.555 1.142 . . . . 0.0 113.957 -176.435 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 18.9 mm100 -131.59 151.73 51.36 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.732 1.613 . . . . 0.0 112.054 -179.718 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -150.72 165.21 34.15 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.707 2.003 . . . . 0.0 110.883 174.3 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 51.72 41.53 29.11 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 125.503 1.521 . . . . 0.0 114.646 176.363 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -141.96 58.5 8.14 Favored Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 125.44 1.496 . . . . 0.0 109.692 179.564 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -72.34 151.9 54.63 Favored 'Trans proline' 0 CA--C 1.542 0.897 0 C-N-CA 123.245 2.63 . . . . 0.0 112.433 -170.825 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 74.71 -39.39 1.1 Allowed Glycine 0 CA--C 1.539 1.539 0 C-N-CA 125.808 1.671 . . . . 0.0 114.791 -176.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . 58.64 25.88 13.82 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 126.718 2.007 . . . . 0.0 115.87 176.437 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 11.0 mp -73.21 153.3 40.73 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.749 1.22 . . . . 0.0 111.643 171.052 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -146.43 153.09 40.06 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.894 1.678 . . . . 0.0 112.661 173.589 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -96.7 149.07 22.22 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.064 1.346 . . . . 0.0 112.401 174.857 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 89.5 mt -128.29 157.39 41.07 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.694 1.597 . . . . 0.0 111.741 -179.293 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -77.46 140.02 39.75 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.898 0.879 . . . . 0.0 110.479 167.195 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -99.1 -12.39 20.55 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 -174.636 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -149.49 168.16 24.24 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.786 1.235 . . . . 0.0 113.211 -172.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.78 -164.47 54.14 Favored Glycine 0 CA--C 1.54 1.615 0 C-N-CA 124.151 0.882 . . . . 0.0 114.094 179.74 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -67.72 -16.82 47.14 Favored 'Trans proline' 0 CA--C 1.542 0.925 0 C-N-CA 123.254 2.636 . . . . 0.0 113.674 -177.145 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.1 mt -92.49 4.42 53.55 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.784 1.234 . . . . 0.0 113.877 175.798 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.01 122.9 11.93 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 120.922 1.692 . . . . 0.0 112.088 -177.342 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.23 4.45 89.65 Favored Glycine 0 CA--C 1.54 1.612 0 C-N-CA 125.418 1.485 . . . . 0.0 115.384 -174.649 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 21.5 mt -103.85 160.05 27.33 Favored Pre-proline 0 CA--C 1.555 1.141 0 C-N-CA 126.204 1.802 . . . . 0.0 111.174 179.49 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -80.23 156.69 22.8 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 124.12 3.213 . . . . 0.0 113.664 -163.464 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 24.1 t -95.52 -36.32 6.59 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -177.157 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 22.2 p -123.52 174.24 7.52 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 124.965 1.306 . . . . 0.0 114.413 -178.584 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -64.12 -39.52 94.22 Favored 'General case' 0 N--CA 1.483 1.184 0 O-C-N 121.176 -0.953 . . . . 0.0 110.83 176.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 35.1 m -61.42 -45.1 95.74 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.196 0.998 . . . . 0.0 111.283 171.306 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -61.35 -46.92 88.22 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 118.842 0.746 . . . . 0.0 111.16 175.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.16 -38.69 89.99 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.467 -0.77 . . . . 0.0 112.313 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 69.4 ttt180 -67.3 -41.56 85.18 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 119.202 0.91 . . . . 0.0 112.622 173.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 59.7 t -61.12 -49.98 82.43 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 CA-C-N 118.713 0.688 . . . . 0.0 110.972 173.689 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -62.61 -40.75 97.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 118.319 -0.848 . . . . 0.0 112.464 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 48.8 mt -56.36 -50.72 70.6 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 CA-C-N 119.17 0.895 . . . . 0.0 110.31 170.7 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -64.29 -45.44 87.98 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -178.117 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 55.4 t30 -68.39 -46.58 69.63 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.918 0.887 . . . . 0.0 111.948 -177.508 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 55.6 mm-40 -60.19 -51.75 68.26 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 118.488 -0.767 . . . . 0.0 110.55 172.814 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.44 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 60.4 t90 -56.26 -47.17 79.06 Favored 'General case' 0 C--O 1.222 -0.358 0 CA-C-N 119.526 1.057 . . . . 0.0 111.929 177.673 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -58.39 -45.5 88.22 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 120.46 1.482 . . . . 0.0 113.027 178.811 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -69.46 -49.72 52.26 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-N 120.001 1.273 . . . . 0.0 112.747 178.126 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 32.6 mmt180 -59.0 -41.05 86.76 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.93 0.892 . . . . 0.0 109.839 178.066 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 21.5 ttpt -69.7 -31.86 70.13 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.088 1.355 . . . . 0.0 113.447 174.831 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -59.52 -33.22 71.1 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 120.022 1.283 . . . . 0.0 110.777 167.672 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 53.1 m -81.02 -24.32 37.99 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 115.453 1.649 . . . . 0.0 115.453 165.635 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -140.02 78.89 23.47 Favored Pre-proline 0 CA--C 1.552 1.024 0 C-N-CA 127.004 2.122 . . . . 0.0 112.251 -168.671 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -61.66 -5.81 6.34 Favored 'Trans proline' 0 CA--C 1.549 1.231 0 C-N-CA 123.859 3.039 . . . . 0.0 116.653 -168.658 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 41.4 p90 -90.89 -6.37 54.26 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.795 2.038 . . . . 0.0 114.887 175.54 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.3 tp -62.77 135.5 57.38 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 119.702 1.137 . . . . 0.0 113.776 -168.089 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 54.3 mmt-85 -86.06 157.36 20.08 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.61 1.164 . . . . 0.0 112.761 179.199 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.44 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -136.72 131.82 34.01 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 126.714 2.005 . . . . 0.0 110.04 -172.612 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 54.9 t0 -142.89 131.09 21.98 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.186 0.994 . . . . 0.0 111.12 176.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 64.7 mtt -127.71 6.75 6.18 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.359 1.464 . . . . 0.0 113.56 -177.277 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 71.3 m -63.21 147.48 50.81 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 118.884 0.766 . . . . 0.0 110.39 169.153 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -61.27 -28.33 69.11 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -163.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -57.11 -34.34 68.26 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.459 1.104 . . . . 0.0 113.41 172.829 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.7 -40.21 96.42 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 119.075 0.852 . . . . 0.0 111.704 173.8 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.63 -45.71 65.85 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 C-N-CA 124.406 1.083 . . . . 0.0 109.212 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 8.4 m-30 -56.92 -46.43 82.0 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 118.716 0.689 . . . . 0.0 112.279 175.237 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.72 -38.49 62.3 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.68 1.192 . . . . 0.0 112.57 -173.03 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 75.1 mtp85 -72.37 -38.85 68.42 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 172.176 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 27.3 m-85 -130.23 83.37 63.19 Favored Pre-proline 0 CA--C 1.548 0.866 0 C-N-CA 125.256 1.423 . . . . 0.0 110.902 -168.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -66.99 -16.79 50.5 Favored 'Trans proline' 0 CA--C 1.541 0.832 0 C-N-CA 123.04 2.493 . . . . 0.0 114.252 -171.478 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 12.4 p-80 -74.86 -23.45 58.42 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.153 0.981 . . . . 0.0 113.257 173.13 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -82.65 -24.36 33.81 Favored 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 125.719 1.608 . . . . 0.0 112.723 -171.708 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 8.3 tmm_? . . . . . 0 C--O 1.254 1.292 0 C-N-CA 125.162 1.385 . . . . 0.0 111.918 178.445 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.9 mtt . . . . . 0 N--CA 1.498 1.951 0 CA-C-O 119.826 -0.13 . . . . 0.0 111.185 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -142.2 148.89 38.93 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 126.12 1.768 . . . . 0.0 110.232 166.014 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 163.86 41.93 0.02 OUTLIER Glycine 0 N--CA 1.475 1.272 0 N-CA-C 114.761 0.664 . . . . 0.0 114.761 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 40.4 m -66.31 124.89 23.93 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.123 0.969 . . . . 0.0 112.856 -172.077 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 5.0 t-80 -138.27 14.53 2.81 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.975 1.31 . . . . 0.0 113.279 -178.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 11.5 p80 -80.64 -7.07 59.17 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 114.983 1.475 . . . . 0.0 114.983 -171.575 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 77.3 t60 -67.69 -22.91 65.25 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.434 1.094 . . . . 0.0 113.86 -177.814 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 86.2 m-70 -80.94 44.6 0.76 Allowed 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.704 1.602 . . . . 0.0 113.894 -171.778 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 78.6 t60 -68.39 144.06 54.88 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.756 1.222 . . . . 0.0 112.54 177.574 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 56.0 t-80 -153.79 148.61 26.52 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.763 1.625 . . . . 0.0 111.196 178.187 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -150.28 7.48 0.73 Allowed Glycine 0 CA--C 1.537 1.434 0 N-CA-C 116.533 1.373 . . . . 0.0 116.533 -178.645 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 21.7 m -78.66 141.6 37.84 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 119.36 1.58 . . . . 0.0 112.382 -178.203 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.5 p -150.65 152.76 11.14 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 125.197 1.399 . . . . 0.0 111.359 -179.578 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 33.2 t -140.37 149.62 42.9 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.955 1.302 . . . . 0.0 112.039 176.537 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 22.4 t80 -134.98 28.94 3.47 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.887 1.675 . . . . 0.0 111.319 175.431 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 74.79 -156.98 50.04 Favored Glycine 0 CA--C 1.536 1.403 0 C-N-CA 124.282 0.944 . . . . 0.0 112.78 -168.793 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -130.77 63.15 69.02 Favored Pre-proline 0 CA--C 1.554 1.121 0 C-N-CA 124.837 1.255 . . . . 0.0 112.517 -178.539 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_endo -67.52 151.87 79.23 Favored 'Trans proline' 0 CA--C 1.542 0.919 0 C-N-CA 123.318 2.679 . . . . 0.0 112.523 177.81 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 78.6 p -152.11 155.97 33.66 Favored Pre-proline 0 N--CA 1.476 0.854 0 C-N-CA 125.358 1.463 . . . . 0.0 112.007 179.136 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -74.63 133.66 17.47 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 123.017 2.478 . . . . 0.0 112.009 177.295 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.3 mp -122.06 151.97 40.31 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.869 1.668 . . . . 0.0 111.018 175.298 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 78.1 p -147.62 149.02 31.74 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.24 1.416 . . . . 0.0 111.764 172.129 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.5 m -135.77 9.35 3.34 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 -170.039 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -146.78 140.18 25.64 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.788 1.235 . . . . 0.0 111.937 -175.495 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 15.4 t -154.09 152.31 30.3 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.339 1.456 . . . . 0.0 111.196 174.223 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 52.91 40.93 31.77 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 125.493 1.517 . . . . 0.0 113.953 177.658 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -74.23 82.69 1.84 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.505 1.122 . . . . 0.0 111.549 179.511 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 56.28 31.33 18.32 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 125.861 1.664 . . . . 0.0 113.701 -171.408 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 55.5 mt -88.52 104.58 14.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 C-N-CA 124.222 1.009 . . . . 0.0 109.394 178.175 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -152.96 156.15 38.33 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.152 1.381 . . . . 0.0 111.865 174.13 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 98.2 m-85 -137.61 152.08 49.0 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.482 1.513 . . . . 0.0 111.351 179.661 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 98.0 mtp -78.24 -31.25 49.14 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.469 0.915 . . . . 0.0 113.469 -174.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 24.8 p -144.46 153.54 55.52 Favored Pre-proline 0 N--CA 1.478 0.971 0 C-N-CA 125.552 1.541 . . . . 0.0 112.255 -175.605 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -71.02 159.09 53.52 Favored 'Trans proline' 0 CA--C 1.549 1.268 0 C-N-CA 123.216 2.611 . . . . 0.0 112.103 171.471 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -66.99 147.03 79.39 Favored 'Trans proline' 0 CA--C 1.539 0.755 0 C-N-CA 123.31 2.673 . . . . 0.0 112.57 177.228 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -94.12 -14.79 25.33 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.261 1.424 . . . . 0.0 113.761 178.119 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -134.93 129.06 33.72 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 126.098 1.759 . . . . 0.0 110.321 176.782 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -132.55 10.02 4.35 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.662 1.185 . . . . 0.0 113.37 -175.432 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -134.66 72.0 1.45 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.22 1.408 . . . . 0.0 111.861 -170.779 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -145.49 66.78 12.45 Favored Pre-proline 0 CA--C 1.548 0.877 0 C-N-CA 125.008 1.323 . . . . 0.0 109.218 172.53 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -72.46 152.88 55.08 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 123.232 2.621 . . . . 0.0 112.85 -167.541 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 75.23 -45.95 1.81 Allowed Glycine 0 CA--C 1.539 1.582 0 C-N-CA 125.588 1.566 . . . . 0.0 114.295 -175.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . 52.77 71.47 0.48 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 127.059 2.143 . . . . 0.0 114.356 179.645 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -101.0 151.62 21.56 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.0 1.72 . . . . 0.0 111.55 176.383 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -135.98 146.39 47.18 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.627 1.571 . . . . 0.0 112.425 176.926 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -87.62 158.79 18.78 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.756 1.223 . . . . 0.0 111.562 167.862 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 95.8 mt -135.83 157.03 47.86 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 125.34 1.456 . . . . 0.0 111.812 -177.838 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -82.2 139.97 33.99 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.535 0.734 . . . . 0.0 109.463 162.487 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -101.28 -19.07 15.82 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -173.359 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -140.1 164.12 30.9 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 125.323 1.449 . . . . 0.0 112.145 -173.129 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 72.37 -161.37 54.33 Favored Glycine 0 CA--C 1.542 1.727 0 C-N-CA 124.105 0.86 . . . . 0.0 113.992 179.269 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -67.9 -16.8 46.23 Favored 'Trans proline' 0 CA--C 1.541 0.872 0 C-N-CA 123.325 2.684 . . . . 0.0 113.895 -174.949 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 89.5 mt -95.24 6.78 48.09 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.81 1.244 . . . . 0.0 113.829 175.482 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.2 113.52 1.97 Allowed 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 121.067 1.758 . . . . 0.0 112.018 -178.638 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.63 7.68 64.62 Favored Glycine 0 CA--C 1.542 1.779 0 C-N-CA 125.418 1.485 . . . . 0.0 115.672 -173.625 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 5.7 mp -108.61 155.73 40.02 Favored Pre-proline 0 CA--C 1.556 1.211 0 C-N-CA 126.666 1.986 . . . . 0.0 111.877 179.491 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -64.82 163.35 28.32 Favored 'Trans proline' 0 C--N 1.354 0.817 0 C-N-CA 125.207 3.938 . . . . 0.0 114.235 -172.795 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 9.1 t -106.96 -30.29 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 123.719 0.808 . . . . 0.0 112.041 174.765 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 24.2 p -126.88 169.52 13.18 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 125.161 1.385 . . . . 0.0 114.004 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 41.0 ptt180 -61.97 -36.07 80.35 Favored 'General case' 0 N--CA 1.482 1.138 0 O-C-N 121.306 -0.871 . . . . 0.0 111.789 173.782 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 22.3 m -63.86 -43.3 96.53 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.361 1.065 . . . . 0.0 110.845 172.754 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -60.81 -49.75 76.23 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 118.688 0.676 . . . . 0.0 111.2 174.494 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.41 -42.97 93.03 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-N 118.721 0.691 . . . . 0.0 112.308 -179.576 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.94 -49.04 76.34 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.261 1.024 . . . . 0.0 111.895 175.808 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 51.7 t -60.2 -47.59 91.51 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 123.638 0.775 . . . . 0.0 111.234 177.95 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 88.0 mt -61.6 -42.87 99.48 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 118.277 -0.868 . . . . 0.0 111.968 179.222 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 55.7 mt -56.79 -52.7 51.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 CA-C-N 119.147 0.885 . . . . 0.0 110.156 172.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -64.44 -45.97 85.15 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 -176.361 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 46.2 m-20 -67.2 -49.11 65.82 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.337 1.055 . . . . 0.0 111.811 -178.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -65.33 -43.22 91.63 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 118.927 -0.558 . . . . 0.0 110.972 179.836 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.42 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 58.2 t90 -57.48 -47.66 81.28 Favored 'General case' 0 C--O 1.217 -0.612 0 CA-C-O 117.217 -1.373 . . . . 0.0 111.315 170.693 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -61.13 -40.79 95.12 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 121.124 1.784 . . . . 0.0 113.519 -178.822 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -65.92 -51.58 57.37 Favored 'General case' 0 N--CA 1.478 0.965 0 CA-C-N 120.212 1.369 . . . . 0.0 111.896 175.253 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -55.28 -48.25 74.33 Favored 'General case' 0 C--O 1.215 -0.715 0 C-N-CA 122.921 0.488 . . . . 0.0 110.491 176.714 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.24 -33.19 75.19 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 126.772 2.029 . . . . 0.0 113.648 179.125 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 44.6 mttp -61.37 -31.46 71.35 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 120.163 1.347 . . . . 0.0 111.579 166.401 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 5.6 t -81.76 -24.86 35.78 Favored 'General case' 0 N--CA 1.484 1.262 0 N-CA-C 115.04 1.496 . . . . 0.0 115.04 165.281 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -137.8 72.69 48.23 Favored Pre-proline 0 CA--C 1.552 1.031 0 C-N-CA 127.708 2.403 . . . . 0.0 111.754 -165.42 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -61.52 -9.05 12.21 Favored 'Trans proline' 0 CA--C 1.547 1.13 0 C-N-CA 123.667 2.911 . . . . 0.0 116.296 -166.553 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 41.3 p90 -82.89 -15.15 52.58 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 126.267 1.827 . . . . 0.0 114.812 174.433 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 20.6 tp -60.54 134.82 57.45 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 114.514 1.301 . . . . 0.0 114.514 -162.612 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 6.7 mmp_? -74.92 155.0 37.91 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.753 1.221 . . . . 0.0 112.619 177.222 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.42 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -136.16 126.84 27.19 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 126.374 1.87 . . . . 0.0 109.989 -177.244 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 55.1 t0 -147.47 122.99 10.42 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.726 0.81 . . . . 0.0 110.738 171.663 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 3.4 ptt? -137.79 31.83 2.49 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.955 1.702 . . . . 0.0 111.707 173.888 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 27.1 t -62.12 152.62 32.41 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 121.582 -0.699 . . . . 0.0 110.143 161.529 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -53.82 -37.32 63.45 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 121.027 -1.046 . . . . 0.0 113.525 -169.831 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -61.32 -33.4 73.53 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.007 0.923 . . . . 0.0 112.729 176.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.4 -39.01 93.03 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 123.505 0.722 . . . . 0.0 111.777 173.778 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.98 -45.36 64.2 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 123.482 0.713 . . . . 0.0 109.301 179.246 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 10.8 m-30 -55.09 -46.46 75.49 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.032 0.533 . . . . 0.0 112.17 175.025 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.55 -31.02 41.96 Favored 'General case' 0 C--N 1.343 0.306 0 C-N-CA 124.712 1.205 . . . . 0.0 113.771 -172.683 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 86.0 mtt180 -82.78 -32.54 27.71 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.818 0.847 . . . . 0.0 112.854 173.853 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -126.86 73.93 75.95 Favored Pre-proline 0 CA--C 1.543 0.702 0 C-N-CA 125.723 1.609 . . . . 0.0 110.874 -173.737 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -66.71 -12.7 36.99 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 123.2 2.6 . . . . 0.0 113.874 -176.413 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 15.0 p-80 -73.65 -23.87 59.91 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.041 0.936 . . . . 0.0 113.258 170.482 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -85.79 -34.06 21.22 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.814 1.646 . . . . 0.0 112.102 -168.395 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 2.9 tmm_? . . . . . 0 C--O 1.256 1.397 0 C-N-CA 125.71 1.604 . . . . 0.0 111.117 176.681 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.9 ttt . . . . . 0 N--CA 1.495 1.82 0 CA-C-O 120.521 0.201 . . . . 0.0 110.762 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 80.2 mtp180 -142.19 160.99 39.13 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 125.995 1.718 . . . . 0.0 111.961 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 74.68 78.81 0.59 Allowed Glycine 0 CA--C 1.534 1.224 0 C-N-CA 124.992 1.282 . . . . 0.0 114.982 166.448 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.4 t -148.03 130.26 15.56 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.49 1.116 . . . . 0.0 111.541 170.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 52.9 t-80 -154.69 133.97 12.52 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.587 1.555 . . . . 0.0 110.798 176.206 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 87.7 m-70 -143.11 107.73 4.84 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.466 1.106 . . . . 0.0 111.134 -176.2 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 86.0 t60 -155.61 146.03 21.89 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.722 1.209 . . . . 0.0 112.244 173.177 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 78.2 t60 -154.2 143.68 21.5 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.149 1.38 . . . . 0.0 111.543 166.579 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 44.4 p-80 -150.15 152.33 34.54 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.145 1.378 . . . . 0.0 111.302 166.704 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 54.6 t-80 -154.36 143.63 21.29 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.241 1.016 . . . . 0.0 112.381 177.457 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 77.96 155.92 8.17 Favored Glycine 0 CA--C 1.539 1.536 0 C-N-CA 125.155 1.36 . . . . 0.0 115.605 173.809 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.3 t -159.13 148.94 18.95 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.961 1.704 . . . . 0.0 110.881 174.121 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.6 p -151.85 141.16 15.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 124.651 1.18 . . . . 0.0 111.877 176.611 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 68.5 m -141.99 140.5 32.7 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.779 1.632 . . . . 0.0 110.82 175.777 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 55.4 p90 -153.47 163.52 39.8 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.67 1.188 . . . . 0.0 112.758 -179.494 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 85.5 134.3 3.27 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 125.502 1.525 . . . . 0.0 114.156 178.041 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -150.85 65.98 7.16 Favored Pre-proline 0 CA--C 1.554 1.1 0 C-N-CA 125.443 1.497 . . . . 0.0 111.208 178.334 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -68.23 143.97 60.87 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 123.508 2.805 . . . . 0.0 113.062 -174.495 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 59.3 p -148.98 47.68 0.52 Allowed Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 125.088 1.355 . . . . 0.0 113.83 178.555 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -64.24 139.92 68.41 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 123.118 2.545 . . . . 0.0 112.838 -176.562 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.8 tt -152.15 118.85 5.72 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.171 1.388 . . . . 0.0 110.01 179.432 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 23.2 t -152.02 146.4 25.54 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.477 1.111 . . . . 0.0 111.776 170.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 79.2 p -145.16 12.64 1.4 Allowed 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.476 1.51 . . . . 0.0 113.797 -178.796 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -111.86 157.77 20.23 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.028 1.331 . . . . 0.0 113.355 -170.872 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 8.6 t -146.75 165.82 28.49 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.576 1.55 . . . . 0.0 111.436 176.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 61.15 -8.01 0.08 Allowed 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 127.732 2.413 . . . . 0.0 116.998 -179.64 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -68.07 -13.88 62.54 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.066 1.346 . . . . 0.0 114.249 -177.689 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -111.43 1.31 16.92 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.811 1.644 . . . . 0.0 113.107 173.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 27.1 mt -106.39 89.13 1.27 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 124.519 1.128 . . . . 0.0 110.548 -169.686 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -148.98 152.83 37.0 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.178 1.391 . . . . 0.0 110.512 169.832 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -71.94 162.43 29.47 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.526 0.73 . . . . 0.0 112.161 171.063 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 26.7 ttt -149.79 144.93 26.33 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.038 1.335 . . . . 0.0 110.55 172.219 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 16.9 p -71.46 151.94 93.98 Favored Pre-proline 0 N--CA 1.477 0.919 0 C-N-CA 124.238 1.015 . . . . 0.0 112.478 176.68 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -67.94 153.99 73.94 Favored 'Trans proline' 0 CA--C 1.546 1.1 0 C-N-CA 122.912 2.408 . . . . 0.0 112.447 178.064 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -70.6 157.06 59.84 Favored 'Trans proline' 0 CA--C 1.541 0.828 0 C-N-CA 123.422 2.748 . . . . 0.0 112.743 179.16 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 77.9 mm-40 -133.74 152.84 51.98 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.619 1.568 . . . . 0.0 111.498 176.226 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -76.1 139.55 41.4 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.615 0.766 . . . . 0.0 111.765 179.383 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -130.56 17.05 5.35 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 114.178 1.177 . . . . 0.0 114.178 178.839 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 52.35 51.37 16.37 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 126.554 1.942 . . . . 0.0 113.417 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -144.89 69.96 14.75 Favored Pre-proline 0 CA--C 1.55 0.966 0 C-N-CA 124.924 1.29 . . . . 0.0 110.478 -171.632 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -84.99 174.81 7.06 Favored 'Trans proline' 0 CA--C 1.545 1.031 0 C-N-CA 123.823 3.015 . . . . 0.0 113.632 -168.341 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 95.85 167.78 34.87 Favored Glycine 0 CA--C 1.538 1.531 0 C-N-CA 125.438 1.494 . . . . 0.0 114.818 177.432 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -128.07 16.79 6.72 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.226 1.41 . . . . 0.0 114.42 -172.259 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.4 mp -95.82 156.91 16.13 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.841 1.656 . . . . 0.0 110.739 174.629 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -135.19 131.49 36.79 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.112 0.965 . . . . 0.0 112.431 174.4 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -87.43 158.55 18.96 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.156 1.382 . . . . 0.0 111.227 167.204 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 96.6 mt -133.7 156.81 47.27 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.927 1.291 . . . . 0.0 112.379 -175.27 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 -79.41 137.48 37.28 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.438 0.695 . . . . 0.0 110.125 163.437 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -95.66 -15.11 22.93 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 -174.46 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -150.04 169.3 21.55 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.888 1.275 . . . . 0.0 112.944 -173.01 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.16 -164.5 54.91 Favored Glycine 0 CA--C 1.54 1.641 0 C-N-CA 124.107 0.861 . . . . 0.0 114.054 179.793 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -67.71 -17.42 47.66 Favored 'Trans proline' 0 CA--C 1.541 0.83 0 C-N-CA 123.312 2.675 . . . . 0.0 113.827 -176.091 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 98.0 mt -94.31 6.85 47.4 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.553 1.141 . . . . 0.0 113.878 175.225 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -54.67 122.06 9.83 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 120.829 1.649 . . . . 0.0 112.037 -178.262 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 82.3 8.32 86.49 Favored Glycine 0 CA--C 1.541 1.702 0 C-N-CA 125.138 1.351 . . . . 0.0 115.453 -175.409 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.453 ' HB3' ' HD2' ' A' ' 73' ' ' PRO . 25.4 mt -106.44 160.62 25.61 Favored Pre-proline 0 CA--C 1.558 1.256 0 C-N-CA 126.557 1.943 . . . . 0.0 111.189 178.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.453 ' HD2' ' HB3' ' A' ' 72' ' ' LEU . 50.1 Cg_endo -69.55 163.77 36.84 Favored 'Trans proline' 0 C--N 1.354 0.866 0 C-N-CA 124.386 3.391 . . . . 0.0 113.591 -169.975 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 11.3 t -105.83 -30.24 2.68 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 O-C-N 121.454 -0.779 . . . . 0.0 112.177 174.782 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 23.2 p -126.65 171.54 11.05 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 125.184 1.394 . . . . 0.0 114.099 -178.212 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 39.0 ttm180 -61.64 -37.98 86.0 Favored 'General case' 0 N--CA 1.48 1.054 0 O-C-N 121.487 -0.758 . . . . 0.0 110.947 171.879 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 10.1 t -59.47 -48.74 80.49 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 123.613 0.765 . . . . 0.0 110.331 172.845 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -60.44 -47.35 86.48 Favored 'General case' 0 CA--C 1.537 0.47 0 O-C-N 122.137 -0.352 . . . . 0.0 111.1 177.74 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.89 -44.32 97.03 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 118.733 0.697 . . . . 0.0 112.778 -179.592 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 57.8 ttm-85 -62.41 -46.98 86.1 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 119.112 0.869 . . . . 0.0 111.513 176.43 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 54.0 t -63.42 -46.23 95.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.055 0.942 . . . . 0.0 111.489 178.957 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 52.0 mt -60.66 -45.69 93.16 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 118.194 -0.908 . . . . 0.0 112.003 176.566 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 61.4 mt -54.58 -51.54 49.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 CA-C-N 119.263 0.938 . . . . 0.0 109.975 173.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.44 ' HB2' ' HE1' ' A' ' 101' ' ' MET . 17.5 t80 -62.91 -47.04 84.97 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -178.268 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 57.6 m-20 -69.7 -46.27 66.39 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.947 0.899 . . . . 0.0 112.051 -176.217 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -63.25 -44.62 94.66 Favored 'General case' 0 N--CA 1.465 0.303 0 O-C-N 121.993 -0.442 . . . . 0.0 111.551 176.343 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.444 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 66.7 t90 -61.11 -47.73 84.9 Favored 'General case' 0 C--O 1.219 -0.517 0 CA-C-O 117.622 -1.18 . . . . 0.0 111.226 172.988 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -54.48 -44.5 72.66 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 120.907 1.685 . . . . 0.0 112.883 178.916 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -67.44 -53.87 25.27 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 119.492 1.042 . . . . 0.0 112.632 176.157 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 77.2 mtm-85 -64.47 -35.0 79.52 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 121.275 -0.89 . . . . 0.0 111.885 -177.546 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.8 tmtt? -74.09 -30.13 62.2 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.359 1.464 . . . . 0.0 113.594 174.543 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -61.75 -35.27 77.63 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 120.051 1.296 . . . . 0.0 110.929 165.599 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 8.2 t -74.46 -34.27 63.1 Favored 'General case' 0 CA--C 1.553 1.086 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 167.425 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -133.78 80.65 55.0 Favored Pre-proline 0 CA--C 1.549 0.905 0 C-N-CA 127.029 2.132 . . . . 0.0 111.749 -168.212 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -61.8 -6.31 7.34 Favored 'Trans proline' 0 CA--C 1.546 1.091 0 C-N-CA 123.604 2.869 . . . . 0.0 116.345 -168.791 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 44.1 p90 -88.9 -3.93 58.6 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.694 1.998 . . . . 0.0 114.828 174.534 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.6 tp -66.57 133.38 50.2 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 120.09 1.313 . . . . 0.0 113.255 -173.607 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 50.9 ttp180 -85.11 152.27 23.52 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.233 1.413 . . . . 0.0 112.723 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.444 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -132.28 130.92 41.49 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.985 2.114 . . . . 0.0 109.826 -174.504 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -143.87 136.04 26.65 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.151 0.98 . . . . 0.0 110.754 176.818 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.44 ' HE1' ' HB2' ' A' ' 84' ' ' PHE . 66.4 mtt -132.63 15.71 4.4 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.769 1.228 . . . . 0.0 113.567 -177.193 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 74.7 m -69.37 154.18 42.43 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.457 -0.777 . . . . 0.0 110.925 172.533 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -56.94 -34.54 68.12 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 121.018 -1.051 . . . . 0.0 113.709 -168.572 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -61.64 -32.77 72.94 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 176.235 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.8 -39.72 92.74 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 119.182 0.901 . . . . 0.0 111.665 174.287 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -74.11 -46.57 44.83 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 C-N-CA 124.536 1.134 . . . . 0.0 109.478 179.831 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 13.8 m-30 -54.94 -45.21 74.83 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 119.064 0.847 . . . . 0.0 112.416 175.865 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -76.6 -38.3 55.02 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.909 1.284 . . . . 0.0 112.227 -173.915 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 72.6 mtt85 -70.14 -39.14 75.56 Favored 'General case' 0 N--CA 1.483 1.213 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 171.342 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 29.7 m-85 -130.59 82.81 63.91 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 125.435 1.494 . . . . 0.0 110.988 -165.61 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -69.05 -5.74 16.51 Favored 'Trans proline' 0 CA--C 1.54 0.788 0 C-N-CA 123.728 2.952 . . . . 0.0 114.726 -172.262 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 7.6 p-80 -86.92 -20.51 27.27 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.144 1.378 . . . . 0.0 113.801 170.787 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -92.39 -14.1 29.14 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 125.881 1.673 . . . . 0.0 113.679 -171.968 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 14.0 ptt180 . . . . . 0 C--O 1.253 1.261 0 C-N-CA 125.251 1.42 . . . . 0.0 113.515 173.297 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.9 mtp . . . . . 0 N--CA 1.498 1.964 0 N-CA-C 111.094 0.035 . . . . 0.0 111.094 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 54.2 ttp85 51.02 46.65 26.13 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 126.3 1.84 . . . . 0.0 114.191 175.31 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -73.33 95.36 0.76 Allowed Glycine 0 CA--C 1.534 1.238 0 C-N-CA 124.26 0.933 . . . . 0.0 111.773 176.474 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 39.8 m 59.39 171.4 0.07 Allowed 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 126.472 1.909 . . . . 0.0 114.708 -171.39 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 32.8 p80 -77.14 163.19 26.82 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.912 0.885 . . . . 0.0 111.992 171.177 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 50.5 m80 -100.28 -85.45 0.41 Allowed 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.174 0.99 . . . . 0.0 111.873 -174.168 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 95.5 m-70 -144.2 -59.52 0.38 Allowed 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.321 1.449 . . . . 0.0 111.031 175.734 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 52.7 t-80 -155.24 148.87 25.28 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.885 1.674 . . . . 0.0 111.001 176.326 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -136.7 148.31 47.27 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.306 1.442 . . . . 0.0 111.506 175.22 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 56.4 t-80 -145.3 151.87 39.02 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.905 1.282 . . . . 0.0 112.376 -177.884 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -175.03 153.4 15.54 Favored Glycine 0 CA--C 1.536 1.386 0 C-N-CA 125.213 1.387 . . . . 0.0 112.493 173.305 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 66.1 m -138.92 146.99 41.73 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.115 1.366 . . . . 0.0 112.09 -176.75 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 23.9 m -138.29 152.95 26.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 125.636 1.574 . . . . 0.0 111.66 176.027 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 21.3 t -151.4 146.82 26.24 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.075 1.35 . . . . 0.0 110.916 175.083 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -138.96 148.57 43.69 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.888 1.275 . . . . 0.0 112.328 -172.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 81.89 129.93 1.2 Allowed Glycine 0 CA--C 1.538 1.492 0 C-N-CA 125.201 1.381 . . . . 0.0 113.26 -175.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -150.39 73.12 9.14 Favored Pre-proline 0 CA--C 1.553 1.06 0 C-N-CA 124.905 1.282 . . . . 0.0 111.336 -178.007 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -66.54 146.65 80.33 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 123.298 2.665 . . . . 0.0 112.481 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 33.3 p -146.17 60.54 6.39 Favored Pre-proline 0 N--CA 1.477 0.903 0 C-N-CA 124.782 1.233 . . . . 0.0 113.051 -174.531 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -62.16 142.85 93.41 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 123.17 2.58 . . . . 0.0 112.138 177.489 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -136.3 12.77 3.28 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 115.448 1.647 . . . . 0.0 115.448 -168.615 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 37.1 t -146.17 145.25 30.4 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.678 1.191 . . . . 0.0 112.157 178.754 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.4 t -141.12 19.07 2.27 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.914 1.685 . . . . 0.0 111.601 171.241 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.4 mp0 -105.56 153.21 22.08 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.798 1.639 . . . . 0.0 112.629 -168.218 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 6.7 t -137.07 53.39 1.89 Allowed 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.718 1.607 . . . . 0.0 110.663 179.135 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 58.67 14.18 3.0 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 126.246 1.819 . . . . 0.0 114.882 -174.522 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -81.01 -14.27 58.07 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.994 1.718 . . . . 0.0 114.959 -173.595 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -130.98 1.96 4.32 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 125.58 1.552 . . . . 0.0 113.03 176.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 17.4 mm -91.48 60.23 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 124.815 1.246 . . . . 0.0 110.225 -171.121 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 50.1 t-20 -144.07 107.96 4.7 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.509 1.524 . . . . 0.0 110.092 179.061 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 51.0 p90 -153.85 168.02 27.75 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.336 1.454 . . . . 0.0 112.058 -174.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 38.5 ttm 57.51 48.77 13.88 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.383 1.473 . . . . 0.0 113.119 -177.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 18.7 p -126.56 55.21 13.38 Favored Pre-proline 0 N--CA 1.48 1.058 0 C-N-CA 125.953 1.701 . . . . 0.0 113.112 -178.563 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -67.42 155.18 71.42 Favored 'Trans proline' 0 CA--C 1.549 1.229 0 C-N-CA 123.118 2.545 . . . . 0.0 112.689 178.424 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -72.37 151.72 54.23 Favored 'Trans proline' 0 CA--C 1.54 0.824 0 C-N-CA 123.416 2.744 . . . . 0.0 112.718 177.836 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -96.37 -20.01 18.79 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 179.699 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -149.79 37.17 0.72 Allowed 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.91 1.284 . . . . 0.0 112.098 -175.559 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -145.13 179.53 7.3 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 125.476 1.51 . . . . 0.0 111.151 -178.364 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 57.38 33.54 23.42 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 125.949 1.699 . . . . 0.0 114.58 -179.423 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -147.14 74.7 11.83 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 125.488 1.515 . . . . 0.0 109.385 176.374 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -82.81 60.9 7.34 Favored 'Trans proline' 0 CA--C 1.546 1.085 0 C-N-CA 124.151 3.234 . . . . 0.0 111.953 -170.098 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 77.9 173.1 40.29 Favored Glycine 0 CA--C 1.538 1.521 0 C-N-CA 125.089 1.328 . . . . 0.0 113.553 -169.532 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -148.81 133.22 17.57 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.389 1.076 . . . . 0.0 112.271 -179.674 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -127.32 153.91 45.6 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.301 1.84 . . . . 0.0 110.39 175.821 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -141.72 144.63 34.15 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.455 1.102 . . . . 0.0 113.073 173.279 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -91.33 155.78 18.26 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.152 1.381 . . . . 0.0 111.466 166.811 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 88.0 mt -132.5 158.03 43.14 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 125.05 1.34 . . . . 0.0 112.31 -174.201 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 -85.3 142.28 29.46 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.901 0.88 . . . . 0.0 110.042 163.001 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -102.48 -11.47 18.54 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 -171.783 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -149.19 167.12 26.83 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.658 1.183 . . . . 0.0 113.166 -172.794 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.02 -161.01 53.21 Favored Glycine 0 CA--C 1.541 1.709 0 C-N-CA 124.062 0.839 . . . . 0.0 113.854 179.645 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -67.63 -16.41 46.69 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 123.163 2.575 . . . . 0.0 113.563 -177.851 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 97.7 mt -93.3 5.22 52.27 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.657 1.183 . . . . 0.0 113.95 176.015 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.61 120.84 8.44 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-N 121.114 1.779 . . . . 0.0 112.025 -178.655 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 82.55 7.23 87.76 Favored Glycine 0 CA--C 1.54 1.652 0 C-N-CA 125.402 1.477 . . . . 0.0 115.45 -174.802 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.455 ' HB3' ' HD2' ' A' ' 73' ' ' PRO . 16.3 mt -104.68 159.86 27.92 Favored Pre-proline 0 CA--C 1.558 1.287 0 C-N-CA 126.371 1.868 . . . . 0.0 111.445 -178.66 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.455 ' HD2' ' HB3' ' A' ' 72' ' ' LEU . 68.5 Cg_endo -71.9 163.92 37.3 Favored 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 124.63 3.554 . . . . 0.0 114.163 -168.029 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 10.5 t -108.88 -26.55 3.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 123.902 0.881 . . . . 0.0 112.52 176.299 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 22.3 p -127.05 172.0 10.87 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 125.508 1.523 . . . . 0.0 113.924 178.292 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -64.83 -36.8 85.51 Favored 'General case' 0 N--CA 1.484 1.264 0 O-C-N 121.183 -0.948 . . . . 0.0 111.251 173.835 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 32.5 m -61.59 -46.82 88.24 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.948 0.899 . . . . 0.0 111.017 171.095 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -59.36 -46.55 88.33 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 118.776 0.716 . . . . 0.0 111.014 175.824 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.47 -41.55 98.85 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.692 0.797 . . . . 0.0 112.698 -178.671 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 60.6 mtp85 -67.81 -39.15 84.01 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.517 0.727 . . . . 0.0 112.396 175.401 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 73.4 t -64.15 -46.56 93.24 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.112 0 CA-C-N 118.847 0.748 . . . . 0.0 111.312 174.255 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.7 mp -60.29 -45.3 93.83 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 118.417 -0.802 . . . . 0.0 112.506 175.439 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 51.1 mt -54.4 -49.86 61.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 CA-C-N 118.969 0.804 . . . . 0.0 110.187 172.303 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 13.8 t80 -63.39 -51.25 66.62 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -177.305 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -67.11 -43.88 81.33 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 119.103 0.865 . . . . 0.0 112.455 -177.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -56.44 -52.69 63.72 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.237 0.615 . . . . 0.0 110.127 174.551 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.4 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 62.9 t90 -59.01 -47.76 84.03 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-O 117.09 -1.433 . . . . 0.0 111.631 176.59 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -56.62 -47.58 79.34 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 121.262 1.846 . . . . 0.0 113.249 -179.76 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -68.26 -47.7 67.03 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 119.516 1.053 . . . . 0.0 111.938 179.264 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 15.8 mmp_? -61.47 -44.57 96.86 Favored 'General case' 0 C--O 1.216 -0.702 0 O-C-N 121.642 -0.661 . . . . 0.0 110.596 178.507 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -61.75 -35.64 78.69 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 126.102 1.761 . . . . 0.0 113.147 174.335 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 63.0 tttm -62.34 -34.64 77.04 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 119.225 0.92 . . . . 0.0 111.263 170.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 7.9 t -77.72 -29.69 51.35 Favored 'General case' 0 CA--C 1.555 1.168 0 N-CA-C 114.762 1.393 . . . . 0.0 114.762 166.914 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -133.39 81.21 55.87 Favored Pre-proline 0 N--CA 1.476 0.86 0 C-N-CA 127.511 2.324 . . . . 0.0 111.94 -165.643 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -63.94 7.37 0.21 Allowed 'Trans proline' 0 CA--C 1.551 1.337 0 C-N-CA 124.456 3.437 . . . . 0.0 117.009 -169.762 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 39.5 p90 -105.24 -6.01 20.12 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 127.199 2.2 . . . . 0.0 114.785 176.33 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 12.9 tp -66.61 139.46 57.89 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.65 1.352 . . . . 0.0 114.65 -168.327 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 18.2 mmt85 -97.98 158.17 15.69 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 125.342 1.457 . . . . 0.0 112.908 -178.154 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.4 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -139.16 129.81 25.98 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 126.333 1.853 . . . . 0.0 110.297 -167.813 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -147.3 134.33 20.35 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.208 1.003 . . . . 0.0 111.19 177.475 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 64.4 mtt -131.14 3.65 4.36 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -172.183 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 70.4 m -63.84 153.25 37.28 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.541 0.736 . . . . 0.0 110.904 172.068 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -55.34 -33.25 63.19 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 -166.554 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 57.6 mtmt -59.4 -35.46 74.01 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.851 0.86 . . . . 0.0 113.285 174.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.52 -39.59 94.05 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.209 0.913 . . . . 0.0 111.723 173.836 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.77 -46.48 61.18 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 C-N-CA 124.212 1.005 . . . . 0.0 109.276 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 13.2 m-30 -56.66 -45.55 81.58 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 118.737 0.699 . . . . 0.0 112.511 174.907 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.4 tmt_? -75.74 -37.18 59.57 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.482 1.113 . . . . 0.0 112.255 -172.639 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 37.3 mtp85 -70.99 -38.83 72.7 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 118.587 0.63 . . . . 0.0 112.665 169.397 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -131.27 83.57 59.36 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 125.23 1.412 . . . . 0.0 111.263 -167.638 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -66.88 -18.52 52.59 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 122.846 2.364 . . . . 0.0 113.977 -172.742 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 8.8 p-80 -72.29 -24.56 61.35 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.901 0.88 . . . . 0.0 113.187 173.329 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.14 -14.01 48.37 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 126.004 1.722 . . . . 0.0 113.296 -175.837 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.326 0 C-N-CA 124.821 1.249 . . . . 0.0 112.723 178.578 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.6 ttp . . . . . 0 N--CA 1.495 1.811 0 CA-C-O 119.398 -0.334 . . . . 0.0 110.85 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 64.29 158.17 0.09 Allowed 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 127.268 2.227 . . . . 0.0 114.455 -177.344 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 81.24 151.24 8.05 Favored Glycine 0 CA--C 1.538 1.507 0 C-N-CA 125.281 1.42 . . . . 0.0 114.297 -178.734 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 21.4 t -157.76 150.94 23.29 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.43 1.492 . . . . 0.0 111.301 177.757 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 19.4 p80 -151.05 156.1 40.39 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.107 1.363 . . . . 0.0 112.223 174.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 23.0 p80 -154.47 159.83 41.25 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.344 1.458 . . . . 0.0 111.558 174.229 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 20.5 p80 -153.07 155.61 37.17 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.646 1.179 . . . . 0.0 112.267 172.462 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 75.6 t60 -154.65 145.47 22.48 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.258 1.423 . . . . 0.0 111.145 171.667 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 18.1 p80 -154.45 152.94 30.73 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.781 1.233 . . . . 0.0 112.255 173.137 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 77.6 t60 -153.89 155.85 36.46 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.501 1.52 . . . . 0.0 111.004 170.471 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -172.21 33.17 0.13 Allowed Glycine 0 CA--C 1.535 1.292 0 N-CA-C 116.508 1.363 . . . . 0.0 116.508 -177.246 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 85.0 p -141.89 154.53 45.19 Favored 'General case' 0 N--CA 1.478 0.975 0 CA-C-N 118.969 1.385 . . . . 0.0 113.949 -178.191 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 12.7 p -156.71 -42.61 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.197 0 C-N-CA 124.54 1.136 . . . . 0.0 112.492 171.654 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 39.3 m 61.85 149.28 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 127.423 2.289 . . . . 0.0 115.377 -174.716 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -141.82 -15.66 0.8 Allowed 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 115.046 1.498 . . . . 0.0 115.046 -175.676 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -66.84 132.53 31.57 Favored Glycine 0 CA--C 1.536 1.377 0 O-C-N 121.108 -0.995 . . . . 0.0 113.5 -177.363 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -147.85 68.61 10.74 Favored Pre-proline 0 CA--C 1.553 1.074 0 C-N-CA 125.098 1.359 . . . . 0.0 111.479 -179.255 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -69.64 153.1 69.89 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 123.47 2.78 . . . . 0.0 112.775 -179.411 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 70.4 m -135.32 67.31 67.58 Favored Pre-proline 0 N--CA 1.475 0.812 0 C-N-CA 125.054 1.342 . . . . 0.0 111.926 -177.193 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -65.66 141.74 67.66 Favored 'Trans proline' 0 CA--C 1.542 0.904 0 C-N-CA 123.2 2.6 . . . . 0.0 111.939 177.863 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 27.0 tp -135.25 -10.69 2.21 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 114.336 1.235 . . . . 0.0 114.336 -171.882 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 32.1 p -79.15 141.54 37.16 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.362 1.065 . . . . 0.0 113.082 -178.76 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 47.4 m -139.27 19.42 2.58 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.841 1.256 . . . . 0.0 113.697 -174.301 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 54.76 30.94 14.48 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 125.241 1.417 . . . . 0.0 113.527 -173.093 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 29.9 p -87.95 154.77 20.25 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.123 1.769 . . . . 0.0 112.932 -179.589 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 59.41 15.44 4.42 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 115.734 1.753 . . . . 0.0 115.734 179.758 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -77.29 96.47 4.6 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 121.15 -0.969 . . . . 0.0 110.127 169.06 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 57.5 20.0 5.75 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 126.546 1.938 . . . . 0.0 115.91 177.434 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 40.9 pt -61.8 -17.4 17.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 O-C-N 120.248 -1.533 . . . . 0.0 114.969 -170.586 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -74.07 -16.61 61.03 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.085 0.954 . . . . 0.0 113.394 175.65 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 34.4 t80 -136.83 -19.91 1.32 Allowed 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 114.597 1.332 . . . . 0.0 114.597 -177.502 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 24.1 ttt -78.02 55.28 1.43 Allowed 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.5 1.52 . . . . 0.0 111.981 178.239 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 18.8 p -134.78 60.49 41.92 Favored Pre-proline 0 N--CA 1.477 0.898 0 C-N-CA 127.0 2.12 . . . . 0.0 111.193 -174.449 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -67.88 160.69 47.29 Favored 'Trans proline' 0 CA--C 1.549 1.245 0 C-N-CA 123.567 2.845 . . . . 0.0 113.326 -175.692 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -78.77 56.41 5.94 Favored 'Trans proline' 0 CA--C 1.545 1.062 0 C-N-CA 124.791 3.661 . . . . 0.0 112.11 178.449 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -125.64 152.25 45.45 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 127.138 2.175 . . . . 0.0 111.302 -174.121 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -130.49 -36.04 1.47 Allowed 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 114.416 1.265 . . . . 0.0 114.416 -177.768 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -149.99 145.66 26.57 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.993 1.317 . . . . 0.0 112.258 177.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -151.49 45.65 0.79 Allowed 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.072 1.349 . . . . 0.0 111.993 -174.361 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 16.7 pt20 -143.74 59.37 7.18 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 124.371 1.068 . . . . 0.0 112.574 -171.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -77.44 -21.72 11.41 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 122.931 2.421 . . . . 0.0 114.122 -168.765 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 68.76 19.8 73.6 Favored Glycine 0 CA--C 1.538 1.527 0 N-CA-C 115.959 1.144 . . . . 0.0 115.959 170.847 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -144.74 152.15 39.95 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.913 1.285 . . . . 0.0 112.633 -175.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -112.0 167.76 10.13 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.965 2.106 . . . . 0.0 112.175 175.626 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -117.49 128.13 54.68 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.352 1.061 . . . . 0.0 112.611 177.421 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -87.01 146.33 26.16 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.725 1.21 . . . . 0.0 110.922 166.11 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.9 mt -128.13 157.54 40.48 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.449 1.1 . . . . 0.0 112.707 -169.785 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -77.82 138.11 38.78 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.901 0.88 . . . . 0.0 110.428 166.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -95.25 -15.13 23.44 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 114.478 1.288 . . . . 0.0 114.478 -175.21 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -150.19 169.72 20.65 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.876 1.27 . . . . 0.0 113.088 -172.54 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.2 -164.75 54.91 Favored Glycine 0 CA--C 1.54 1.605 0 C-N-CA 124.184 0.897 . . . . 0.0 114.138 179.385 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -67.69 -17.13 47.69 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 123.325 2.683 . . . . 0.0 113.788 -176.324 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.8 mt -94.58 6.61 48.34 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.785 1.234 . . . . 0.0 113.815 175.824 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -54.57 123.33 12.81 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 120.952 1.705 . . . . 0.0 112.256 -177.228 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 82.41 3.13 90.65 Favored Glycine 0 CA--C 1.541 1.678 0 C-N-CA 125.501 1.524 . . . . 0.0 115.378 -174.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.419 ' HB3' ' HD2' ' A' ' 73' ' ' PRO . 20.9 mt -102.01 163.54 17.56 Favored Pre-proline 0 CA--C 1.555 1.156 0 C-N-CA 126.265 1.826 . . . . 0.0 110.888 179.411 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.419 ' HD2' ' HB3' ' A' ' 72' ' ' LEU . 73.7 Cg_endo -76.33 157.33 37.21 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 124.186 3.257 . . . . 0.0 113.383 -164.943 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 35.3 t -92.99 -35.88 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 O-C-N 121.533 -0.729 . . . . 0.0 112.502 174.511 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 19.6 p -123.29 172.67 8.47 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 114.716 1.376 . . . . 0.0 114.716 -177.501 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 15.0 ptp180 -61.73 -36.66 81.61 Favored 'General case' 0 N--CA 1.482 1.162 0 O-C-N 121.448 -0.783 . . . . 0.0 111.934 173.148 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 25.3 m -66.07 -44.31 84.88 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.895 0.878 . . . . 0.0 110.705 173.16 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -61.23 -42.21 98.22 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 121.714 -0.616 . . . . 0.0 111.401 175.914 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.09 -44.48 92.23 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.105 0.962 . . . . 0.0 112.831 177.639 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 81.1 mtp180 -66.12 -40.7 90.9 Favored 'General case' 0 N--CA 1.478 0.974 0 O-C-N 121.415 -0.803 . . . . 0.0 112.262 176.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 78.4 t -63.79 -45.85 96.06 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 123.356 0.663 . . . . 0.0 111.071 174.159 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 15.8 mt -57.26 -48.88 77.75 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 118.466 -0.778 . . . . 0.0 112.035 174.11 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 52.8 mt -54.48 -49.42 65.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 CA-C-N 118.736 0.698 . . . . 0.0 110.294 176.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.405 ' HB2' ' HE1' ' A' ' 101' ' ' MET . 13.6 t80 -64.79 -51.62 61.23 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -179.32 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.9 t30 -66.36 -43.8 84.96 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 118.639 0.654 . . . . 0.0 112.544 -176.908 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -60.62 -51.27 70.11 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 118.845 -0.598 . . . . 0.0 110.025 174.044 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.405 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 62.5 t90 -56.26 -46.26 79.71 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-O 118.001 -0.999 . . . . 0.0 112.5 176.216 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -56.38 -51.31 68.78 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 120.053 1.297 . . . . 0.0 112.491 177.288 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -70.09 -45.58 66.66 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 119.75 1.159 . . . . 0.0 112.488 -178.112 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 58.1 mmt-85 -55.91 -44.01 77.88 Favored 'General case' 0 N--CA 1.475 0.789 0 O-C-N 121.839 -0.538 . . . . 0.0 109.642 174.327 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 78.8 tttt -69.24 -33.24 72.97 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 178.388 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -59.32 -32.5 70.12 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 119.941 1.246 . . . . 0.0 111.137 167.537 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 67.1 m -81.6 -24.26 36.57 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 115.374 1.62 . . . . 0.0 115.374 166.334 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -145.77 78.93 11.46 Favored Pre-proline 0 CA--C 1.552 1.029 0 C-N-CA 126.758 2.023 . . . . 0.0 111.974 -164.787 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_endo -60.87 -7.51 7.81 Favored 'Trans proline' 0 CA--C 1.548 1.209 0 C-N-CA 123.605 2.87 . . . . 0.0 116.682 -167.56 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 42.2 p90 -86.46 -2.8 58.76 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 126.996 2.118 . . . . 0.0 115.25 176.036 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.35 133.28 52.74 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 124.714 1.206 . . . . 0.0 114.153 -173.975 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -88.77 152.18 21.94 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 125.278 1.431 . . . . 0.0 113.0 176.628 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.405 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.3 tm? -133.36 129.22 37.15 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.63 1.572 . . . . 0.0 110.494 -174.06 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -145.99 134.98 22.61 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.319 1.048 . . . . 0.0 110.843 174.63 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.405 ' HE1' ' HB2' ' A' ' 84' ' ' PHE . 66.8 mtt -129.81 12.48 5.77 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.739 1.216 . . . . 0.0 113.818 -176.284 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 75.3 m -66.99 153.62 43.19 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 121.345 -0.847 . . . . 0.0 111.11 174.247 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -55.17 -36.08 65.47 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -169.802 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 59.2 mtmt -61.41 -33.19 73.27 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.052 0.941 . . . . 0.0 113.323 176.068 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.01 -40.43 97.73 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 119.194 0.906 . . . . 0.0 111.632 173.206 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.86 -46.14 61.93 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 C-N-CA 123.833 0.853 . . . . 0.0 109.541 -179.819 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 16.5 m-30 -55.58 -47.01 77.14 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.364 0.666 . . . . 0.0 112.641 174.699 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.4 tmt_? -77.51 -36.77 52.24 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 124.292 1.037 . . . . 0.0 112.254 -172.254 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 51.1 ttt85 -75.73 -34.56 60.35 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.831 0.852 . . . . 0.0 112.629 174.632 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 35.6 m-85 -130.74 88.64 45.75 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 125.588 1.555 . . . . 0.0 110.871 -175.316 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -67.51 -19.77 48.35 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 123.057 2.504 . . . . 0.0 114.6 -168.201 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 7.9 p-80 -73.78 -22.48 59.82 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.783 0.833 . . . . 0.0 113.07 173.789 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.5 4.96 37.61 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 126.571 1.948 . . . . 0.0 113.636 -177.773 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.256 1.402 0 C-N-CA 125.412 1.485 . . . . 0.0 111.433 172.255 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.8 ttt . . . . . 0 N--CA 1.495 1.817 0 CA-C-O 119.877 -0.106 . . . . 0.0 110.774 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 73.4 ttp85 -133.89 139.28 46.08 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 125.349 1.46 . . . . 0.0 111.601 179.634 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 80.4 136.31 1.64 Allowed Glycine 0 CA--C 1.539 1.56 0 C-N-CA 125.598 1.57 . . . . 0.0 114.042 179.607 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.4 t -150.68 33.13 0.62 Allowed 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.991 1.316 . . . . 0.0 111.9 178.345 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -91.04 135.88 33.45 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.426 1.09 . . . . 0.0 112.724 -167.981 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 13.4 p80 -153.8 142.96 21.37 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.177 1.391 . . . . 0.0 111.683 172.966 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -146.28 139.26 25.63 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.577 1.551 . . . . 0.0 110.792 177.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 15.8 p-80 -156.11 119.78 4.37 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.361 1.064 . . . . 0.0 111.87 177.52 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 65.4 m80 -145.72 115.39 7.26 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.629 1.572 . . . . 0.0 109.546 177.739 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 39.8 t-80 -155.84 151.74 27.53 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.813 0.845 . . . . 0.0 113.086 -177.148 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 82.77 148.77 7.73 Favored Glycine 0 CA--C 1.538 1.492 0 C-N-CA 125.361 1.458 . . . . 0.0 115.391 172.378 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 79.6 p -158.08 158.32 34.53 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 126.154 1.782 . . . . 0.0 111.617 175.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.3 p -151.54 140.94 15.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 124.492 1.117 . . . . 0.0 111.595 175.644 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.6 p -156.02 153.66 29.83 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.448 1.499 . . . . 0.0 111.797 174.074 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -153.69 156.09 37.19 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.028 1.331 . . . . 0.0 112.295 177.041 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 78.46 148.52 3.93 Favored Glycine 0 CA--C 1.54 1.614 0 C-N-CA 125.1 1.333 . . . . 0.0 114.228 -178.219 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -150.36 64.45 6.67 Favored Pre-proline 0 CA--C 1.555 1.142 0 C-N-CA 124.996 1.318 . . . . 0.0 111.941 179.133 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -68.68 131.09 21.99 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 123.19 2.594 . . . . 0.0 112.082 -179.29 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 73.2 m -140.58 68.97 31.55 Favored Pre-proline 0 N--CA 1.477 0.898 0 C-N-CA 125.162 1.385 . . . . 0.0 111.101 -178.497 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_endo -67.69 154.73 72.51 Favored 'Trans proline' 0 CA--C 1.543 0.96 0 C-N-CA 123.362 2.708 . . . . 0.0 112.492 179.581 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.1 mp -77.38 -21.38 53.31 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.893 0.877 . . . . 0.0 113.23 -176.499 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 14.0 t -151.97 159.6 43.72 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.636 1.575 . . . . 0.0 111.493 175.579 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.6 t -150.14 -42.51 0.13 Allowed 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.364 1.066 . . . . 0.0 112.458 178.566 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.6 mp0 -70.84 119.38 14.89 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.521 1.128 . . . . 0.0 112.274 -177.013 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 3.4 t -149.41 36.32 0.73 Allowed 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.627 1.171 . . . . 0.0 112.234 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -136.76 4.59 2.81 Favored 'General case' 0 N--CA 1.478 0.925 0 N-CA-C 114.989 1.477 . . . . 0.0 114.989 -169.491 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -72.86 -24.67 60.9 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 -173.103 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -139.76 14.86 2.5 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.935 1.694 . . . . 0.0 113.786 179.035 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 46.5 mt -130.25 125.33 59.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 125.1 1.36 . . . . 0.0 110.468 -170.635 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -152.91 159.8 43.01 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.595 1.558 . . . . 0.0 111.499 171.258 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -81.82 159.88 23.65 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.773 0.829 . . . . 0.0 111.698 169.548 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 64.7 mtt -126.78 -36.21 2.24 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.749 1.22 . . . . 0.0 112.538 171.563 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 19.6 p -132.09 60.37 50.75 Favored Pre-proline 0 N--CA 1.48 1.049 0 C-N-CA 125.941 1.696 . . . . 0.0 111.538 178.11 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_endo -65.82 155.4 69.48 Favored 'Trans proline' 0 CA--C 1.548 1.221 0 C-N-CA 123.21 2.607 . . . . 0.0 112.63 -178.569 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -73.59 112.95 3.66 Favored 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 123.456 2.771 . . . . 0.0 112.174 -177.437 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -142.91 8.51 1.68 Allowed 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.567 1.321 . . . . 0.0 114.567 179.198 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 -138.41 49.45 1.91 Allowed 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 124.68 1.192 . . . . 0.0 111.965 -168.705 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -125.28 126.13 44.63 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.139 1.376 . . . . 0.0 111.108 177.497 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -145.36 21.42 1.53 Allowed 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 124.519 1.128 . . . . 0.0 113.885 -174.137 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 57.1 tp60 -150.85 79.58 7.01 Favored Pre-proline 0 CA--C 1.544 0.748 0 C-N-CA 124.838 1.255 . . . . 0.0 109.213 -176.816 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -82.5 68.96 7.55 Favored 'Trans proline' 0 CA--C 1.543 0.957 0 C-N-CA 123.869 3.046 . . . . 0.0 111.276 -170.689 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 81.76 171.99 46.51 Favored Glycine 0 CA--C 1.537 1.413 0 C-N-CA 125.278 1.418 . . . . 0.0 113.178 -166.074 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -152.58 137.24 16.93 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.824 1.25 . . . . 0.0 111.718 176.713 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -126.94 151.12 48.92 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.779 1.631 . . . . 0.0 110.888 178.485 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -132.61 126.62 33.13 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.559 1.144 . . . . 0.0 111.932 171.723 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -87.2 143.44 27.29 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.426 1.091 . . . . 0.0 110.938 169.722 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 59.9 mt -127.9 157.51 40.33 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.517 1.127 . . . . 0.0 112.482 -170.696 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 93.5 m-70 -79.1 139.15 38.15 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.939 0.896 . . . . 0.0 110.242 167.483 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -94.19 -23.68 17.81 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -174.663 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -141.14 166.44 24.76 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.192 1.397 . . . . 0.0 112.61 -170.664 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 74.18 -163.86 54.6 Favored Glycine 0 CA--C 1.539 1.574 0 C-N-CA 124.277 0.942 . . . . 0.0 114.166 178.056 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -67.41 -17.21 49.1 Favored 'Trans proline' 0 CA--C 1.541 0.86 0 C-N-CA 123.281 2.654 . . . . 0.0 113.778 -175.988 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.9 mt -93.49 5.11 52.7 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.656 1.182 . . . . 0.0 113.81 175.377 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.26 123.61 14.33 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 120.954 1.707 . . . . 0.0 112.318 -176.783 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 81.98 2.9 90.69 Favored Glycine 0 CA--C 1.541 1.681 0 C-N-CA 125.71 1.624 . . . . 0.0 115.339 -174.831 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 17.0 mt -101.63 162.49 20.27 Favored Pre-proline 0 CA--C 1.557 1.224 0 C-N-CA 126.07 1.748 . . . . 0.0 110.951 -179.107 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -77.69 155.29 31.14 Favored 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 124.113 3.209 . . . . 0.0 113.751 -164.107 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 45.1 t -91.53 -36.44 7.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 CA-C-O 118.514 -0.755 . . . . 0.0 112.574 175.271 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 16.9 p -124.68 172.77 9.01 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 115.038 1.496 . . . . 0.0 115.038 -177.425 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 56.5 ttt180 -59.26 -41.36 88.63 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 125.253 1.421 . . . . 0.0 111.192 174.605 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.3 t -62.71 -47.32 84.09 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 123.612 0.765 . . . . 0.0 110.832 171.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 69.0 m-20 -60.08 -42.21 94.12 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.418 -0.801 . . . . 0.0 111.862 178.341 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.04 -43.52 92.06 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.63 0.772 . . . . 0.0 112.696 177.486 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 92.5 mtt180 -66.63 -38.33 86.69 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 121.163 -0.961 . . . . 0.0 113.005 175.55 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 77.6 t -66.31 -43.49 91.48 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 CA-C-N 118.835 0.743 . . . . 0.0 111.321 174.498 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 16.5 mt -56.82 -48.39 78.1 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 118.595 0.634 . . . . 0.0 112.173 172.542 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 59.9 mt -54.83 -51.26 54.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 122.943 0.497 . . . . 0.0 110.082 175.364 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.466 ' HB2' ' HE1' ' A' ' 101' ' ' MET . 15.0 t80 -65.09 -48.0 75.25 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -177.001 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 20.1 t30 -69.64 -45.04 69.36 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.502 0.721 . . . . 0.0 112.246 -176.43 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 48.0 tt0 -66.04 -44.96 83.13 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 118.113 -0.946 . . . . 0.0 110.849 175.771 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.428 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 66.1 t90 -58.35 -46.0 87.11 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 119.987 1.267 . . . . 0.0 111.588 173.4 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -55.3 -46.15 76.23 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 120.71 1.595 . . . . 0.0 112.768 177.415 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -68.54 -52.24 34.18 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 119.533 1.061 . . . . 0.0 112.766 177.237 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 38.6 mmt180 -57.01 -45.34 83.12 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.447 0.699 . . . . 0.0 110.281 179.243 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.8 tmtt? -70.8 -29.49 65.68 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.785 1.634 . . . . 0.0 113.477 178.451 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 65.4 tttm -60.71 -35.34 76.07 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 120.237 1.381 . . . . 0.0 110.933 165.714 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 61.1 m -80.04 -23.47 41.39 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 115.226 1.565 . . . . 0.0 115.226 167.265 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -140.0 75.39 29.71 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 126.883 2.073 . . . . 0.0 111.8 -167.795 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -61.35 -6.23 6.49 Favored 'Trans proline' 0 CA--C 1.547 1.147 0 C-N-CA 123.947 3.098 . . . . 0.0 116.59 -167.246 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 41.3 p90 -87.44 -8.3 56.66 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 126.648 1.979 . . . . 0.0 114.938 174.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 16.2 tp -65.24 136.55 56.75 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 119.857 1.208 . . . . 0.0 114.048 -168.851 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 82.3 mtt85 -83.44 155.97 23.15 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.894 1.277 . . . . 0.0 113.084 179.094 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.428 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.4 tm? -138.8 128.29 24.54 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 126.606 1.962 . . . . 0.0 109.841 -174.672 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -146.5 137.48 24.23 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.111 0.964 . . . . 0.0 110.849 174.407 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.466 ' HE1' ' HB2' ' A' ' 84' ' ' PHE . 65.6 mtt -126.03 12.34 7.76 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.776 1.23 . . . . 0.0 113.713 -175.284 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 32.9 t -61.24 143.87 54.82 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.488 -0.758 . . . . 0.0 110.405 172.782 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 32.7 m-20 -60.51 -24.95 65.74 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 121.011 -1.056 . . . . 0.0 113.517 -172.527 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -56.25 -38.45 71.13 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.038 0.935 . . . . 0.0 112.609 169.782 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.42 -38.65 91.78 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.745 0.818 . . . . 0.0 112.035 173.856 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -70.38 -46.28 71.66 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 123.806 0.842 . . . . 0.0 109.396 -179.277 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 10.2 m-30 -58.83 -45.91 88.89 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 118.545 0.612 . . . . 0.0 112.284 174.448 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.09 -29.24 60.57 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 124.276 1.031 . . . . 0.0 113.267 -173.654 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -78.85 -38.91 36.76 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.085 0.954 . . . . 0.0 112.374 169.385 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -130.9 83.06 62.34 Favored Pre-proline 0 CA--C 1.546 0.814 0 C-N-CA 125.635 1.574 . . . . 0.0 110.84 -168.658 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.69 -15.46 44.53 Favored 'Trans proline' 0 CA--C 1.539 0.767 0 C-N-CA 123.067 2.511 . . . . 0.0 114.212 -170.706 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 12.5 p-80 -74.2 -22.71 59.26 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.083 0.953 . . . . 0.0 113.219 173.418 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -81.02 -25.63 37.03 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.389 1.475 . . . . 0.0 112.622 -171.435 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 69.9 ttp85 . . . . . 0 C--O 1.254 1.319 0 C-N-CA 124.585 1.154 . . . . 0.0 112.506 177.711 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.0 ttt . . . . . 0 N--CA 1.495 1.812 0 CA-C-O 120.485 0.183 . . . . 0.0 110.726 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 80.9 mtt85 -139.23 164.92 28.54 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 126.058 1.743 . . . . 0.0 111.802 177.403 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 82.75 176.57 51.53 Favored Glycine 0 CA--C 1.537 1.431 0 C-N-CA 124.997 1.284 . . . . 0.0 114.667 178.013 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 87.8 p -148.69 168.92 21.58 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 125.938 1.695 . . . . 0.0 112.364 -176.258 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 23.3 p80 -141.28 164.57 29.9 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.056 1.342 . . . . 0.0 112.487 178.729 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 55.7 t-80 -147.21 144.31 28.81 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.061 1.344 . . . . 0.0 111.571 174.109 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 22.2 p80 -151.12 158.94 44.66 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.229 1.412 . . . . 0.0 111.577 172.095 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 85.1 t60 -151.49 144.18 24.34 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.694 1.198 . . . . 0.0 112.081 176.918 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 18.6 p80 -152.99 151.66 30.53 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.556 1.542 . . . . 0.0 111.357 167.525 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 47.6 p-80 -155.84 173.31 16.94 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.072 1.349 . . . . 0.0 112.62 -179.802 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 91.25 84.48 1.44 Allowed Glycine 0 CA--C 1.533 1.217 0 C-N-CA 124.642 1.115 . . . . 0.0 114.542 168.346 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 70.9 p -147.9 140.02 24.2 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.317 1.447 . . . . 0.0 111.479 168.402 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 9.5 p -158.69 155.59 4.36 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 C-N-CA 125.091 1.357 . . . . 0.0 111.296 -178.183 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.2 p -143.14 149.39 38.01 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.923 1.289 . . . . 0.0 112.491 173.416 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -144.23 169.21 18.31 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 126.023 1.729 . . . . 0.0 111.815 -177.61 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 89.01 82.97 1.29 Allowed Glycine 0 CA--C 1.532 1.141 0 C-N-CA 124.712 1.149 . . . . 0.0 113.441 174.15 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.16 63.19 28.83 Favored Pre-proline 0 CA--C 1.554 1.119 0 C-N-CA 125.329 1.452 . . . . 0.0 111.434 175.093 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -68.38 150.26 75.79 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 123.606 2.87 . . . . 0.0 113.136 -175.625 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 54.1 p -146.51 50.78 1.05 Allowed Pre-proline 0 CA--C 1.552 1.023 0 C-N-CA 125.037 1.335 . . . . 0.0 113.841 -179.459 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -63.49 140.81 77.79 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 123.151 2.568 . . . . 0.0 112.447 -179.54 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -139.8 6.18 2.21 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 115.547 1.684 . . . . 0.0 115.547 -174.523 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.2 t -76.48 130.18 37.59 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 121.366 -0.834 . . . . 0.0 111.79 -178.235 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.4 t -158.09 150.22 21.98 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.33 1.452 . . . . 0.0 111.354 178.195 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -149.81 151.36 33.42 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.108 1.363 . . . . 0.0 112.236 175.118 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 12.3 t -152.58 99.68 2.49 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.763 1.225 . . . . 0.0 109.804 176.235 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -149.81 30.48 0.73 Allowed 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.28 1.032 . . . . 0.0 113.623 -168.652 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -75.51 61.11 1.26 Allowed 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.931 1.693 . . . . 0.0 112.268 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 54.08 43.7 30.32 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 126.413 1.885 . . . . 0.0 112.425 -170.907 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 75.4 mt -91.4 97.06 6.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 C-N-CA 125.308 1.443 . . . . 0.0 108.655 -176.836 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 52.1 t30 -146.78 37.69 0.99 Allowed 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 123.895 0.878 . . . . 0.0 113.31 -173.413 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 66.6 t80 -143.29 136.64 28.18 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 175.529 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 58.5 ttm -158.78 150.48 20.92 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.827 2.051 . . . . 0.0 109.049 165.15 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.8 t -133.17 117.7 14.81 Favored Pre-proline 0 N--CA 1.478 0.938 0 C-N-CA 123.233 0.613 . . . . 0.0 111.507 169.234 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -95.62 154.5 1.55 Allowed 'Trans proline' 0 CA--C 1.548 1.208 0 C-N-CA 124.005 3.136 . . . . 0.0 113.007 176.438 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -73.34 170.32 20.18 Favored 'Trans proline' 0 CA--C 1.544 1.021 0 C-N-CA 123.203 2.602 . . . . 0.0 111.393 165.408 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -69.24 -21.99 63.88 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 176.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -151.32 129.32 11.78 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.304 1.842 . . . . 0.0 109.72 171.876 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -89.21 -45.02 9.86 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -179.413 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 54.05 12.87 0.5 Allowed 'General case' 0 CA--C 1.555 1.163 0 N-CA-C 116.712 2.116 . . . . 0.0 116.712 179.758 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -152.67 70.42 7.29 Favored Pre-proline 0 CA--C 1.551 0.996 0 C-N-CA 125.887 1.675 . . . . 0.0 109.234 -178.77 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -81.04 176.42 8.91 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 124.177 3.251 . . . . 0.0 114.137 -165.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 98.15 -4.45 60.66 Favored Glycine 0 CA--C 1.538 1.469 0 C-N-CA 125.393 1.473 . . . . 0.0 115.691 172.206 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . 57.91 18.42 5.01 Favored 'General case' 0 CA--C 1.551 0.986 0 N-CA-C 116.662 2.097 . . . . 0.0 116.662 175.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -79.41 162.27 25.62 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.764 1.226 . . . . 0.0 110.598 163.696 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -132.02 140.44 48.92 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.438 1.095 . . . . 0.0 112.936 174.049 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -86.58 155.06 20.61 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.523 1.129 . . . . 0.0 110.837 164.394 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 91.3 mt -132.99 157.32 45.49 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.803 1.241 . . . . 0.0 112.105 -175.129 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -81.81 137.53 35.28 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 123.352 0.661 . . . . 0.0 109.615 162.627 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -96.48 -21.59 17.63 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 114.426 1.269 . . . . 0.0 114.426 -173.422 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -140.8 165.53 27.27 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.202 1.401 . . . . 0.0 112.373 -171.535 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.17 -162.72 54.79 Favored Glycine 0 CA--C 1.54 1.629 0 C-N-CA 124.162 0.887 . . . . 0.0 114.124 178.296 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -67.85 -17.36 46.92 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 123.251 2.634 . . . . 0.0 113.809 -175.168 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 97.8 mt -94.13 6.26 49.15 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.557 1.143 . . . . 0.0 113.901 175.273 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.45 122.01 10.28 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 120.798 1.636 . . . . 0.0 112.123 -178.04 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.15 6.28 88.23 Favored Glycine 0 CA--C 1.541 1.693 0 C-N-CA 125.447 1.499 . . . . 0.0 115.432 -175.18 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.457 ' HB3' ' HD2' ' A' ' 73' ' ' PRO . 18.2 mt -103.99 160.77 25.0 Favored Pre-proline 0 CA--C 1.559 1.293 0 C-N-CA 126.137 1.775 . . . . 0.0 111.33 -179.208 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.457 ' HD2' ' HB3' ' A' ' 72' ' ' LEU . 67.9 Cg_endo -72.24 164.73 34.75 Favored 'Trans proline' 0 C--N 1.354 0.832 0 C-N-CA 124.307 3.338 . . . . 0.0 113.553 -168.497 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 10.6 t -110.12 -27.38 2.89 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 O-C-N 121.288 -0.883 . . . . 0.0 112.458 176.583 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 17.7 p -125.87 172.65 9.71 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 125.385 1.474 . . . . 0.0 114.203 179.726 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 10.1 mmt180 -60.19 -40.96 91.9 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 121.378 -0.826 . . . . 0.0 111.442 170.965 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 8.6 t -63.15 -44.28 95.98 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 122.617 0.367 . . . . 0.0 110.761 174.815 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -60.01 -45.14 93.74 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.717 -0.614 . . . . 0.0 111.417 175.739 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.72 -41.82 95.7 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.595 0.758 . . . . 0.0 112.67 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 34.0 mtp-105 -61.42 -45.8 92.8 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 118.803 0.729 . . . . 0.0 111.773 173.051 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 55.4 t -60.96 -49.78 83.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 124.046 0.938 . . . . 0.0 111.199 177.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.6 mp -60.13 -49.83 76.08 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 118.6 -0.714 . . . . 0.0 112.562 177.811 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 60.8 mt -54.47 -52.61 38.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-N 118.859 0.754 . . . . 0.0 110.199 175.75 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -65.44 -47.41 76.26 Favored 'General case' 0 C--O 1.224 -0.267 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -176.482 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -67.61 -45.95 73.99 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 119.47 1.032 . . . . 0.0 112.528 -178.071 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -64.86 -44.44 89.7 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 118.957 -0.544 . . . . 0.0 110.722 178.606 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.436 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 71.3 t90 -60.29 -46.0 91.4 Favored 'General case' 0 C--O 1.219 -0.545 0 CA-C-O 117.787 -1.102 . . . . 0.0 111.897 171.298 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -55.72 -49.2 73.67 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 121.042 1.747 . . . . 0.0 112.637 179.576 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -65.53 -53.71 38.42 Favored 'General case' 0 C--O 1.245 0.835 0 O-C-N 121.067 -1.02 . . . . 0.0 111.931 178.324 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 9.8 mmm180 -58.32 -47.12 84.72 Favored 'General case' 0 C--O 1.215 -0.739 0 C-N-CA 122.435 0.294 . . . . 0.0 111.039 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 13.7 tmtt? -67.37 -30.96 70.89 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.32 1.048 . . . . 0.0 113.192 178.859 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 8.9 mtpm? -66.64 -26.56 67.12 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 120.194 1.361 . . . . 0.0 112.531 168.565 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 79.8 p -91.06 -9.18 46.71 Favored 'General case' 0 N--CA 1.486 1.34 0 N-CA-C 116.185 1.92 . . . . 0.0 116.185 163.104 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -144.64 72.55 15.48 Favored Pre-proline 0 CA--C 1.552 1.02 0 C-N-CA 127.353 2.261 . . . . 0.0 111.4 -172.103 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -61.1 -7.78 8.72 Favored 'Trans proline' 0 CA--C 1.546 1.114 0 C-N-CA 123.835 3.024 . . . . 0.0 116.577 -166.277 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 41.0 p90 -84.31 -10.49 57.58 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 126.502 1.921 . . . . 0.0 115.037 174.506 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.4 tp -64.84 137.08 57.55 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.674 1.124 . . . . 0.0 113.747 -169.589 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 23.3 mmt85 -90.06 156.46 18.37 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.593 1.157 . . . . 0.0 112.78 -179.107 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.436 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.4 tm? -137.69 131.81 31.96 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 126.996 2.119 . . . . 0.0 109.266 -171.772 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 52.5 t0 -141.85 130.65 22.92 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.68 0.792 . . . . 0.0 111.041 175.923 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 65.0 mtt -122.8 9.23 9.45 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.836 1.654 . . . . 0.0 112.841 -179.732 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 28.9 t -64.52 153.73 38.14 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.026 0.93 . . . . 0.0 111.507 172.516 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -51.4 -38.28 52.64 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.238 1.015 . . . . 0.0 112.79 -179.496 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -58.78 -39.1 80.04 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.531 1.133 . . . . 0.0 112.914 176.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.24 -42.38 99.26 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 123.25 0.62 . . . . 0.0 111.551 175.788 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.02 -46.92 64.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.297 0 C-N-CA 123.651 0.781 . . . . 0.0 109.902 -179.036 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 18.8 m-30 -55.35 -46.48 76.4 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 118.869 0.759 . . . . 0.0 112.599 175.394 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 1.5 ttp85 -78.2 -35.18 48.87 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.906 0.882 . . . . 0.0 112.93 -172.053 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 61.7 ttm-85 -80.71 -37.24 30.98 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 124.433 1.093 . . . . 0.0 112.847 175.495 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -129.71 76.96 77.77 Favored Pre-proline 0 CA--C 1.547 0.846 0 C-N-CA 126.54 1.936 . . . . 0.0 110.893 -173.32 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -65.41 -17.67 58.26 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 123.109 2.54 . . . . 0.0 114.281 -172.598 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 7.6 p-80 -74.15 -23.98 59.34 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.078 0.951 . . . . 0.0 113.32 172.795 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -85.53 -4.79 59.26 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 126.278 1.831 . . . . 0.0 113.496 -178.795 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 57.5 ttp180 . . . . . 0 C--O 1.254 1.302 0 C-N-CA 125.405 1.482 . . . . 0.0 111.843 173.777 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.5 mtt . . . . . 0 N--CA 1.499 1.978 0 N-CA-C 110.364 -0.235 . . . . 0.0 110.364 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 80.3 mtm180 -140.37 167.89 21.1 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 125.964 1.706 . . . . 0.0 111.828 179.359 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 84.27 17.04 65.47 Favored Glycine 0 CA--C 1.535 1.337 0 N-CA-C 115.963 1.145 . . . . 0.0 115.963 169.289 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 56.4 p -69.18 150.11 47.85 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 118.68 1.24 . . . . 0.0 112.47 173.602 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 41.6 p-80 -80.91 -37.08 30.27 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 -174.274 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' HIS . . . . . 0.464 ' CG ' ' H ' ' A' ' 7' ' ' HIS . 33.2 t60 56.15 172.68 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 126.869 2.068 . . . . 0.0 115.131 -173.923 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' HIS . . . . . 0.464 ' H ' ' CG ' ' A' ' 6' ' ' HIS . 94.7 m-70 -80.41 39.31 0.46 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.228 1.811 . . . . 0.0 113.658 -176.844 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 34.0 m80 -72.24 158.92 34.96 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.573 1.149 . . . . 0.0 112.182 172.003 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 23.3 m80 60.07 22.31 11.5 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 125.726 1.61 . . . . 0.0 115.248 178.431 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 58.8 m170 -100.38 152.37 20.42 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.371 1.468 . . . . 0.0 111.758 173.5 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 74.47 178.88 40.57 Favored Glycine 0 CA--C 1.54 1.631 0 C-N-CA 124.389 0.995 . . . . 0.0 114.631 -178.376 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 8.8 t -154.36 168.58 26.14 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 125.586 1.554 . . . . 0.0 111.662 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.9 p -140.86 139.27 34.36 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 125.381 1.472 . . . . 0.0 111.354 175.767 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 80.2 p -154.01 162.14 41.42 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.726 1.611 . . . . 0.0 111.618 179.535 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 84.1 m-85 -133.43 132.43 41.11 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.632 1.173 . . . . 0.0 111.363 -177.885 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 72.5 165.08 8.05 Favored Glycine 0 CA--C 1.54 1.619 0 C-N-CA 124.605 1.097 . . . . 0.0 114.235 -172.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -146.95 55.31 2.39 Favored Pre-proline 0 CA--C 1.555 1.14 0 C-N-CA 124.617 1.167 . . . . 0.0 112.984 178.037 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -66.83 141.48 59.32 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.097 2.532 . . . . 0.0 112.378 -179.806 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 9.6 t -152.08 80.88 5.84 Favored Pre-proline 0 CA--C 1.545 0.773 0 C-N-CA 124.479 1.112 . . . . 0.0 110.88 176.893 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -78.13 95.72 1.08 Allowed 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 123.659 2.906 . . . . 0.0 111.562 -176.498 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 97.9 mt -115.69 -3.26 12.29 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.963 1.305 . . . . 0.0 114.397 -175.897 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 21.1 t -81.52 134.61 35.54 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.751 0.82 . . . . 0.0 112.054 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 81.4 p -158.42 163.15 37.48 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.525 1.53 . . . . 0.0 112.353 179.44 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -131.05 144.55 51.52 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.217 1.407 . . . . 0.0 111.181 173.244 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 59.8 m -142.44 151.47 41.8 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.745 1.218 . . . . 0.0 112.85 -172.477 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 57.01 25.64 10.94 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.983 1.713 . . . . 0.0 115.467 172.266 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -70.95 -22.42 62.22 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 114.29 1.218 . . . . 0.0 114.29 -174.339 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 -127.78 7.07 6.16 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 125.906 1.682 . . . . 0.0 113.014 -179.239 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 46.3 mm -97.81 125.89 50.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 O-C-N 120.925 -1.109 . . . . 0.0 111.334 -170.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 66.3 m-20 48.53 42.73 19.3 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 126.394 1.878 . . . . 0.0 114.135 171.394 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 26.1 t80 -81.66 59.17 4.06 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.833 1.253 . . . . 0.0 113.055 -170.708 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 55.5 mtt 60.49 171.18 0.09 Allowed 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 127.881 2.472 . . . . 0.0 115.476 -179.197 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 26.3 p -137.34 154.21 75.27 Favored Pre-proline 0 N--CA 1.479 0.997 0 C-N-CA 126.531 1.932 . . . . 0.0 111.311 -179.342 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -68.09 152.0 76.86 Favored 'Trans proline' 0 CA--C 1.548 1.18 0 C-N-CA 122.884 2.39 . . . . 0.0 112.334 177.123 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -69.8 141.51 45.25 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 123.446 2.764 . . . . 0.0 112.547 -178.674 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -74.16 131.01 40.87 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.011 1.324 . . . . 0.0 112.214 -178.299 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.6 pm0 -78.02 -21.72 50.36 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 115.067 1.506 . . . . 0.0 115.067 -176.159 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -139.81 2.5 1.97 Allowed 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 115.669 1.729 . . . . 0.0 115.669 -168.68 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -83.98 61.88 6.69 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.04 1.336 . . . . 0.0 112.062 -177.366 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 33.0 tp60 -149.25 83.49 6.56 Favored Pre-proline 0 CA--C 1.541 0.611 0 C-N-CA 125.041 1.336 . . . . 0.0 109.087 179.22 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -87.31 -169.61 0.51 Allowed 'Trans proline' 0 CA--C 1.546 1.082 0 C-N-CA 123.522 2.815 . . . . 0.0 110.994 179.347 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 82.06 -129.58 9.15 Favored Glycine 0 CA--C 1.536 1.354 0 C-N-CA 124.093 0.854 . . . . 0.0 113.296 177.877 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . 58.8 52.73 6.35 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.98 1.712 . . . . 0.0 114.624 -175.605 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -85.81 168.08 14.61 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.019 1.727 . . . . 0.0 111.418 171.781 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -135.91 148.96 48.78 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.028 1.331 . . . . 0.0 113.032 176.272 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -92.93 154.54 18.13 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.128 1.371 . . . . 0.0 111.639 168.152 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 81.4 mt -129.25 157.12 42.75 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.145 1.378 . . . . 0.0 112.051 -176.284 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 79.3 m-70 -82.94 143.34 30.76 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.716 0.806 . . . . 0.0 109.584 162.347 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -107.13 -9.56 16.12 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 114.898 1.444 . . . . 0.0 114.898 -170.225 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -148.53 165.72 30.38 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.745 1.218 . . . . 0.0 112.957 -174.299 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 68.52 -158.9 52.32 Favored Glycine 0 CA--C 1.541 1.658 0 C-N-CA 123.931 0.777 . . . . 0.0 113.83 -179.81 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_endo -68.05 -15.45 43.26 Favored 'Trans proline' 0 CA--C 1.541 0.865 0 C-N-CA 123.268 2.645 . . . . 0.0 113.746 -177.441 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.0 mt -94.46 5.5 51.62 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.765 1.226 . . . . 0.0 113.949 176.301 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.93 114.12 2.41 Favored 'General case' 0 CA--C 1.549 0.907 0 CA-C-N 121.276 1.853 . . . . 0.0 111.995 -179.28 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.17 1.81 71.95 Favored Glycine 0 CA--C 1.542 1.763 0 C-N-CA 125.682 1.611 . . . . 0.0 115.694 -174.209 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 6.7 mp -98.61 157.17 34.74 Favored Pre-proline 0 CA--C 1.556 1.198 0 C-N-CA 126.792 2.037 . . . . 0.0 111.563 179.57 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -68.06 160.13 49.98 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 124.748 3.632 . . . . 0.0 113.664 -172.003 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 15.2 t -103.95 -30.77 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 O-C-N 121.445 -0.784 . . . . 0.0 112.2 175.857 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 22.3 p -124.96 170.31 11.24 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 125.143 1.377 . . . . 0.0 114.144 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 43.0 ttt-85 -59.97 -40.1 87.94 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.033 0.933 . . . . 0.0 111.119 173.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 37.4 m -62.77 -43.9 97.59 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.019 0.927 . . . . 0.0 111.291 172.838 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -60.59 -46.46 90.17 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 118.866 0.757 . . . . 0.0 111.274 175.069 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.19 -42.22 98.2 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 118.623 0.647 . . . . 0.0 112.55 179.587 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 74.5 mtp180 -64.45 -43.16 95.13 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 121.525 -0.735 . . . . 0.0 112.376 175.449 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 53.4 t -62.91 -48.33 88.55 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 C-N-CA 123.79 0.836 . . . . 0.0 111.142 176.195 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.7 mp -59.67 -45.15 92.91 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 118.45 -0.786 . . . . 0.0 112.602 176.542 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 49.7 mt -54.76 -51.49 51.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 CA-C-N 118.884 0.765 . . . . 0.0 110.157 173.346 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -65.44 -48.46 72.65 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 113.318 0.859 . . . . 0.0 113.318 -176.865 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 23.7 t30 -69.43 -42.78 74.56 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 118.627 0.648 . . . . 0.0 112.49 -176.704 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -65.01 -45.96 83.37 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 118.772 -0.633 . . . . 0.0 110.778 175.861 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.455 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 64.7 t90 -58.99 -47.34 85.53 Favored 'General case' 0 C--O 1.22 -0.454 0 CA-C-O 117.919 -1.039 . . . . 0.0 111.658 173.05 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -57.93 -45.22 86.9 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 120.645 1.566 . . . . 0.0 112.927 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -66.86 -52.76 39.77 Favored 'General case' 0 C--O 1.245 0.824 0 CA-C-N 119.599 1.09 . . . . 0.0 112.435 177.234 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -55.84 -48.51 75.36 Favored 'General case' 0 C--O 1.218 -0.595 0 O-C-N 121.776 -0.578 . . . . 0.0 110.16 177.513 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 18.5 ttpt -63.04 -34.02 76.67 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.214 1.405 . . . . 0.0 113.397 177.197 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -59.64 -33.66 71.81 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 119.998 1.272 . . . . 0.0 111.001 169.171 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 63.0 m -84.37 -17.66 38.69 Favored 'General case' 0 N--CA 1.484 1.234 0 N-CA-C 116.106 1.891 . . . . 0.0 116.106 165.861 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -143.09 72.89 18.29 Favored Pre-proline 0 CA--C 1.553 1.073 0 C-N-CA 127.266 2.226 . . . . 0.0 111.738 -165.278 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -61.84 -5.23 5.7 Favored 'Trans proline' 0 CA--C 1.547 1.166 0 C-N-CA 123.934 3.089 . . . . 0.0 116.649 -167.301 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 38.9 p90 -88.12 -9.11 54.27 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 126.921 2.088 . . . . 0.0 114.965 175.721 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.3 tp -65.43 137.5 57.51 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 114.725 1.38 . . . . 0.0 114.725 -164.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 34.4 mmt180 -84.21 155.01 22.71 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 125.139 1.376 . . . . 0.0 113.128 178.79 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.455 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -138.77 131.98 29.94 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.898 2.079 . . . . 0.0 109.681 -174.991 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 53.5 t0 -143.86 132.44 22.33 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.894 0.877 . . . . 0.0 111.152 174.901 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 66.7 mtt -125.9 2.21 7.35 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.313 1.445 . . . . 0.0 113.729 -176.884 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 73.4 m -62.73 144.7 56.14 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 118.96 0.8 . . . . 0.0 110.216 169.797 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -61.26 -25.04 66.82 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 -165.038 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -56.32 -34.48 66.58 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.86 0.864 . . . . 0.0 112.966 171.492 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.31 -40.04 95.0 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.508 0.723 . . . . 0.0 111.922 173.141 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.6 mp -73.28 -45.42 53.07 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 C-N-CA 124.204 1.001 . . . . 0.0 109.261 -179.621 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 11.7 m-30 -55.59 -46.15 77.29 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 118.618 0.644 . . . . 0.0 112.235 175.679 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.4 tmt_? -77.66 -39.92 43.45 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.65 1.18 . . . . 0.0 112.523 -173.524 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 62.2 ttm-85 -76.89 -35.69 57.24 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.144 0.978 . . . . 0.0 112.994 177.123 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 45.1 m-85 -127.19 72.68 76.96 Favored Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 125.991 1.717 . . . . 0.0 111.115 -174.534 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -66.68 -11.08 30.42 Favored 'Trans proline' 0 CA--C 1.542 0.898 0 C-N-CA 123.348 2.699 . . . . 0.0 114.171 -175.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 16.1 p-80 -74.83 -23.48 58.46 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.003 0.921 . . . . 0.0 113.343 171.296 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -81.04 -45.66 16.2 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.82 1.248 . . . . 0.0 111.892 -164.462 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 20.8 mmt85 . . . . . 0 C--O 1.253 1.268 0 C-N-CA 127.054 2.142 . . . . 0.0 111.121 172.794 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.7 mmt . . . . . 0 N--CA 1.498 1.934 0 CA-C-O 120.079 -0.01 . . . . 0.0 111.012 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 82.2 mtp180 -135.23 165.73 24.73 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 125.739 1.616 . . . . 0.0 112.405 -178.07 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 104.6 117.28 4.33 Favored Glycine 0 CA--C 1.536 1.35 0 C-N-CA 125.711 1.624 . . . . 0.0 113.974 171.079 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 79.1 p -157.9 156.92 32.2 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.593 1.957 . . . . 0.0 111.162 173.146 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 56.5 t-80 -151.92 133.51 14.7 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.196 0.998 . . . . 0.0 112.331 178.222 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 95.3 m-70 -145.77 96.36 2.8 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 125.474 1.51 . . . . 0.0 110.564 175.347 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 57.8 t-80 -152.53 135.16 15.31 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.971 0.908 . . . . 0.0 112.194 173.36 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 64.7 m80 -146.94 151.57 37.23 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.956 1.702 . . . . 0.0 111.267 178.038 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 55.9 t-80 -149.32 137.0 20.31 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 124.407 1.083 . . . . 0.0 111.936 171.8 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 46.6 p-80 -162.25 176.22 10.83 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.859 1.664 . . . . 0.0 112.016 -175.937 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 88.38 18.25 55.62 Favored Glycine 0 CA--C 1.537 1.441 0 N-CA-C 116.181 1.232 . . . . 0.0 116.181 168.076 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 70.4 p -79.23 -10.82 59.91 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 114.972 1.471 . . . . 0.0 114.972 -179.266 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.0 m -84.92 -1.38 6.64 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 N-CA-C 115.294 1.59 . . . . 0.0 115.294 -169.627 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 30.2 m -73.4 -13.42 61.08 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 115.71 1.745 . . . . 0.0 115.71 -168.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -79.24 149.36 31.9 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -176.708 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 86.59 134.51 3.86 Favored Glycine 0 CA--C 1.538 1.476 0 C-N-CA 125.693 1.616 . . . . 0.0 114.341 175.554 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -151.78 67.26 7.15 Favored Pre-proline 0 CA--C 1.556 1.177 0 C-N-CA 125.099 1.36 . . . . 0.0 112.152 -179.824 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -70.32 146.65 57.35 Favored 'Trans proline' 0 CA--C 1.543 0.948 0 C-N-CA 123.369 2.712 . . . . 0.0 112.725 179.56 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 67.3 m -139.47 62.43 24.01 Favored Pre-proline 0 N--CA 1.479 1.014 0 C-N-CA 124.933 1.293 . . . . 0.0 112.637 -177.618 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -67.77 132.15 26.03 Favored 'Trans proline' 0 CA--C 1.542 0.923 0 C-N-CA 123.169 2.579 . . . . 0.0 112.095 179.629 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.3 tt -153.92 115.56 4.2 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.901 1.28 . . . . 0.0 110.341 179.067 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 76.2 p -155.41 148.48 24.61 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.787 1.235 . . . . 0.0 112.304 172.028 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.9 t -159.69 128.72 5.17 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.682 1.193 . . . . 0.0 111.269 172.801 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -155.97 124.59 5.93 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.981 1.312 . . . . 0.0 110.353 172.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 11.0 t -160.44 151.77 19.36 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.425 1.09 . . . . 0.0 112.426 177.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 47.54 63.05 2.15 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.634 1.974 . . . . 0.0 114.364 170.925 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -76.54 43.02 0.3 Allowed 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 124.914 1.285 . . . . 0.0 112.27 172.218 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 54.47 42.73 31.18 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 126.918 2.087 . . . . 0.0 113.575 -168.307 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 16.9 mm -88.77 51.14 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 126.012 1.725 . . . . 0.0 109.366 179.329 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -146.88 137.03 23.48 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.727 1.611 . . . . 0.0 111.03 -177.067 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 32.3 p90 -163.26 151.93 14.19 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.295 1.438 . . . . 0.0 111.854 -179.345 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 14.6 ttt -155.98 141.48 17.72 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.92 1.288 . . . . 0.0 110.646 169.259 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 17.9 p -135.48 64.38 58.42 Favored Pre-proline 0 N--CA 1.484 1.23 0 C-N-CA 125.021 1.328 . . . . 0.0 112.012 -176.569 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -71.18 149.67 58.29 Favored 'Trans proline' 0 CA--C 1.548 1.221 0 C-N-CA 123.013 2.475 . . . . 0.0 112.58 -176.921 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -74.39 149.95 40.56 Favored 'Trans proline' 0 CA--C 1.539 0.769 0 C-N-CA 123.467 2.778 . . . . 0.0 112.329 176.256 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -90.34 -21.73 21.87 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 177.193 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.0 tt0 49.37 47.49 22.3 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 126.554 1.941 . . . . 0.0 113.723 175.516 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -65.15 -29.86 70.73 Favored 'General case' 0 N--CA 1.477 0.925 0 O-C-N 120.989 -1.069 . . . . 0.0 113.143 -174.725 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -81.71 67.55 7.72 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.605 1.562 . . . . 0.0 111.641 178.451 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -136.1 38.59 0.39 Allowed Pre-proline 0 CA--C 1.555 1.156 0 C-N-CA 125.229 1.412 . . . . 0.0 114.347 178.923 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -70.95 146.97 54.21 Favored 'Trans proline' 0 CA--C 1.544 1.011 0 C-N-CA 122.646 2.231 . . . . 0.0 112.966 -170.793 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 68.81 -173.47 34.43 Favored Glycine 0 CA--C 1.539 1.562 0 C-N-CA 124.422 1.01 . . . . 0.0 114.566 -176.488 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -144.52 102.0 3.76 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.665 1.186 . . . . 0.0 111.084 177.087 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -123.21 143.84 49.77 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.584 1.554 . . . . 0.0 110.947 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -150.73 155.97 40.37 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.685 1.594 . . . . 0.0 112.549 178.711 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -92.41 150.96 20.49 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.612 1.165 . . . . 0.0 111.681 168.844 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 99.5 mt -131.34 157.49 43.21 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.678 1.591 . . . . 0.0 111.28 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -79.23 143.37 35.38 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.809 0.843 . . . . 0.0 109.91 166.552 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -106.83 -9.01 16.51 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 -172.002 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -148.39 165.7 30.31 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.85 1.26 . . . . 0.0 112.924 -174.802 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 69.53 -161.16 52.68 Favored Glycine 0 CA--C 1.541 1.701 0 C-N-CA 123.942 0.782 . . . . 0.0 113.9 -179.33 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -68.07 -16.03 44.17 Favored 'Trans proline' 0 CA--C 1.541 0.851 0 C-N-CA 123.191 2.594 . . . . 0.0 113.72 -177.059 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.1 mt -92.91 4.28 54.2 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 124.813 1.245 . . . . 0.0 113.971 175.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.39 113.94 2.2 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-N 121.107 1.776 . . . . 0.0 112.088 -178.099 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 92.55 4.27 66.0 Favored Glycine 0 CA--C 1.544 1.864 0 C-N-CA 125.642 1.591 . . . . 0.0 115.704 -173.631 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 5.9 mp -105.45 154.77 38.83 Favored Pre-proline 0 CA--C 1.555 1.173 0 C-N-CA 126.831 2.052 . . . . 0.0 111.435 179.848 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -71.56 162.55 41.84 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 124.98 3.786 . . . . 0.0 113.859 -167.9 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 14.7 t -105.27 -32.88 2.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 O-C-N 121.441 -0.787 . . . . 0.0 113.09 -179.122 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 25.1 p -123.93 172.75 8.69 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 124.914 1.285 . . . . 0.0 113.988 179.364 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 41.5 mtp-105 -61.68 -40.5 95.21 Favored 'General case' 0 N--CA 1.482 1.156 0 O-C-N 121.378 -0.827 . . . . 0.0 110.562 175.054 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 31.3 m -61.67 -44.61 96.63 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 124.353 1.061 . . . . 0.0 111.237 173.321 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -61.16 -47.29 86.88 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 118.885 0.766 . . . . 0.0 111.233 175.116 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.21 -39.58 90.75 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.616 -0.677 . . . . 0.0 112.216 179.698 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 75.3 ttt180 -65.21 -42.07 93.86 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 121.422 -0.798 . . . . 0.0 112.354 174.14 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 68.1 t -63.07 -48.54 87.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 CA-C-N 118.786 0.721 . . . . 0.0 111.223 175.021 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -60.63 -45.11 95.29 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 118.628 -0.701 . . . . 0.0 111.952 178.178 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 52.9 mt -53.59 -51.69 40.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-N 118.736 0.698 . . . . 0.0 110.33 170.703 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.449 ' HB2' ' HE1' ' A' ' 101' ' ' MET . 20.8 t80 -64.15 -46.5 83.79 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 -176.298 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -70.71 -44.99 65.78 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.033 0.933 . . . . 0.0 112.353 -176.517 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -65.71 -44.01 87.37 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 118.766 -0.635 . . . . 0.0 111.091 176.091 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.437 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 68.3 t90 -60.02 -45.48 92.64 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-O 117.572 -1.204 . . . . 0.0 111.59 171.589 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -54.93 -48.68 72.81 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 120.836 1.653 . . . . 0.0 112.492 178.667 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -65.29 -51.5 60.3 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 119.68 1.127 . . . . 0.0 112.232 177.207 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 38.2 mmt180 -58.54 -46.25 87.22 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 122.99 0.516 . . . . 0.0 110.845 -178.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 3.5 tmtm? -69.27 -30.32 68.4 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 126.043 1.737 . . . . 0.0 113.509 178.661 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 90.8 mttt -65.83 -28.23 68.83 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 119.993 1.27 . . . . 0.0 111.98 166.818 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 68.5 m -82.9 -22.65 33.88 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 115.173 1.546 . . . . 0.0 115.173 163.801 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -140.44 75.83 26.48 Favored Pre-proline 0 N--CA 1.477 0.903 0 C-N-CA 127.105 2.162 . . . . 0.0 111.363 -167.332 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -58.63 -16.84 32.29 Favored 'Trans proline' 0 CA--C 1.542 0.907 0 C-N-CA 123.379 2.719 . . . . 0.0 116.039 -165.393 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 39.1 p90 -79.08 -9.78 59.64 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 126.611 1.964 . . . . 0.0 115.463 177.181 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 18.2 tp -64.05 135.42 56.39 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 120.098 1.317 . . . . 0.0 114.35 -167.069 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 7.5 tpm_? -77.9 146.65 35.46 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.939 1.696 . . . . 0.0 112.721 178.9 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.437 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.4 tm? -128.36 133.89 48.74 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 126.886 2.074 . . . . 0.0 109.847 179.533 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -149.62 134.3 17.69 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.901 0.881 . . . . 0.0 111.084 176.487 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.449 ' HE1' ' HB2' ' A' ' 84' ' ' PHE . 63.6 mtt -130.24 1.79 4.67 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.052 1.341 . . . . 0.0 114.288 -171.653 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 69.6 m -63.78 147.34 52.0 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.022 0.828 . . . . 0.0 111.067 173.097 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -58.52 -27.64 64.69 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 114.888 1.44 . . . . 0.0 114.888 -166.396 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -56.85 -37.37 71.2 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 119.035 0.834 . . . . 0.0 112.802 172.468 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.06 -37.1 86.2 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.661 0.784 . . . . 0.0 112.065 174.162 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.6 mp -73.65 -46.4 47.94 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 C-N-CA 124.104 0.962 . . . . 0.0 109.327 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 13.9 m-30 -56.17 -45.81 79.56 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 119.006 0.821 . . . . 0.0 112.334 174.391 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.46 -38.97 62.8 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 124.277 1.031 . . . . 0.0 112.283 -173.943 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 39.7 ttm105 -78.99 -34.78 43.79 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.836 0.854 . . . . 0.0 112.948 176.45 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 -128.21 78.16 75.86 Favored Pre-proline 0 CA--C 1.546 0.827 0 C-N-CA 126.396 1.879 . . . . 0.0 110.757 -174.329 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -66.16 -16.04 50.59 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 123.091 2.527 . . . . 0.0 114.231 -173.4 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 12.9 p-80 -73.99 -24.01 59.53 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.138 0.975 . . . . 0.0 113.444 172.48 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -82.18 -27.31 32.71 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 125.858 1.663 . . . . 0.0 112.252 -171.442 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 59.6 ttp180 . . . . . 0 C--O 1.254 1.311 0 C-N-CA 125.169 1.388 . . . . 0.0 112.291 175.994 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.832 0 N-CA-C 111.718 0.266 . . . . 0.0 111.718 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 17.9 tpt180 -152.77 151.85 30.96 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 125.037 1.335 . . . . 0.0 111.448 178.122 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 78.27 -58.84 4.03 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 125.418 1.485 . . . . 0.0 114.596 174.229 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 25.1 m 59.31 179.25 0.08 Allowed 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 126.581 1.953 . . . . 0.0 114.755 -177.553 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 65.8 m80 -128.9 156.17 44.12 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.434 1.494 . . . . 0.0 112.228 -176.186 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 46.8 t60 -145.44 157.19 44.06 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.312 1.445 . . . . 0.0 112.004 -179.103 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 95.3 m-70 -135.31 149.87 49.87 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.606 1.562 . . . . 0.0 112.295 -176.156 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 25.1 p80 -145.43 166.5 25.45 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 125.138 1.375 . . . . 0.0 112.479 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 56.3 t-80 -146.11 148.86 33.05 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.114 1.365 . . . . 0.0 111.801 176.998 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 25.3 p80 -149.19 160.03 43.73 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.557 1.543 . . . . 0.0 111.686 175.782 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 174.33 -158.52 27.02 Favored Glycine 0 CA--C 1.537 1.415 0 C-N-CA 123.879 0.752 . . . . 0.0 114.305 -178.389 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.6 t 64.92 161.06 0.12 Allowed 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 127.19 2.196 . . . . 0.0 115.35 -174.366 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 15.1 m -143.33 152.83 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 126.831 2.053 . . . . 0.0 111.819 -174.778 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 26.4 m -73.66 -34.44 64.93 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 113.322 0.86 . . . . 0.0 113.322 -179.074 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 7.3 t80 52.09 37.18 20.81 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 126.289 1.836 . . . . 0.0 114.956 172.745 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -69.84 144.61 40.29 Favored Glycine 0 CA--C 1.537 1.46 0 O-C-N 121.247 -0.908 . . . . 0.0 113.747 -178.775 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -146.22 66.59 11.42 Favored Pre-proline 0 CA--C 1.554 1.124 0 C-N-CA 125.036 1.334 . . . . 0.0 111.878 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_endo -69.35 150.47 70.74 Favored 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 123.677 2.918 . . . . 0.0 113.094 -177.343 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.9 p -148.31 53.53 1.5 Allowed Pre-proline 0 CA--C 1.553 1.07 0 C-N-CA 125.094 1.357 . . . . 0.0 113.472 -179.458 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -66.02 144.77 77.39 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 123.413 2.742 . . . . 0.0 113.358 -176.176 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.4 mt -140.82 153.7 45.9 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.637 1.975 . . . . 0.0 110.939 176.571 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 81.9 p -152.26 161.46 42.57 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.783 1.233 . . . . 0.0 113.171 -179.745 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 63.0 m -137.61 148.67 46.02 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.904 1.682 . . . . 0.0 111.393 178.232 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -150.7 138.09 19.54 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.498 1.119 . . . . 0.0 112.121 -177.211 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 69.0 m -142.02 132.69 25.51 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 125.523 1.529 . . . . 0.0 111.132 177.435 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -146.72 -1.56 0.68 Allowed 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 115.396 1.628 . . . . 0.0 115.396 -177.451 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -70.26 -13.48 62.19 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 115.727 1.751 . . . . 0.0 115.727 -165.698 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -127.13 3.01 6.45 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.371 1.469 . . . . 0.0 113.033 173.061 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 19.5 mm -87.32 56.63 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 O-C-N 120.507 -1.371 . . . . 0.0 110.141 -172.155 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -142.78 -6.97 0.86 Allowed 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 125.188 1.395 . . . . 0.0 114.548 -170.665 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 49.3 m-85 -121.05 56.68 1.01 Allowed 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.391 1.076 . . . . 0.0 112.63 -162.431 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 62.4 mtt -108.51 5.61 25.35 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 125.3 1.44 . . . . 0.0 114.194 -172.061 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 17.1 p -127.98 69.52 77.13 Favored Pre-proline 0 N--CA 1.482 1.154 0 C-N-CA 125.282 1.433 . . . . 0.0 113.081 -167.316 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -67.1 156.42 66.41 Favored 'Trans proline' 0 CA--C 1.55 1.317 0 C-N-CA 123.271 2.647 . . . . 0.0 112.389 174.12 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -72.76 125.37 10.47 Favored 'Trans proline' 0 CA--C 1.542 0.888 0 C-N-CA 123.416 2.744 . . . . 0.0 112.313 -178.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -157.42 170.4 22.53 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.997 1.719 . . . . 0.0 112.018 176.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 62.3 16.18 8.26 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 115.459 1.652 . . . . 0.0 115.459 169.574 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -98.72 113.84 26.1 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.589 1.555 . . . . 0.0 111.674 177.883 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -146.63 22.87 1.28 Allowed 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 124.824 1.25 . . . . 0.0 113.449 -176.442 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 23.0 tt0 -150.62 76.79 8.15 Favored Pre-proline 0 CA--C 1.546 0.802 0 C-N-CA 125.026 1.33 . . . . 0.0 109.547 -172.903 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -82.15 69.34 7.54 Favored 'Trans proline' 0 CA--C 1.544 1.005 0 C-N-CA 123.919 3.079 . . . . 0.0 112.315 -167.302 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 88.77 123.78 2.21 Favored Glycine 0 CA--C 1.535 1.322 0 C-N-CA 126.021 1.772 . . . . 0.0 112.747 -175.207 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -156.52 162.86 39.92 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.896 1.678 . . . . 0.0 111.088 178.667 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.8 mp -90.11 163.32 14.91 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.185 1.394 . . . . 0.0 111.07 173.308 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -126.22 140.41 52.57 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.686 1.195 . . . . 0.0 112.895 174.69 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -89.25 159.57 17.36 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.792 1.237 . . . . 0.0 111.275 164.743 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 96.5 mt -135.52 156.17 49.32 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.047 1.339 . . . . 0.0 112.178 -176.059 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 87.3 m-70 -81.67 141.87 33.24 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.731 0.812 . . . . 0.0 109.479 162.12 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -104.82 -16.76 14.81 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 -172.415 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -139.58 162.67 34.53 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.155 1.382 . . . . 0.0 112.373 -173.061 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.84 -161.23 53.97 Favored Glycine 0 CA--C 1.541 1.671 0 C-N-CA 124.075 0.845 . . . . 0.0 113.99 179.065 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -67.81 -16.38 45.86 Favored 'Trans proline' 0 CA--C 1.542 0.902 0 C-N-CA 123.241 2.628 . . . . 0.0 113.835 -176.162 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 98.9 mt -92.82 4.28 54.13 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.697 1.199 . . . . 0.0 113.865 175.245 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.41 113.74 2.12 Favored 'General case' 0 CA--C 1.548 0.896 0 CA-C-N 121.097 1.771 . . . . 0.0 111.999 -179.0 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.93 6.16 65.53 Favored Glycine 0 CA--C 1.543 1.787 0 C-N-CA 125.453 1.501 . . . . 0.0 115.737 -173.84 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 6.0 mp -106.44 157.3 35.32 Favored Pre-proline 0 CA--C 1.558 1.267 0 C-N-CA 126.986 2.114 . . . . 0.0 111.318 178.94 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -71.36 163.9 37.53 Favored 'Trans proline' 0 C--N 1.355 0.882 0 C-N-CA 124.65 3.567 . . . . 0.0 113.833 -168.828 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 11.0 t -107.05 -27.88 2.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 123.658 0.783 . . . . 0.0 112.084 176.889 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 29.1 p -126.89 170.38 12.29 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 125.021 1.328 . . . . 0.0 114.471 -179.902 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 71.8 ttt180 -64.65 -39.36 93.56 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 124.618 1.167 . . . . 0.0 111.116 176.855 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 11.8 p -65.9 -40.58 91.66 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.275 1.03 . . . . 0.0 111.987 170.897 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 85.6 m-20 -58.82 -48.86 79.82 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 120.01 1.277 . . . . 0.0 110.846 172.297 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.22 -40.74 91.24 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 121.573 -0.704 . . . . 0.0 112.504 179.5 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 38.4 mmm-85 -61.55 -46.8 88.37 Favored 'General case' 0 N--CA 1.485 1.292 0 O-C-N 121.38 -0.825 . . . . 0.0 112.778 172.3 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 55.4 t -61.67 -46.07 97.33 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 C-N-CA 123.662 0.785 . . . . 0.0 111.058 177.693 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 56.5 mt -63.11 -43.49 98.28 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 117.839 -1.077 . . . . 0.0 112.107 178.642 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 54.5 mt -53.98 -52.6 34.82 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 CA-C-N 119.591 1.087 . . . . 0.0 110.146 171.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -63.33 -46.83 84.79 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 -177.419 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -69.91 -44.8 68.92 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 119.043 0.838 . . . . 0.0 112.233 -177.114 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -54.42 -54.85 35.15 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.951 0.9 . . . . 0.0 109.992 172.947 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.451 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 66.2 t90 -62.39 -42.76 99.67 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-O 117.771 -1.109 . . . . 0.0 112.436 178.805 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -57.56 -46.59 83.74 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 120.723 1.602 . . . . 0.0 112.513 178.408 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -66.65 -49.31 66.64 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 119.347 0.976 . . . . 0.0 112.036 176.399 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 6.1 mmp_? -53.9 -53.88 46.53 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.56 0.744 . . . . 0.0 110.053 177.487 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 45.7 tptt -64.04 -34.26 77.61 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 126.1 1.76 . . . . 0.0 113.374 -178.974 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt -59.7 -37.23 78.29 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.324 0.966 . . . . 0.0 111.086 169.453 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 70.7 m -81.71 -21.97 37.67 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 115.414 1.635 . . . . 0.0 115.414 169.116 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -143.52 84.82 9.78 Favored Pre-proline 0 N--CA 1.477 0.909 0 C-N-CA 125.913 1.685 . . . . 0.0 112.132 -161.063 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -60.45 -12.66 21.51 Favored 'Trans proline' 0 CA--C 1.544 1.019 0 C-N-CA 123.009 2.473 . . . . 0.0 115.288 -172.931 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 40.4 p90 -81.91 -8.07 59.65 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 115.509 1.67 . . . . 0.0 115.509 176.661 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.47 137.74 58.32 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 120.394 1.452 . . . . 0.0 113.444 -176.999 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 84.2 mtp180 -99.99 153.44 19.19 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 125.951 1.7 . . . . 0.0 112.277 175.021 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.451 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.4 tm? -128.4 130.99 48.48 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.769 1.628 . . . . 0.0 110.029 -174.29 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -142.01 131.08 23.23 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.244 1.018 . . . . 0.0 111.049 176.595 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 61.1 mtt -128.32 -0.37 5.7 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.737 1.384 . . . . 0.0 114.737 -171.824 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 63.6 m -65.77 150.86 47.84 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 118.769 0.713 . . . . 0.0 110.467 172.635 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 27.4 m-20 -59.86 -24.45 64.24 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 114.652 1.352 . . . . 0.0 114.652 -165.558 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -55.56 -36.76 67.17 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.678 0.791 . . . . 0.0 112.416 171.674 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.61 -39.31 90.77 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 118.868 0.758 . . . . 0.0 112.101 174.195 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.6 mp -73.14 -47.15 48.51 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 C-N-CA 124.341 1.056 . . . . 0.0 109.071 -179.307 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 11.3 m-30 -57.11 -44.41 83.22 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 118.669 0.668 . . . . 0.0 112.296 176.351 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.3 tmt_? -77.66 -38.29 48.05 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 124.656 1.182 . . . . 0.0 112.595 -173.246 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 46.8 mtt-85 -69.02 -41.92 77.1 Favored 'General case' 0 N--CA 1.483 1.181 0 CA-C-N 118.912 0.778 . . . . 0.0 112.506 169.473 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -130.35 71.15 82.38 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 125.43 1.492 . . . . 0.0 111.544 -164.145 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -66.33 -12.68 36.64 Favored 'Trans proline' 0 CA--C 1.54 0.813 0 C-N-CA 123.171 2.58 . . . . 0.0 113.739 -177.838 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 15.9 p-80 -72.83 -23.86 60.82 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.308 1.043 . . . . 0.0 113.442 172.413 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -80.79 -45.25 17.26 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.193 0.997 . . . . 0.0 112.528 -161.069 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 3.7 tmt_? . . . . . 0 C--O 1.253 1.278 0 C-N-CA 125.968 1.707 . . . . 0.0 110.752 -178.042 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.495 1.814 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 66.6 ttt180 -149.16 57.07 1.01 Allowed 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 124.747 1.219 . . . . 0.0 112.133 -177.598 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -178.27 131.15 1.69 Allowed Glycine 0 CA--C 1.534 1.23 0 O-C-N 121.669 -0.644 . . . . 0.0 114.146 175.792 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 82.3 p -153.21 162.03 41.76 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.949 1.699 . . . . 0.0 111.732 177.963 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 78.6 t60 -147.9 145.4 28.62 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.444 1.097 . . . . 0.0 112.561 179.303 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 -151.43 137.22 18.02 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 125.398 1.479 . . . . 0.0 110.616 169.022 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 40.4 t-80 -155.07 156.36 35.72 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.668 1.187 . . . . 0.0 111.758 177.474 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 19.0 p80 -145.1 154.11 42.13 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 125.205 1.402 . . . . 0.0 111.627 173.931 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 56.1 p-80 -146.63 155.65 42.61 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.651 1.18 . . . . 0.0 113.208 -173.092 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 55.0 p-80 -157.06 165.31 36.46 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.219 1.808 . . . . 0.0 111.523 178.88 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 173.64 138.94 2.77 Favored Glycine 0 CA--C 1.535 1.338 0 C-N-CA 123.677 0.656 . . . . 0.0 113.89 173.334 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 71.1 m -146.04 150.56 36.22 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.904 1.682 . . . . 0.0 111.529 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 62.0 t -133.58 114.96 21.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 C-N-CA 125.179 1.391 . . . . 0.0 109.371 174.666 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.0 m -137.89 15.29 2.88 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 -171.389 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 36.2 p90 -112.54 163.04 14.97 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.512 1.525 . . . . 0.0 113.322 -173.517 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 130.86 89.68 0.51 Allowed Glycine 0 CA--C 1.533 1.163 0 C-N-CA 125.693 1.616 . . . . 0.0 112.236 177.84 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -144.36 64.23 11.97 Favored Pre-proline 0 CA--C 1.556 1.179 0 C-N-CA 124.702 1.201 . . . . 0.0 112.351 -178.475 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -69.52 157.54 60.49 Favored 'Trans proline' 0 CA--C 1.543 0.955 0 C-N-CA 123.65 2.9 . . . . 0.0 112.884 179.388 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 75.4 p -150.3 151.57 31.64 Favored Pre-proline 0 N--CA 1.476 0.844 0 C-N-CA 125.004 1.321 . . . . 0.0 112.732 178.167 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -74.97 156.07 43.11 Favored 'Trans proline' 0 CA--C 1.542 0.919 0 C-N-CA 123.61 2.873 . . . . 0.0 112.721 177.981 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.1 pp -151.19 165.63 33.33 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.142 1.377 . . . . 0.0 112.871 176.795 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.3 t 60.41 178.55 0.1 Allowed 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 126.604 1.962 . . . . 0.0 115.678 177.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 61.39 8.4 2.14 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 127.907 2.483 . . . . 0.0 116.566 179.441 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -63.0 -30.97 72.01 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 120.447 -1.408 . . . . 0.0 113.764 -168.565 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 76.7 p -99.22 0.55 43.46 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.368 1.467 . . . . 0.0 114.743 -176.773 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -136.75 -5.81 1.94 Allowed 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 116.215 1.931 . . . . 0.0 116.215 -169.565 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -58.74 -23.57 60.07 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 115.137 1.532 . . . . 0.0 115.137 -173.083 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -112.12 1.42 16.27 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 126.915 2.086 . . . . 0.0 114.407 177.581 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 44.3 mm -94.92 97.25 6.63 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 C-N-CA 124.588 1.155 . . . . 0.0 110.871 -173.466 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 49.0 t-20 -152.45 122.45 7.05 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.143 1.377 . . . . 0.0 110.647 172.525 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 86.4 t80 -150.24 106.79 3.5 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.444 1.098 . . . . 0.0 110.855 171.494 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 36.8 tpp 59.89 159.45 0.04 OUTLIER 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 127.159 2.184 . . . . 0.0 115.316 -177.689 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 19.3 p -128.84 62.43 61.44 Favored Pre-proline 0 N--CA 1.48 1.027 0 C-N-CA 125.74 1.616 . . . . 0.0 111.607 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -71.79 153.61 58.93 Favored 'Trans proline' 0 CA--C 1.546 1.12 0 C-N-CA 123.068 2.512 . . . . 0.0 112.669 -175.508 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -71.96 115.78 4.44 Favored 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 123.071 2.514 . . . . 0.0 110.477 171.931 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -135.83 142.82 44.87 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 125.36 1.464 . . . . 0.0 111.33 -176.633 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -146.67 -27.93 0.4 Allowed 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 -177.594 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -137.14 143.54 42.53 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.939 1.296 . . . . 0.0 112.08 -174.185 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -137.44 44.38 2.25 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 126.157 1.783 . . . . 0.0 111.068 177.322 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -143.68 62.71 11.27 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 125.205 1.402 . . . . 0.0 112.135 -170.882 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -80.08 64.74 8.9 Favored 'Trans proline' 0 CA--C 1.546 1.096 0 C-N-CA 124.274 3.316 . . . . 0.0 112.332 -171.395 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 84.16 154.72 20.17 Favored Glycine 0 CA--C 1.538 1.508 0 C-N-CA 125.671 1.605 . . . . 0.0 113.27 -170.495 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -153.05 152.12 31.0 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.029 1.332 . . . . 0.0 111.927 -178.249 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 11.1 mp -100.77 160.49 14.32 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.566 1.546 . . . . 0.0 111.053 174.459 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -144.9 155.8 43.64 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.156 1.382 . . . . 0.0 113.215 178.826 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -97.15 154.02 17.62 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.312 1.445 . . . . 0.0 111.987 171.194 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 98.2 mt -130.67 157.36 43.0 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 125.64 1.576 . . . . 0.0 111.186 178.518 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 83.2 m-70 -77.87 141.09 39.32 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.587 0.755 . . . . 0.0 109.82 165.425 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -102.89 -16.75 15.79 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 -174.396 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -139.87 163.0 33.81 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.264 1.425 . . . . 0.0 112.373 -173.093 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.86 -162.71 54.43 Favored Glycine 0 CA--C 1.541 1.686 0 C-N-CA 123.978 0.799 . . . . 0.0 114.159 179.02 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -68.0 -17.02 46.11 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 123.279 2.653 . . . . 0.0 113.887 -175.644 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 81.7 mt -92.25 4.88 52.35 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.741 1.216 . . . . 0.0 113.837 174.875 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.88 114.96 2.55 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 121.142 1.792 . . . . 0.0 112.061 -178.313 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 92.12 3.55 67.58 Favored Glycine 0 CA--C 1.543 1.792 0 C-N-CA 125.704 1.621 . . . . 0.0 115.592 -173.845 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 5.6 mp -105.09 155.36 37.81 Favored Pre-proline 0 CA--C 1.555 1.147 0 C-N-CA 126.841 2.056 . . . . 0.0 111.26 178.868 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -68.4 162.22 41.55 Favored 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 124.71 3.606 . . . . 0.0 113.459 -170.423 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 14.9 t -102.15 -33.72 3.49 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 O-C-N 121.428 -0.795 . . . . 0.0 112.706 178.329 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 27.1 p -123.98 173.87 7.96 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 125.053 1.341 . . . . 0.0 114.165 -178.618 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 55.4 ttt85 -61.28 -42.1 98.08 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.128 0.971 . . . . 0.0 110.914 173.054 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 32.9 m -61.16 -45.03 96.29 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.908 0.883 . . . . 0.0 110.941 173.353 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 78.2 m-20 -61.11 -47.02 88.19 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 118.644 0.657 . . . . 0.0 111.273 175.595 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.36 -41.24 88.79 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.458 -0.776 . . . . 0.0 112.708 179.461 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.7 tmt_? -65.38 -45.44 84.06 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 118.661 0.664 . . . . 0.0 111.818 174.524 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 76.6 t -62.21 -46.01 97.43 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 CA-C-N 118.712 0.687 . . . . 0.0 111.38 177.787 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -63.84 -44.93 91.71 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 118.099 -0.953 . . . . 0.0 112.375 177.723 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 50.2 mt -53.94 -51.78 42.28 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 CA-C-N 119.684 1.129 . . . . 0.0 109.819 171.319 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.441 ' HB2' ' HE1' ' A' ' 101' ' ' MET . 13.3 t80 -60.65 -52.41 65.27 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.09 0.556 . . . . 0.0 112.196 -176.561 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -78.63 -34.71 46.31 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -171.641 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -63.32 -44.22 95.56 Favored 'General case' 0 N--CA 1.467 0.377 0 O-C-N 121.807 -0.558 . . . . 0.0 110.051 169.861 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.442 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 68.2 t90 -59.41 -48.72 80.55 Favored 'General case' 0 C--O 1.216 -0.7 0 CA-C-O 116.834 -1.555 . . . . 0.0 111.753 170.658 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -51.59 -47.94 63.37 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 121.756 2.071 . . . . 0.0 112.606 179.394 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -68.12 -50.14 56.64 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 118.941 0.791 . . . . 0.0 112.432 178.705 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 90.0 mmt-85 -59.23 -45.14 91.93 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 121.471 -0.768 . . . . 0.0 110.474 178.825 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 47.1 tptt -61.31 -36.27 79.67 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 127.108 2.163 . . . . 0.0 113.078 174.833 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -61.33 -35.34 77.12 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.531 1.06 . . . . 0.0 111.145 169.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 60.6 m -80.31 -19.83 45.71 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 115.472 1.656 . . . . 0.0 115.472 167.096 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -142.07 78.71 16.92 Favored Pre-proline 0 N--CA 1.477 0.892 0 C-N-CA 127.004 2.122 . . . . 0.0 111.88 -166.151 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_endo -59.0 -15.81 29.45 Favored 'Trans proline' 0 CA--C 1.545 1.035 0 C-N-CA 123.121 2.547 . . . . 0.0 114.977 -173.487 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 39.4 p90 -78.89 -10.03 59.68 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.932 1.693 . . . . 0.0 115.3 174.917 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 14.6 tp -67.36 134.24 51.13 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 120.389 1.45 . . . . 0.0 113.849 -169.211 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 80.1 ttt180 -86.45 152.68 22.48 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 126.12 1.768 . . . . 0.0 112.494 178.171 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.442 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -131.4 131.49 43.66 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.824 2.05 . . . . 0.0 109.692 -177.05 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -143.49 135.26 26.48 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.945 0.898 . . . . 0.0 111.006 176.488 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.441 ' HE1' ' HB2' ' A' ' 84' ' ' PHE . 63.2 mtt -130.37 21.89 5.19 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.08 1.352 . . . . 0.0 112.782 -176.978 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 32.4 t -63.86 152.53 39.43 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.626 0.771 . . . . 0.0 111.173 173.315 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -52.02 -39.46 59.52 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.964 0.906 . . . . 0.0 112.329 179.349 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -59.32 -37.54 78.01 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.794 1.238 . . . . 0.0 112.78 176.426 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.3 -42.05 99.03 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 118.767 0.712 . . . . 0.0 111.638 176.388 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.26 -46.98 62.68 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 C-N-CA 123.384 0.674 . . . . 0.0 109.735 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 16.6 m-30 -56.11 -45.75 79.37 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 176.457 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.99 -38.31 37.11 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 124.417 1.087 . . . . 0.0 112.631 -172.098 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 56.0 ttt85 -75.7 -36.88 59.9 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.117 0.967 . . . . 0.0 112.631 175.265 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 38.4 m-85 -124.04 80.49 57.67 Favored Pre-proline 0 CA--C 1.545 0.773 0 C-N-CA 125.683 1.593 . . . . 0.0 110.929 -175.439 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -67.75 -9.54 25.86 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 123.326 2.684 . . . . 0.0 114.442 -173.684 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 10.7 p-80 -80.62 -18.54 47.85 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.343 1.057 . . . . 0.0 113.619 170.383 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.58 -10.8 26.4 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 126.666 1.986 . . . . 0.0 113.546 -172.512 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 6.5 ppt_? . . . . . 0 C--O 1.253 1.255 0 C-N-CA 124.621 1.168 . . . . 0.0 113.48 174.531 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 23.3 t . . . . . 0 N--CA 1.474 0.767 0 N-CA-C 110.31 -0.255 . . . . 0.0 110.31 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 22.2 m -140.19 152.92 21.95 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 125.124 1.37 . . . . 0.0 112.884 -176.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.6 m -140.97 155.82 46.17 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 125.967 1.707 . . . . 0.0 111.534 178.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 60.2 t80 -138.14 76.9 1.6 Allowed 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.645 1.178 . . . . 0.0 111.286 179.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -79.47 43.99 2.63 Favored Glycine 0 CA--C 1.537 1.46 0 C-N-CA 125.518 1.532 . . . . 0.0 114.589 -178.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -130.88 67.31 80.59 Favored Pre-proline 0 CA--C 1.553 1.084 0 C-N-CA 125.23 1.412 . . . . 0.0 112.953 -172.294 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -71.21 165.76 31.39 Favored 'Trans proline' 0 CA--C 1.544 1.017 0 C-N-CA 123.703 2.936 . . . . 0.0 112.617 174.232 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 61.8 m -129.42 66.41 76.8 Favored Pre-proline 0 N--CA 1.478 0.93 0 C-N-CA 124.93 1.292 . . . . 0.0 112.308 -178.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -70.4 159.24 53.6 Favored 'Trans proline' 0 CA--C 1.543 0.927 0 C-N-CA 123.559 2.839 . . . . 0.0 112.799 178.301 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 58.6 tp -146.05 130.55 17.79 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.033 1.333 . . . . 0.0 111.356 176.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 77.7 p -143.13 18.37 1.93 Allowed 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 125.089 1.356 . . . . 0.0 113.964 -177.125 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.0 t -90.11 2.39 55.32 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 114.633 1.345 . . . . 0.0 114.633 -167.397 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -137.4 127.3 25.69 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.832 1.253 . . . . 0.0 111.939 -176.418 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 69.3 m -136.88 62.48 1.6 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.976 2.11 . . . . 0.0 110.338 178.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 61.84 21.28 12.13 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.778 2.031 . . . . 0.0 115.237 -177.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -64.06 -25.78 68.26 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 115.106 1.521 . . . . 0.0 115.106 -171.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 . . . . . 0 CA--C 1.548 0.892 0 C-N-CA 125.632 1.573 . . . . 0.0 113.217 -179.137 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.584 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -83.67 143.95 29.73 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.348 1.059 . . . . 0.0 110.908 169.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 59.0 mt -128.08 157.66 40.1 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.336 1.054 . . . . 0.0 112.65 -169.496 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -79.2 138.82 38.0 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.22 1.008 . . . . 0.0 110.193 166.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -95.85 -15.3 22.57 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 114.658 1.355 . . . . 0.0 114.658 -173.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -150.28 169.4 21.45 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.721 1.209 . . . . 0.0 113.105 -172.242 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 72.49 -163.67 54.68 Favored Glycine 0 CA--C 1.54 1.65 0 C-N-CA 124.169 0.89 . . . . 0.0 114.041 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -67.63 -16.94 47.82 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 123.173 2.582 . . . . 0.0 113.713 -176.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.3 mt -94.01 5.88 50.28 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.723 1.209 . . . . 0.0 113.931 175.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.12 123.33 13.31 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 120.91 1.687 . . . . 0.0 112.387 -177.2 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 81.78 3.58 90.56 Favored Glycine 0 CA--C 1.54 1.641 0 C-N-CA 125.523 1.535 . . . . 0.0 115.323 -175.015 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 16.4 mt -101.46 162.1 21.53 Favored Pre-proline 0 CA--C 1.556 1.208 0 C-N-CA 126.145 1.778 . . . . 0.0 110.926 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -76.8 159.35 34.83 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 124.269 3.312 . . . . 0.0 113.562 -164.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 42.4 t -96.55 -33.85 4.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 CA-C-O 118.621 -0.704 . . . . 0.0 112.743 174.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 16.2 p -124.5 172.18 9.4 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 114.707 1.373 . . . . 0.0 114.707 -178.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 13.6 ptp180 -63.65 -35.03 79.19 Favored 'General case' 0 N--CA 1.482 1.125 0 O-C-N 121.358 -0.839 . . . . 0.0 112.052 174.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.0 t -64.98 -46.58 80.86 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.427 0.691 . . . . 0.0 110.411 171.134 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -59.78 -42.64 93.81 Favored 'General case' 0 CA--C 1.539 0.538 0 O-C-N 121.658 -0.651 . . . . 0.0 111.616 177.141 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.01 -43.66 94.98 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 123.957 0.903 . . . . 0.0 113.035 177.191 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.6 tmt_? -64.49 -43.61 93.6 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 119.311 0.959 . . . . 0.0 111.668 176.495 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 77.5 t -63.13 -44.34 99.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 123.605 0.762 . . . . 0.0 110.983 176.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 20.4 mt -57.89 -51.26 70.34 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 118.113 -0.946 . . . . 0.0 112.103 173.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 65.7 mt -54.37 -50.12 59.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 CA-C-N 119.25 0.932 . . . . 0.0 110.365 177.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.438 ' HB2' ' HE1' ' A' ' 101' ' ' MET . 16.0 t80 -64.19 -47.8 78.36 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 -178.104 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -70.45 -42.84 70.98 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 119.131 0.878 . . . . 0.0 112.466 -177.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -56.22 -54.79 41.06 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 124.286 1.034 . . . . 0.0 110.073 172.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.443 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 68.4 t90 -61.07 -45.37 95.03 Favored 'General case' 0 C--O 1.219 -0.505 0 CA-C-O 117.755 -1.117 . . . . 0.0 111.934 177.674 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -55.49 -47.69 75.76 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 120.562 1.528 . . . . 0.0 112.433 178.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -70.65 -48.44 54.92 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 119.524 1.056 . . . . 0.0 112.521 178.423 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.5 mmp_? -55.34 -49.8 71.3 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.063 0.545 . . . . 0.0 110.48 177.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.8 tmtt? -69.79 -29.23 66.49 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.882 1.673 . . . . 0.0 113.637 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 34.0 ttpt -58.92 -37.1 75.89 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.965 1.257 . . . . 0.0 110.851 165.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 68.3 m -81.89 -22.57 36.79 Favored 'General case' 0 N--CA 1.481 1.106 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 168.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -139.92 73.06 33.9 Favored Pre-proline 0 N--CA 1.477 0.916 0 C-N-CA 126.669 1.988 . . . . 0.0 111.534 -164.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -62.05 -6.68 8.34 Favored 'Trans proline' 0 CA--C 1.546 1.099 0 C-N-CA 124.095 3.196 . . . . 0.0 116.5 -165.168 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 37.7 p90 -83.9 -11.58 56.71 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 126.458 1.903 . . . . 0.0 114.875 175.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.5 tp -65.54 136.55 56.54 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 -167.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 27.2 mmm180 -84.23 156.07 22.18 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 124.886 1.275 . . . . 0.0 112.798 179.39 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.443 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -138.75 127.46 23.45 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 126.224 1.81 . . . . 0.0 110.1 -175.636 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -150.17 139.66 21.49 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.604 1.161 . . . . 0.0 111.772 177.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.438 ' HE1' ' HB2' ' A' ' 84' ' ' PHE . 62.6 mtt -135.01 11.04 3.6 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 114.098 1.148 . . . . 0.0 114.098 -167.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 29.8 m -63.02 155.02 28.8 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.117 0.967 . . . . 0.0 111.541 177.039 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -55.23 -36.31 65.86 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 121.09 -1.007 . . . . 0.0 113.448 -171.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -60.86 -34.16 74.18 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.964 0.905 . . . . 0.0 112.841 175.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.05 -41.84 98.55 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 119.071 0.851 . . . . 0.0 111.56 174.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.6 mp -71.34 -45.94 67.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 C-N-CA 123.855 0.862 . . . . 0.0 109.413 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 15.5 m-30 -56.21 -47.02 79.22 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 118.746 0.703 . . . . 0.0 112.693 174.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.9 tmt_? -76.0 -38.18 57.64 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.582 1.153 . . . . 0.0 112.366 -172.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 6.1 ttm180 -75.18 -41.28 58.32 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.675 0.79 . . . . 0.0 112.249 173.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 38.7 m-85 -124.6 81.43 60.3 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 126.028 1.731 . . . . 0.0 111.027 -173.009 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -66.28 -17.48 54.25 Favored 'Trans proline' 0 CA--C 1.539 0.75 0 C-N-CA 123.114 2.543 . . . . 0.0 114.499 -171.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 10.2 p-80 -74.25 -22.89 59.12 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.875 0.87 . . . . 0.0 113.299 173.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -84.32 -15.04 47.99 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 125.819 1.648 . . . . 0.0 113.162 -175.748 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 57.8 ttp180 . . . . . 0 C--O 1.254 1.299 0 C-N-CA 124.501 1.12 . . . . 0.0 111.985 174.018 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 78.8 p . . . . . 0 N--CA 1.478 0.944 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.8 p -156.4 148.11 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 126.263 1.825 . . . . 0.0 110.718 175.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 79.2 p -150.87 151.69 32.59 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.81 1.244 . . . . 0.0 112.552 174.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 38.6 t80 -153.9 155.87 36.5 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.082 1.353 . . . . 0.0 111.739 176.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -77.1 172.83 55.08 Favored Glycine 0 CA--C 1.539 1.568 0 C-N-CA 124.411 1.005 . . . . 0.0 114.801 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -148.13 148.42 29.41 Favored Pre-proline 0 CA--C 1.551 1.007 0 C-N-CA 125.076 1.35 . . . . 0.0 111.826 174.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -74.53 118.33 5.29 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 123.247 2.632 . . . . 0.0 111.708 178.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 68.6 m -139.2 61.63 21.67 Favored Pre-proline 0 N--CA 1.476 0.856 0 C-N-CA 125.068 1.347 . . . . 0.0 111.92 -179.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -66.22 126.39 15.63 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 123.2 2.6 . . . . 0.0 111.904 -178.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 21.9 tp -141.58 -3.35 1.16 Allowed 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 124.524 1.13 . . . . 0.0 113.963 -175.013 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 21.4 m -64.59 138.35 58.35 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.482 1.113 . . . . 0.0 113.202 -173.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 65.4 p -90.94 -16.56 27.87 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -178.565 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.1 pp20? -77.82 160.84 28.07 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 124.499 1.12 . . . . 0.0 113.6 179.198 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 81.4 p -122.05 20.73 10.68 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 125.816 1.646 . . . . 0.0 114.074 -170.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 60.64 -7.92 0.07 Allowed 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 127.805 2.442 . . . . 0.0 116.391 -170.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -64.19 -25.49 68.1 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 120.858 -1.151 . . . . 0.0 113.998 -177.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 . . . . . 0 N--CA 1.472 0.669 0 C-N-CA 125.229 1.412 . . . . 0.0 114.604 176.81 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.55 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -91.24 163.47 14.23 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.642 1.577 . . . . 0.0 111.408 165.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 96.7 mt -136.64 157.18 47.38 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 125.147 1.379 . . . . 0.0 112.18 -176.337 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 84.8 m-70 -80.82 144.13 32.28 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.681 0.792 . . . . 0.0 109.906 162.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -109.01 -6.11 15.79 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.631 1.345 . . . . 0.0 114.631 -173.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -147.54 164.59 32.94 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.904 1.282 . . . . 0.0 112.917 -175.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 69.23 -161.77 52.07 Favored Glycine 0 CA--C 1.541 1.681 0 C-N-CA 123.888 0.756 . . . . 0.0 113.892 -179.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -68.09 -15.93 43.89 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 123.212 2.608 . . . . 0.0 113.752 -177.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 81.3 mt -92.49 4.2 53.98 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.815 1.246 . . . . 0.0 113.924 175.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.27 113.27 1.87 Allowed 'General case' 0 CA--C 1.548 0.893 0 CA-C-N 121.048 1.749 . . . . 0.0 111.807 -179.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.32 9.76 62.95 Favored Glycine 0 CA--C 1.542 1.743 0 C-N-CA 125.179 1.371 . . . . 0.0 115.676 -173.263 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 5.3 mp -111.84 156.56 41.46 Favored Pre-proline 0 CA--C 1.556 1.19 0 C-N-CA 126.911 2.084 . . . . 0.0 111.545 178.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -63.17 162.21 27.38 Favored 'Trans proline' 0 C--N 1.356 0.921 0 C-N-CA 125.056 3.837 . . . . 0.0 114.33 -172.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 8.2 t -105.5 -30.04 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 123.666 0.786 . . . . 0.0 111.824 172.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 26.6 p -126.9 170.71 11.96 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 125.087 1.355 . . . . 0.0 114.237 -178.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 42.9 ttm-85 -60.37 -41.4 93.65 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.011 0.924 . . . . 0.0 110.848 172.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 28.4 m -60.47 -45.45 93.69 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.903 0.881 . . . . 0.0 111.017 173.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -59.78 -49.32 78.19 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 118.443 0.565 . . . . 0.0 110.9 175.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.03 -43.73 98.46 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.633 0.773 . . . . 0.0 112.637 -177.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 73.0 ttt180 -68.91 -40.94 78.8 Favored 'General case' 0 N--CA 1.478 0.935 0 O-C-N 121.213 -0.929 . . . . 0.0 112.497 178.1 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 77.3 t -64.76 -42.22 94.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 CA-C-N 118.365 0.529 . . . . 0.0 111.192 175.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 87.4 mt -65.54 -41.56 92.9 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 118.179 -0.915 . . . . 0.0 112.541 176.267 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 47.7 mt -53.65 -50.89 47.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 CA-C-N 119.368 0.986 . . . . 0.0 109.729 169.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -64.19 -46.63 83.1 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 113.255 0.835 . . . . 0.0 113.255 -178.241 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -69.96 -44.41 69.56 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.136 0.975 . . . . 0.0 112.598 -176.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -61.04 -52.11 66.36 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 118.554 -0.736 . . . . 0.0 110.117 172.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.422 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 61.7 t90 -56.06 -46.44 78.93 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-N 119.452 1.024 . . . . 0.0 112.126 177.004 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -51.75 -55.36 20.13 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 119.72 1.145 . . . . 0.0 112.459 176.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -74.25 -42.97 58.81 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 121.137 -0.977 . . . . 0.0 112.822 -175.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 35.7 mmt180 -57.29 -45.34 84.21 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.296 0.638 . . . . 0.0 109.835 174.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.9 tmtt? -69.72 -32.18 70.6 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.106 0.962 . . . . 0.0 113.516 178.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 66.4 mttt -61.89 -31.14 71.4 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 119.761 1.164 . . . . 0.0 111.715 167.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 70.6 m -81.82 -24.21 36.01 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 115.14 1.533 . . . . 0.0 115.14 165.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -142.49 78.97 15.86 Favored Pre-proline 0 CA--C 1.55 0.949 0 C-N-CA 126.819 2.048 . . . . 0.0 111.561 -166.136 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -62.21 -5.08 5.97 Favored 'Trans proline' 0 CA--C 1.547 1.161 0 C-N-CA 123.707 2.938 . . . . 0.0 116.566 -167.005 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 39.5 p90 -88.04 -3.53 58.89 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.815 2.046 . . . . 0.0 115.065 175.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.84 141.82 43.3 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-N 119.96 1.255 . . . . 0.0 113.447 -177.634 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 1.9 mpp_? -103.24 153.82 19.99 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 125.255 1.422 . . . . 0.0 112.412 174.301 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.422 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.3 tm? -127.37 128.11 45.32 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.837 1.655 . . . . 0.0 110.264 -173.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 58.4 t0 -143.25 128.7 19.01 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.355 1.062 . . . . 0.0 110.956 179.203 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 65.3 mtt -127.47 10.76 6.75 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.459 1.504 . . . . 0.0 113.127 -177.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 72.6 m -68.14 152.44 45.48 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 121.42 -0.8 . . . . 0.0 111.383 172.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -57.21 -34.58 68.68 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -166.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 33.7 mmtp -59.12 -37.28 76.83 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.002 0.921 . . . . 0.0 112.484 177.03 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.38 -37.25 82.7 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.546 0.739 . . . . 0.0 111.844 173.073 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 2.5 mm -75.18 -44.0 43.69 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 C-N-CA 123.374 0.67 . . . . 0.0 109.396 -175.31 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 10.2 m-30 -60.86 -45.39 94.72 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 123.088 0.555 . . . . 0.0 112.106 174.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 6.5 tmm_? -74.15 -35.14 64.05 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.126 0.971 . . . . 0.0 112.52 -173.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 73.4 mtp85 -74.78 -40.61 61.07 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.702 0.801 . . . . 0.0 112.564 170.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 34.3 m-85 -130.3 77.38 76.29 Favored Pre-proline 0 CA--C 1.545 0.785 0 C-N-CA 125.594 1.558 . . . . 0.0 111.266 -169.164 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -66.51 -16.85 52.31 Favored 'Trans proline' 0 CA--C 1.539 0.767 0 C-N-CA 123.077 2.518 . . . . 0.0 113.979 -173.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 12.1 p-80 -74.05 -22.39 59.56 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.278 1.031 . . . . 0.0 113.495 172.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.47 -19.57 27.8 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 125.986 1.715 . . . . 0.0 112.753 -172.584 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 . . . . . 0 C--O 1.256 1.411 0 C-N-CA 124.625 1.17 . . . . 0.0 112.202 174.738 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 88.6 p . . . . . 0 N--CA 1.474 0.774 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.3 p -150.89 148.51 14.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 125.391 1.476 . . . . 0.0 111.027 178.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.2 t -148.18 141.74 25.44 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.623 1.169 . . . . 0.0 111.668 175.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -152.3 154.51 35.83 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.713 1.605 . . . . 0.0 110.912 176.416 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 173.62 -154.81 20.84 Favored Glycine 0 CA--C 1.534 1.276 0 C-N-CA 123.702 0.668 . . . . 0.0 114.148 -178.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . 50.71 56.43 17.23 Favored Pre-proline 0 CA--C 1.557 1.243 0 C-N-CA 126.323 1.849 . . . . 0.0 114.981 -179.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -66.75 159.44 51.26 Favored 'Trans proline' 0 CA--C 1.544 0.981 0 C-N-CA 123.242 2.628 . . . . 0.0 112.328 174.346 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 37.3 p -136.57 56.78 14.33 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 124.835 1.254 . . . . 0.0 113.863 -173.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -64.67 143.29 80.44 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 123.208 2.605 . . . . 0.0 112.233 177.051 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 58.2 tp -153.34 142.65 21.55 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.86 1.264 . . . . 0.0 111.715 -177.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 66.5 p -145.57 140.69 27.6 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.201 1.4 . . . . 0.0 111.354 168.125 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.4 m -141.02 13.22 2.24 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 -169.045 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -148.1 156.35 42.51 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.672 1.189 . . . . 0.0 113.466 -170.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 19.4 t -154.55 148.39 25.54 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.471 1.508 . . . . 0.0 111.156 175.014 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 56.95 24.25 9.19 Favored 'General case' 0 CA--C 1.552 1.019 0 C-N-CA 125.676 1.59 . . . . 0.0 114.712 178.114 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -75.7 -24.8 56.26 Favored 'General case' 0 N--CA 1.475 0.799 0 O-C-N 120.816 -1.177 . . . . 0.0 113.918 -174.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 . . . . . 0 CA--C 1.546 0.815 0 C-N-CA 125.624 1.57 . . . . 0.0 114.693 -175.806 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.573 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -84.61 144.05 28.86 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.437 1.095 . . . . 0.0 110.7 166.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.4 mt -128.05 157.55 40.38 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.408 1.083 . . . . 0.0 112.441 -169.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -78.07 138.72 38.91 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.896 0.879 . . . . 0.0 110.044 166.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -94.09 -22.75 18.3 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 114.321 1.23 . . . . 0.0 114.321 -175.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -140.68 165.91 26.19 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.99 1.316 . . . . 0.0 112.855 -170.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.37 -163.14 54.81 Favored Glycine 0 CA--C 1.54 1.599 0 C-N-CA 124.247 0.927 . . . . 0.0 114.201 177.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -67.49 -17.08 48.62 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 123.314 2.676 . . . . 0.0 113.754 -176.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.5 mt -93.94 5.0 53.1 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.662 1.185 . . . . 0.0 113.782 175.641 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.32 123.69 14.64 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 120.936 1.698 . . . . 0.0 112.282 -177.06 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 82.58 3.04 90.68 Favored Glycine 0 CA--C 1.541 1.664 0 C-N-CA 125.631 1.586 . . . . 0.0 115.321 -174.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.402 ' HB3' ' HD2' ' A' ' 73' ' ' PRO . 18.0 mt -102.1 161.63 22.8 Favored Pre-proline 0 CA--C 1.556 1.184 0 C-N-CA 126.057 1.743 . . . . 0.0 111.087 -179.214 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.402 ' HD2' ' HB3' ' A' ' 72' ' ' LEU . 73.5 Cg_endo -77.06 156.65 34.05 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 124.208 3.272 . . . . 0.0 113.837 -164.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 39.2 t -94.73 -35.73 6.37 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 O-C-N 121.569 -0.707 . . . . 0.0 112.82 176.45 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 19.9 p -123.44 172.67 8.53 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 125.229 1.412 . . . . 0.0 114.017 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 47.7 ttp180 -64.7 -36.43 84.26 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 121.11 -0.994 . . . . 0.0 110.97 174.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 30.4 m -60.53 -44.27 96.25 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.476 0.71 . . . . 0.0 110.937 170.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 -63.19 -43.67 97.56 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.48 -0.762 . . . . 0.0 111.74 176.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.6 -41.45 96.22 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 118.79 0.723 . . . . 0.0 112.743 177.372 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 22.9 tpp85 -61.75 -45.89 91.98 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.096 1.359 . . . . 0.0 111.762 175.047 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 73.4 t -65.08 -44.14 95.76 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 123.705 0.802 . . . . 0.0 111.11 177.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 17.9 mt -56.46 -49.71 73.81 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 118.603 -0.713 . . . . 0.0 111.997 173.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 51.8 mt -54.24 -52.05 42.02 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 CA-C-N 118.573 0.624 . . . . 0.0 110.322 176.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 22.5 t80 -66.6 -47.19 73.45 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -177.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -68.33 -45.47 72.82 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 118.722 0.692 . . . . 0.0 112.244 -177.552 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 58.1 mm-40 -60.51 -51.4 69.62 Favored 'General case' 0 C--N 1.342 0.248 0 CA-C-O 118.38 -0.819 . . . . 0.0 109.926 174.278 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.445 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 67.5 t90 -56.6 -43.61 80.3 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 119.797 1.18 . . . . 0.0 112.598 177.63 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -59.04 -49.64 77.1 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 119.849 1.204 . . . . 0.0 113.109 177.009 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -71.56 -46.31 59.78 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 119.673 1.124 . . . . 0.0 112.471 -179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 33.4 mmt180 -58.8 -44.6 90.83 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.752 0.821 . . . . 0.0 109.721 176.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 74.5 tttt -70.8 -29.41 65.59 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 176.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -59.47 -35.2 73.64 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 119.922 1.237 . . . . 0.0 110.857 166.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 8.4 t -78.22 -32.9 50.12 Favored 'General case' 0 CA--C 1.553 1.088 0 N-CA-C 114.617 1.34 . . . . 0.0 114.617 167.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -132.97 77.82 67.22 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 127.196 2.198 . . . . 0.0 112.198 -166.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -63.9 5.79 0.34 Allowed 'Trans proline' 0 CA--C 1.549 1.247 0 C-N-CA 124.697 3.598 . . . . 0.0 117.532 -165.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 31.2 p90 -99.78 -6.01 27.67 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 127.306 2.242 . . . . 0.0 114.806 177.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 13.1 tp -65.77 139.51 58.35 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 115.224 1.565 . . . . 0.0 115.224 -167.011 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 11.6 ptp85 -90.02 157.74 17.67 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 125.834 1.653 . . . . 0.0 113.788 176.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.445 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.4 tm? -137.95 130.95 30.13 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 126.935 2.094 . . . . 0.0 109.924 -172.348 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -142.03 136.65 30.45 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.288 1.035 . . . . 0.0 110.632 172.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 61.9 mtt -123.61 5.76 8.89 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.912 1.285 . . . . 0.0 114.268 -172.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 35.0 t -63.74 148.22 49.7 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 119.011 0.823 . . . . 0.0 111.557 178.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -53.82 -31.86 50.76 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 121.202 -0.937 . . . . 0.0 112.813 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 53.8 tptt -54.93 -41.24 70.78 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.956 1.302 . . . . 0.0 112.623 172.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.68 -36.41 83.77 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.159 0.983 . . . . 0.0 112.263 176.363 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.9 mp -74.35 -46.51 43.6 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 C-N-CA 124.185 0.994 . . . . 0.0 109.458 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -56.43 -44.74 80.69 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 119.076 0.853 . . . . 0.0 112.132 174.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.3 tmt_? -72.4 -40.55 67.12 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 124.576 1.15 . . . . 0.0 112.26 -174.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 73.4 mtt85 -72.04 -38.75 69.46 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 173.091 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -131.48 79.39 69.54 Favored Pre-proline 0 CA--C 1.545 0.753 0 C-N-CA 125.584 1.553 . . . . 0.0 110.822 -166.6 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -66.85 -16.05 48.88 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 123.064 2.509 . . . . 0.0 113.986 -173.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 12.1 p-80 -73.49 -23.94 60.11 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.052 0.941 . . . . 0.0 113.134 172.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.44 -27.99 37.83 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.579 1.552 . . . . 0.0 112.3 -173.201 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 51.8 ttt85 . . . . . 0 C--O 1.255 1.359 0 C-N-CA 124.69 1.196 . . . . 0.0 112.288 175.357 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.6 t . . . . . 0 N--CA 1.473 0.684 0 CA-C-O 120.622 0.249 . . . . 0.0 111.088 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 9.7 p -83.73 143.77 11.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 124.444 1.098 . . . . 0.0 112.02 -178.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 50.4 m -79.44 152.94 30.02 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.04 0.936 . . . . 0.0 112.379 175.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -124.55 146.8 48.81 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.937 1.295 . . . . 0.0 111.566 176.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 72.56 177.19 30.65 Favored Glycine 0 CA--C 1.539 1.546 0 C-N-CA 123.993 0.806 . . . . 0.0 113.73 -169.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -149.27 151.32 33.66 Favored Pre-proline 0 CA--C 1.55 0.952 0 C-N-CA 125.033 1.333 . . . . 0.0 111.929 179.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.48 149.33 68.54 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 123.209 2.606 . . . . 0.0 112.219 175.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 49.8 m -75.01 147.58 83.76 Favored Pre-proline 0 N--CA 1.474 0.728 0 C-N-CA 123.921 0.888 . . . . 0.0 112.791 -178.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -71.06 164.82 34.43 Favored 'Trans proline' 0 CA--C 1.543 0.95 0 C-N-CA 123.522 2.815 . . . . 0.0 112.322 172.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.3 tt -136.34 127.71 28.4 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.975 1.31 . . . . 0.0 110.836 178.159 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 31.2 m -139.8 29.71 2.1 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.286 1.435 . . . . 0.0 112.591 -173.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.5 m -74.39 -10.07 59.21 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 115.921 1.823 . . . . 0.0 115.921 -164.076 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -129.08 136.09 49.78 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.939 1.296 . . . . 0.0 111.884 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 81.7 p -158.54 166.66 31.61 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.425 1.49 . . . . 0.0 112.575 -177.361 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 61.12 21.35 11.76 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 115.35 1.611 . . . . 0.0 115.35 172.292 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -74.45 -19.61 60.33 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 120.769 -1.207 . . . . 0.0 114.158 -175.009 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 . . . . . 0 CA--C 1.553 1.058 0 C-N-CA 125.416 1.486 . . . . 0.0 113.41 -177.656 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.619 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -95.23 150.52 20.14 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.981 1.312 . . . . 0.0 112.137 173.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 91.5 mt -130.43 157.62 42.11 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.623 1.569 . . . . 0.0 111.675 -179.164 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -79.06 141.26 37.55 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.102 0.961 . . . . 0.0 110.463 168.004 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -100.25 -11.85 20.02 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 -173.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -149.41 167.83 25.08 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.791 1.236 . . . . 0.0 113.233 -172.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.41 -163.62 54.11 Favored Glycine 0 CA--C 1.54 1.647 0 C-N-CA 124.16 0.886 . . . . 0.0 114.014 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -67.64 -16.56 46.97 Favored 'Trans proline' 0 CA--C 1.542 0.882 0 C-N-CA 123.262 2.642 . . . . 0.0 113.686 -177.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.0 mt -92.89 4.66 53.51 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.702 1.201 . . . . 0.0 113.873 175.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.63 122.62 11.76 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 120.874 1.67 . . . . 0.0 112.016 -177.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.2 5.06 89.35 Favored Glycine 0 CA--C 1.541 1.704 0 C-N-CA 125.399 1.476 . . . . 0.0 115.404 -174.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 18.7 mt -104.74 159.07 30.55 Favored Pre-proline 0 CA--C 1.556 1.177 0 C-N-CA 126.227 1.811 . . . . 0.0 111.263 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -79.38 160.12 25.89 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 124.523 3.482 . . . . 0.0 113.805 -164.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 19.1 t -102.36 -33.15 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 N-CA-C 113.381 0.882 . . . . 0.0 113.381 -175.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 19.7 p -123.44 171.28 9.59 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 114.3 1.222 . . . . 0.0 114.3 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 46.3 ttt180 -61.83 -40.14 94.24 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 124.356 1.063 . . . . 0.0 110.767 177.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 31.4 m -63.6 -44.42 94.06 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 124.683 1.193 . . . . 0.0 111.552 171.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 78.5 m-20 -60.1 -47.0 87.72 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.007 0.821 . . . . 0.0 110.993 174.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.66 -39.56 91.82 Favored 'General case' 0 CA--C 1.541 0.596 0 O-C-N 121.405 -0.81 . . . . 0.0 112.575 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 78.9 ttt180 -64.49 -43.66 93.46 Favored 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 119.24 0.927 . . . . 0.0 112.344 172.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 54.9 t -60.62 -49.24 85.25 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 CA-C-N 118.797 0.726 . . . . 0.0 111.182 175.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -62.64 -42.66 99.73 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 118.22 -0.895 . . . . 0.0 112.15 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 56.0 mt -55.86 -51.37 61.1 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 CA-C-N 119.408 1.004 . . . . 0.0 110.471 170.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 20.2 t80 -63.67 -47.63 80.44 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -175.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 12.3 t30 -68.99 -44.07 73.57 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 118.913 0.779 . . . . 0.0 112.169 -179.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -56.21 -53.5 56.46 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 122.701 0.401 . . . . 0.0 110.059 174.285 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.448 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 62.6 t90 -59.37 -46.8 87.64 Favored 'General case' 0 C--O 1.218 -0.587 0 CA-C-O 117.415 -1.278 . . . . 0.0 111.793 177.226 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -55.91 -48.76 75.09 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 120.928 1.694 . . . . 0.0 113.306 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -69.01 -47.4 65.59 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.171 0.896 . . . . 0.0 111.982 179.279 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 38.8 mmm-85 -59.16 -47.63 84.59 Favored 'General case' 0 C--O 1.216 -0.67 0 O-C-N 121.645 -0.659 . . . . 0.0 110.699 177.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 18.9 tptm -62.42 -35.09 78.15 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 126.07 1.748 . . . . 0.0 113.043 176.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 14.9 tmtt? -59.44 -36.82 76.65 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 119.603 1.092 . . . . 0.0 111.126 168.458 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 66.5 m -81.7 -18.34 44.73 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 115.926 1.824 . . . . 0.0 115.926 168.691 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -140.13 84.07 15.19 Favored Pre-proline 0 N--CA 1.477 0.903 0 C-N-CA 126.603 1.961 . . . . 0.0 111.88 -165.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -62.04 -0.92 1.91 Allowed 'Trans proline' 0 CA--C 1.549 1.256 0 C-N-CA 124.274 3.316 . . . . 0.0 116.598 -171.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 31.3 p90 -98.25 -10.96 23.17 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.667 1.987 . . . . 0.0 115.161 177.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 11.1 tp -66.82 137.73 56.82 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 114.671 1.36 . . . . 0.0 114.671 -166.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 18.6 mmt85 -99.37 159.25 15.15 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 126.05 1.74 . . . . 0.0 112.44 -179.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.448 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.4 tm? -137.07 133.51 35.5 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.573 1.949 . . . . 0.0 109.958 -169.556 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 54.0 t0 -141.43 130.53 23.34 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.186 0.994 . . . . 0.0 111.079 176.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 65.4 mtt -124.47 6.88 8.3 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.259 1.423 . . . . 0.0 113.409 -179.002 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 68.7 m -64.18 147.25 52.76 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 121.496 -0.753 . . . . 0.0 110.547 168.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.4 -26.23 67.71 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 113.526 0.935 . . . . 0.0 113.526 -166.009 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 61.0 mtpt -56.95 -34.79 68.37 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.76 1.224 . . . . 0.0 113.248 172.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.92 -39.69 92.93 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 118.914 0.779 . . . . 0.0 111.613 173.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.6 mp -73.62 -46.13 48.94 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 C-N-CA 124.299 1.039 . . . . 0.0 109.24 -179.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.4 m-30 -55.87 -46.13 78.34 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 119.152 0.887 . . . . 0.0 112.464 175.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.72 -41.59 44.53 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.387 1.075 . . . . 0.0 112.532 -173.087 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 6.9 ttm180 -75.27 -39.81 59.4 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.642 0.777 . . . . 0.0 112.447 176.563 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -124.73 74.58 64.19 Favored Pre-proline 0 CA--C 1.547 0.854 0 C-N-CA 125.999 1.72 . . . . 0.0 111.214 -172.521 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -67.09 -10.25 27.91 Favored 'Trans proline' 0 CA--C 1.538 0.694 0 C-N-CA 123.521 2.814 . . . . 0.0 114.626 -173.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 14.7 p-80 -77.98 -24.55 47.99 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.341 1.056 . . . . 0.0 113.407 172.079 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -77.76 -48.84 15.64 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.292 1.037 . . . . 0.0 112.057 -161.447 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 10.7 mmt180 . . . . . 0 C--O 1.254 1.301 0 C-N-CA 126.442 1.897 . . . . 0.0 112.923 179.633 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.2 t . . . . . 0 N--CA 1.476 0.865 0 N-CA-C 113.021 0.749 . . . . 0.0 113.021 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 13.1 p -153.75 142.94 14.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 126.0 1.72 . . . . 0.0 110.271 174.236 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 82.1 p -155.62 159.95 40.04 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.331 1.053 . . . . 0.0 113.366 -178.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 90.7 t80 -148.08 151.37 35.54 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.458 1.503 . . . . 0.0 111.252 170.016 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -179.71 47.33 0.08 OUTLIER Glycine 0 CA--C 1.532 1.156 0 C-N-CA 123.848 0.737 . . . . 0.0 113.772 177.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -129.09 62.11 60.63 Favored Pre-proline 0 CA--C 1.554 1.117 0 C-N-CA 124.429 1.092 . . . . 0.0 113.944 -171.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -69.97 168.74 20.95 Favored 'Trans proline' 0 CA--C 1.545 1.054 0 C-N-CA 123.379 2.72 . . . . 0.0 112.163 169.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 14.8 t -134.88 83.8 39.76 Favored Pre-proline 0 N--CA 1.474 0.764 0 C-N-CA 124.465 1.106 . . . . 0.0 111.316 176.093 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -80.22 64.03 8.82 Favored 'Trans proline' 0 CA--C 1.546 1.115 0 C-N-CA 124.454 3.436 . . . . 0.0 111.475 -179.413 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -75.77 -6.61 51.45 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 115.784 1.772 . . . . 0.0 115.784 -170.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.2 m -64.11 139.67 58.79 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.633 1.173 . . . . 0.0 113.132 -175.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 77.9 p -133.41 15.05 4.11 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 125.19 1.396 . . . . 0.0 114.291 -171.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -64.03 -27.92 69.45 Favored 'General case' 0 N--CA 1.476 0.871 0 O-C-N 120.901 -1.125 . . . . 0.0 113.691 -171.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 31.1 p -79.84 -45.89 17.89 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.579 1.151 . . . . 0.0 112.214 171.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 57.8 mt-10 -60.21 -27.0 66.82 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.78 1.232 . . . . 0.0 112.868 179.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -67.37 -14.18 62.69 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.018 1.327 . . . . 0.0 114.239 175.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 . . . . . 0 N--CA 1.476 0.853 0 N-CA-C 115.624 1.713 . . . . 0.0 115.624 179.583 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.621 0 CA-C-O 120.398 0.142 . . . . 0.0 111.34 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -84.36 143.71 29.3 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.318 1.047 . . . . 0.0 111.22 170.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 58.3 mt -126.88 157.46 39.3 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.718 1.207 . . . . 0.0 112.629 -170.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -79.41 137.47 37.28 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.01 0.924 . . . . 0.0 110.24 166.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -93.74 -16.9 23.74 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 -174.211 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -150.65 170.31 19.49 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.772 1.229 . . . . 0.0 113.005 -172.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.59 -163.99 54.79 Favored Glycine 0 CA--C 1.54 1.655 0 C-N-CA 124.155 0.883 . . . . 0.0 114.049 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -67.58 -17.11 48.2 Favored 'Trans proline' 0 CA--C 1.542 0.882 0 C-N-CA 123.265 2.643 . . . . 0.0 113.752 -176.075 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.7 mt -95.32 6.89 47.8 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.699 1.199 . . . . 0.0 113.834 175.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -54.7 123.46 13.34 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 120.853 1.66 . . . . 0.0 112.442 -176.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 81.63 3.0 90.72 Favored Glycine 0 CA--C 1.54 1.625 0 C-N-CA 125.577 1.561 . . . . 0.0 115.387 -175.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.431 ' HB3' ' HD2' ' A' ' 73' ' ' PRO . 19.0 mt -100.57 161.21 24.68 Favored Pre-proline 0 CA--C 1.555 1.144 0 C-N-CA 126.062 1.745 . . . . 0.0 111.0 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.431 ' HD2' ' HB3' ' A' ' 72' ' ' LEU . 71.8 Cg_endo -75.24 157.24 41.87 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 124.197 3.265 . . . . 0.0 113.63 -165.74 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 52.0 t -92.5 -36.27 7.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 O-C-N 121.434 -0.791 . . . . 0.0 112.719 175.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 16.4 p -122.41 172.36 8.39 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 124.999 1.319 . . . . 0.0 114.496 -178.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 34.6 ptt-85 -63.48 -34.4 77.69 Favored 'General case' 0 N--CA 1.483 1.193 0 O-C-N 121.298 -0.876 . . . . 0.0 112.26 172.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 17.7 t -66.4 -44.96 81.57 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.16 0.584 . . . . 0.0 110.605 171.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -60.4 -43.16 96.94 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.619 -0.676 . . . . 0.0 111.397 175.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.47 -43.97 97.53 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.775 0.83 . . . . 0.0 112.78 176.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 60.3 ttp180 -65.34 -41.75 93.6 Favored 'General case' 0 N--CA 1.477 0.917 0 O-C-N 121.341 -0.849 . . . . 0.0 112.233 177.115 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 71.0 t -63.73 -45.0 98.52 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 C-N-CA 123.65 0.78 . . . . 0.0 111.073 175.42 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 21.4 mt -58.61 -48.96 79.22 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 118.56 -0.733 . . . . 0.0 112.335 174.148 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 57.2 mt -54.2 -51.12 50.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-N 118.598 0.636 . . . . 0.0 109.915 176.232 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.406 ' HB2' ' HE1' ' A' ' 101' ' ' MET . 12.7 t80 -64.17 -50.65 67.33 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.856 0.687 . . . . 0.0 112.856 -177.695 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -66.46 -45.79 78.58 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 119.193 0.906 . . . . 0.0 112.395 -177.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -62.2 -45.83 91.6 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 119.135 -0.459 . . . . 0.0 110.505 178.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 68.6 t90 -60.09 -46.58 89.12 Favored 'General case' 0 C--O 1.217 -0.617 0 CA-C-O 117.506 -1.235 . . . . 0.0 111.953 172.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -57.35 -45.15 84.64 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 121.149 1.795 . . . . 0.0 113.042 179.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -69.53 -50.02 48.94 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 119.559 1.072 . . . . 0.0 112.187 178.213 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -56.64 -49.74 74.11 Favored 'General case' 0 C--O 1.216 -0.672 0 O-C-N 121.789 -0.569 . . . . 0.0 110.602 176.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.9 tmtt? -66.44 -30.92 71.38 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.664 1.586 . . . . 0.0 113.634 179.271 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 2.4 tmpt? -58.73 -37.92 77.22 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 120.015 1.279 . . . . 0.0 110.756 165.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 51.5 m -83.03 -16.94 45.07 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 115.575 1.694 . . . . 0.0 115.575 169.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -142.91 72.11 18.99 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 127.328 2.251 . . . . 0.0 111.194 -166.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -61.56 -6.26 6.87 Favored 'Trans proline' 0 CA--C 1.548 1.185 0 C-N-CA 123.921 3.081 . . . . 0.0 116.545 -165.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 38.9 p90 -86.13 -9.78 56.02 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 126.76 2.024 . . . . 0.0 115.032 174.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.6 tp -65.76 138.06 57.68 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 114.762 1.393 . . . . 0.0 114.762 -165.463 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 82.0 mtp180 -84.26 155.23 22.55 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 125.737 1.615 . . . . 0.0 112.997 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -138.52 129.87 27.34 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 126.608 1.963 . . . . 0.0 109.947 -173.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 50.8 t0 -147.4 131.54 17.35 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.084 0.954 . . . . 0.0 111.439 -179.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.406 ' HE1' ' HB2' ' A' ' 84' ' ' PHE . 65.6 mtt -132.3 6.03 4.14 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 114.526 1.306 . . . . 0.0 114.526 -171.199 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 66.6 m -63.44 155.87 27.83 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 121.313 -0.867 . . . . 0.0 111.591 174.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 24.1 p-10 -48.62 -43.41 36.28 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.288 1.218 . . . . 0.0 114.288 -176.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 62.1 mtpt -55.5 -38.02 68.64 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.858 1.263 . . . . 0.0 113.52 173.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.87 -40.73 96.39 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 119.26 0.936 . . . . 0.0 111.931 176.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -73.75 -45.96 48.64 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 C-N-CA 124.617 1.167 . . . . 0.0 109.73 -179.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 14.9 m-30 -56.93 -45.13 82.96 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 118.806 0.73 . . . . 0.0 112.61 175.094 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -74.51 -36.4 63.2 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.44 1.096 . . . . 0.0 111.99 -174.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 72.1 mtt85 -70.16 -40.28 74.83 Favored 'General case' 0 N--CA 1.484 1.229 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 169.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 35.3 m-85 -132.22 88.41 40.4 Favored Pre-proline 0 CA--C 1.546 0.792 0 C-N-CA 125.398 1.479 . . . . 0.0 110.87 -167.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -68.05 -19.96 44.88 Favored 'Trans proline' 0 CA--C 1.538 0.711 0 C-N-CA 122.795 2.33 . . . . 0.0 114.013 -170.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 8.4 p-80 -71.94 -23.63 61.49 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 123.619 0.767 . . . . 0.0 112.919 173.01 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -85.31 1.93 46.27 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 126.56 1.944 . . . . 0.0 113.593 -179.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? . . . . . 0 C--O 1.253 1.256 0 C-N-CA 125.715 1.606 . . . . 0.0 110.84 172.404 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 69.9 m . . . . . 0 N--CA 1.477 0.891 0 N-CA-C 111.748 0.277 . . . . 0.0 111.748 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.6 p -152.2 146.3 15.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 C-N-CA 124.751 1.221 . . . . 0.0 111.803 179.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.1 p -148.01 149.92 33.03 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.74 1.616 . . . . 0.0 111.292 171.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -154.63 164.33 38.9 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.41 1.084 . . . . 0.0 112.756 -175.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 101.74 132.82 7.86 Favored Glycine 0 CA--C 1.535 1.317 0 C-N-CA 125.673 1.606 . . . . 0.0 113.908 173.347 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -155.24 154.65 28.94 Favored Pre-proline 0 CA--C 1.552 1.034 0 C-N-CA 126.321 1.849 . . . . 0.0 111.137 178.363 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo -69.9 153.1 68.67 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 123.142 2.562 . . . . 0.0 112.343 174.171 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 67.8 m -134.53 66.17 69.23 Favored Pre-proline 0 N--CA 1.477 0.894 0 C-N-CA 124.709 1.204 . . . . 0.0 112.445 -175.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -66.97 135.68 38.57 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 123.102 2.535 . . . . 0.0 111.567 175.301 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 90.0 mt -142.85 152.47 42.2 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.474 1.509 . . . . 0.0 112.158 -176.249 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 54.7 p -80.41 161.2 25.07 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.204 1.402 . . . . 0.0 112.353 169.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 88.6 p -145.96 -4.73 0.63 Allowed 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.565 1.32 . . . . 0.0 114.565 -178.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -121.6 -3.14 9.32 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 126.322 1.849 . . . . 0.0 114.765 -171.507 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 42.3 m -73.17 141.32 47.4 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.059 0.944 . . . . 0.0 113.481 -173.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 60.42 10.04 2.28 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 116.859 2.17 . . . . 0.0 116.859 171.453 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -69.46 -20.58 63.75 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 114.789 1.403 . . . . 0.0 114.789 -174.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 . . . . . 0 CA--C 1.549 0.905 0 C-N-CA 124.991 1.317 . . . . 0.0 114.532 -179.732 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.569 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -82.78 146.35 29.02 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.218 1.007 . . . . 0.0 110.898 167.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 61.5 mt -128.9 157.78 40.63 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.57 1.148 . . . . 0.0 112.712 -169.53 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 -80.8 141.62 34.53 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.074 0.95 . . . . 0.0 110.206 166.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -100.16 -13.1 19.08 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 114.811 1.411 . . . . 0.0 114.811 -171.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -149.56 167.74 25.46 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.586 1.154 . . . . 0.0 113.221 -172.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.69 -162.03 53.72 Favored Glycine 0 CA--C 1.541 1.704 0 C-N-CA 124.17 0.891 . . . . 0.0 113.916 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -67.52 -16.44 47.25 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 123.194 2.596 . . . . 0.0 113.649 -177.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 97.2 mt -92.68 4.22 54.12 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.756 1.222 . . . . 0.0 113.915 175.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.1 122.21 11.17 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 120.941 1.7 . . . . 0.0 112.139 -177.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 82.64 4.62 90.02 Favored Glycine 0 CA--C 1.539 1.593 0 C-N-CA 125.457 1.503 . . . . 0.0 115.372 -174.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.421 ' HB3' ' HD2' ' A' ' 73' ' ' PRO . 16.5 mt -102.1 159.86 28.12 Favored Pre-proline 0 CA--C 1.555 1.14 0 C-N-CA 126.15 1.78 . . . . 0.0 111.271 -179.172 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.421 ' HD2' ' HB3' ' A' ' 72' ' ' LEU . 74.4 Cg_endo -75.78 160.45 37.56 Favored 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 124.317 3.344 . . . . 0.0 113.884 -165.296 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 29.6 t -103.24 -32.01 2.99 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 178.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 18.1 p -124.51 170.42 10.91 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 125.181 1.393 . . . . 0.0 113.898 177.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 39.3 ttm180 -66.03 -34.58 78.42 Favored 'General case' 0 N--CA 1.48 1.046 0 O-C-N 121.019 -1.05 . . . . 0.0 111.113 178.359 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 34.2 m -61.51 -46.54 89.54 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.028 0.931 . . . . 0.0 111.255 168.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -60.22 -44.51 95.13 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 119.14 0.882 . . . . 0.0 111.426 176.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.39 -41.1 96.84 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.439 0.696 . . . . 0.0 112.538 178.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 20.7 ttp180 -67.88 -40.51 83.53 Favored 'General case' 0 N--CA 1.479 1.005 0 O-C-N 121.114 -0.991 . . . . 0.0 112.344 176.357 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 72.2 t -62.74 -45.18 99.47 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 C-N-CA 123.486 0.715 . . . . 0.0 110.799 175.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 23.7 mt -58.27 -49.05 78.5 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 118.389 -0.815 . . . . 0.0 112.193 173.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 51.9 mt -52.76 -52.12 30.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 CA-C-N 118.796 0.726 . . . . 0.0 110.043 176.012 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -65.95 -50.83 63.0 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 -176.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -68.57 -43.03 77.44 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 118.933 0.788 . . . . 0.0 112.511 -175.259 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -64.85 -45.88 84.23 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 118.639 -0.696 . . . . 0.0 110.48 175.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.413 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 68.1 t90 -58.98 -47.35 85.47 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-O 117.08 -1.438 . . . . 0.0 111.579 173.21 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -55.15 -49.32 72.11 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 121.329 1.877 . . . . 0.0 112.771 178.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -64.47 -51.73 61.57 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 121.124 -0.985 . . . . 0.0 112.427 179.015 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 10.3 mmm180 -58.22 -47.47 83.4 Favored 'General case' 0 C--O 1.213 -0.829 0 C-N-CA 123.114 0.566 . . . . 0.0 110.51 177.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 18.8 tptp -60.17 -37.33 79.85 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 125.936 1.695 . . . . 0.0 113.143 177.414 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 61.1 mtpt -62.89 -31.16 72.16 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 119.194 0.906 . . . . 0.0 111.866 170.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 68.7 m -83.15 -20.06 35.45 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 115.922 1.823 . . . . 0.0 115.922 165.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -145.16 77.81 12.72 Favored Pre-proline 0 N--CA 1.479 0.988 0 C-N-CA 127.06 2.144 . . . . 0.0 111.254 -162.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -56.77 -24.25 54.48 Favored 'Trans proline' 0 CA--C 1.546 1.077 0 C-N-CA 122.624 2.216 . . . . 0.0 114.756 -170.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 44.8 p90 -71.85 -6.55 42.54 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 116.043 1.868 . . . . 0.0 116.043 177.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 14.0 tp -70.58 131.83 44.57 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 120.981 1.719 . . . . 0.0 114.101 -170.444 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 41.4 ptt180 -87.79 160.07 18.18 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 124.904 1.282 . . . . 0.0 113.735 176.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.413 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.4 tm? -139.17 129.83 25.99 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.741 2.016 . . . . 0.0 109.995 -169.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -147.87 135.04 20.43 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.287 1.035 . . . . 0.0 111.332 178.147 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 63.8 mtt -129.82 1.48 4.87 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 114.731 1.382 . . . . 0.0 114.731 -169.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 66.2 m -62.36 151.1 37.74 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 119.057 0.844 . . . . 0.0 111.613 175.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 43.2 p-10 -50.74 -37.81 44.0 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 114.65 1.352 . . . . 0.0 114.65 -174.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt -52.97 -40.05 63.42 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.408 1.483 . . . . 0.0 113.167 173.317 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.5 -39.01 89.41 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 123.625 0.77 . . . . 0.0 112.042 176.226 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.6 mp -73.83 -45.19 50.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 C-N-CA 123.391 0.677 . . . . 0.0 109.3 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 9.9 m-30 -55.94 -44.51 78.45 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 118.779 0.718 . . . . 0.0 112.214 175.199 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.0 -39.72 55.19 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.975 1.31 . . . . 0.0 112.49 -174.497 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 94.5 mtt-85 -74.89 -36.52 62.24 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.888 0.875 . . . . 0.0 112.704 175.268 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 48.3 m-85 -131.68 75.92 75.56 Favored Pre-proline 0 CA--C 1.546 0.816 0 C-N-CA 125.958 1.703 . . . . 0.0 110.834 -170.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -66.12 -14.92 46.55 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.083 2.522 . . . . 0.0 114.031 -175.303 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 13.2 p-80 -73.52 -24.39 60.14 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.198 0.999 . . . . 0.0 113.279 171.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.71 -53.71 5.99 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.861 1.265 . . . . 0.0 112.061 -162.591 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 65.7 ttt-85 . . . . . 0 C--O 1.253 1.28 0 C-N-CA 126.635 1.974 . . . . 0.0 112.737 -176.181 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 21.5 t . . . . . 0 N--CA 1.473 0.723 0 CA-C-O 120.363 0.125 . . . . 0.0 111.256 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 48.3 t -138.98 130.23 34.85 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 C-N-CA 125.469 1.507 . . . . 0.0 109.777 177.112 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 68.4 m -140.26 135.87 32.73 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.024 1.329 . . . . 0.0 111.427 178.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -154.04 155.32 35.28 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.135 1.374 . . . . 0.0 111.69 176.281 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -172.41 130.1 1.85 Allowed Glycine 0 CA--C 1.533 1.216 0 C-N-CA 124.345 0.974 . . . . 0.0 112.421 171.067 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -146.65 61.32 6.7 Favored Pre-proline 0 CA--C 1.553 1.092 0 C-N-CA 124.91 1.284 . . . . 0.0 111.757 178.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -67.75 150.18 78.94 Favored 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 123.371 2.714 . . . . 0.0 112.834 -177.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 75.1 p -153.23 153.78 29.91 Favored Pre-proline 0 N--CA 1.474 0.757 0 C-N-CA 125.324 1.449 . . . . 0.0 112.131 178.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.11 152.08 67.35 Favored 'Trans proline' 0 CA--C 1.54 0.82 0 C-N-CA 123.106 2.537 . . . . 0.0 112.178 175.047 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 60.5 tp -146.82 134.78 21.41 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.747 1.219 . . . . 0.0 111.529 -179.297 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.8 t -151.47 146.2 25.75 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.981 1.312 . . . . 0.0 110.996 169.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 78.9 p -141.92 9.13 1.92 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.144 1.378 . . . . 0.0 113.987 -176.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -112.43 120.46 41.73 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.799 1.24 . . . . 0.0 112.34 -172.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 40.4 m -124.23 3.85 8.52 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.942 1.297 . . . . 0.0 113.755 176.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 58.09 17.03 4.19 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 126.452 1.901 . . . . 0.0 115.539 -178.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -76.12 -24.14 54.93 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 114.036 1.125 . . . . 0.0 114.036 -174.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 . . . . . 0 N--CA 1.476 0.869 0 C-N-CA 125.702 1.601 . . . . 0.0 114.472 -179.218 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.51 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -88.48 154.89 19.99 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.757 1.223 . . . . 0.0 111.114 164.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 91.6 mt -132.59 157.55 44.45 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.952 1.301 . . . . 0.0 112.112 -175.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -81.24 138.61 35.76 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.468 0.707 . . . . 0.0 109.974 163.218 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -97.26 -20.57 17.8 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 -174.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -140.66 165.47 27.4 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.211 1.405 . . . . 0.0 112.428 -171.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.17 -163.27 54.89 Favored Glycine 0 CA--C 1.54 1.648 0 C-N-CA 124.246 0.927 . . . . 0.0 114.13 178.115 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -67.74 -17.14 47.42 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 123.267 2.645 . . . . 0.0 113.833 -175.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.2 mt -94.08 5.95 50.09 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 124.612 1.165 . . . . 0.0 113.935 175.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.42 122.37 11.05 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 120.875 1.67 . . . . 0.0 112.123 -177.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.25 5.66 88.68 Favored Glycine 0 CA--C 1.541 1.718 0 C-N-CA 125.568 1.556 . . . . 0.0 115.469 -175.104 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.461 ' HB3' ' HD2' ' A' ' 73' ' ' PRO . 20.3 mt -104.02 160.71 25.2 Favored Pre-proline 0 CA--C 1.557 1.228 0 C-N-CA 126.348 1.859 . . . . 0.0 111.295 -179.481 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.461 ' HD2' ' HB3' ' A' ' 72' ' ' LEU . 60.8 Cg_endo -71.36 164.95 34.01 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 124.318 3.346 . . . . 0.0 113.408 -169.165 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.9 t -107.53 -29.58 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 O-C-N 121.324 -0.86 . . . . 0.0 112.468 175.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 22.1 p -125.73 172.12 10.07 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 125.31 1.444 . . . . 0.0 114.056 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 34.6 ptt-85 -63.42 -35.6 80.97 Favored 'General case' 0 N--CA 1.48 1.071 0 O-C-N 121.284 -0.885 . . . . 0.0 111.92 173.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 37.2 m -65.39 -44.08 88.62 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.971 0.909 . . . . 0.0 110.95 172.491 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 76.3 m-20 -60.52 -46.42 90.19 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 118.522 0.601 . . . . 0.0 111.066 175.043 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.94 -42.3 98.95 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.61 0.764 . . . . 0.0 112.611 179.512 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 62.8 ttp85 -64.55 -42.84 95.43 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 118.962 0.801 . . . . 0.0 112.234 175.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 54.5 t -62.39 -47.87 91.01 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 123.752 0.821 . . . . 0.0 111.078 176.128 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.2 mp -58.95 -48.63 80.82 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 118.519 -0.753 . . . . 0.0 112.791 175.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 55.2 mt -55.49 -51.03 61.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 CA-C-N 118.775 0.716 . . . . 0.0 110.173 176.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -65.62 -49.19 69.62 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -177.399 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -66.72 -46.61 74.97 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 118.986 0.812 . . . . 0.0 112.299 -177.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -60.31 -49.71 76.51 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 118.458 -0.782 . . . . 0.0 110.25 175.044 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.424 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 64.3 t90 -56.44 -47.12 79.78 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-O 117.719 -1.134 . . . . 0.0 112.116 176.385 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -57.15 -48.26 79.13 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 120.792 1.633 . . . . 0.0 113.078 178.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -68.92 -48.52 63.08 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 119.902 1.228 . . . . 0.0 112.399 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 34.2 mmt180 -60.54 -39.62 88.57 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.673 0.789 . . . . 0.0 110.175 178.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -72.64 -30.13 64.04 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 125.057 1.343 . . . . 0.0 113.581 176.302 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.7 mmtp -62.29 -31.46 72.06 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 120.135 1.334 . . . . 0.0 111.412 165.412 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 60.2 m -80.0 -25.76 40.16 Favored 'General case' 0 N--CA 1.483 1.193 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 165.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -139.85 78.58 24.87 Favored Pre-proline 0 N--CA 1.478 0.961 0 C-N-CA 126.775 2.03 . . . . 0.0 111.667 -168.41 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -59.93 -11.78 16.43 Favored 'Trans proline' 0 CA--C 1.546 1.121 0 C-N-CA 123.539 2.826 . . . . 0.0 116.495 -166.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 40.6 p90 -85.08 -7.11 59.24 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 126.778 2.031 . . . . 0.0 115.21 176.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.4 tp -62.32 137.73 58.31 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 114.515 1.302 . . . . 0.0 114.515 -167.56 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 30.1 mmm180 -83.83 154.74 23.33 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 125.258 1.423 . . . . 0.0 113.113 179.107 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.424 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -137.62 130.35 29.98 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.826 2.05 . . . . 0.0 109.671 -175.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 59.2 t0 -143.74 129.61 19.43 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.011 0.924 . . . . 0.0 111.004 176.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 66.1 mtt -124.98 13.54 8.45 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.476 1.511 . . . . 0.0 112.952 -179.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 38.8 t -59.9 148.45 34.91 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.568 -0.707 . . . . 0.0 110.906 170.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -54.66 -35.25 63.33 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.21 -0.931 . . . . 0.0 112.437 -178.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -60.3 -36.19 77.33 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.369 1.067 . . . . 0.0 113.039 175.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.49 -41.06 98.55 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 118.95 0.795 . . . . 0.0 111.429 174.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.79 -46.91 59.16 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 C-N-CA 123.791 0.837 . . . . 0.0 109.758 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 16.9 m-30 -55.08 -46.42 75.44 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 118.89 0.768 . . . . 0.0 112.575 175.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.7 tmt_? -76.71 -38.47 54.27 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.508 1.123 . . . . 0.0 112.332 -172.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 19.9 ttm180 -75.9 -37.13 59.12 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.804 0.842 . . . . 0.0 112.646 175.328 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 34.9 m-85 -128.1 82.81 67.73 Favored Pre-proline 0 CA--C 1.547 0.864 0 C-N-CA 126.13 1.772 . . . . 0.0 110.648 -173.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -66.01 -19.68 57.63 Favored 'Trans proline' 0 CA--C 1.539 0.738 0 C-N-CA 122.971 2.447 . . . . 0.0 114.174 -172.051 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 8.1 p-80 -72.09 -20.6 61.62 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.917 0.887 . . . . 0.0 113.294 172.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -91.88 -0.91 57.52 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 127.015 2.126 . . . . 0.0 113.578 -178.531 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.231 0 C-N-CA 124.769 1.228 . . . . 0.0 111.211 170.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 64.1 m . . . . . 0 N--CA 1.477 0.882 0 CA-C-O 120.722 0.296 . . . . 0.0 111.784 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 27.0 m -126.7 155.38 37.28 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 125.221 1.408 . . . . 0.0 112.547 -178.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 79.8 p -145.02 155.7 43.51 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.689 1.595 . . . . 0.0 111.988 177.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 51.1 p90 -153.54 165.58 35.42 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.057 1.343 . . . . 0.0 112.535 -175.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 81.94 162.53 30.41 Favored Glycine 0 CA--C 1.538 1.507 0 C-N-CA 124.992 1.282 . . . . 0.0 114.742 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -152.34 154.15 31.71 Favored Pre-proline 0 CA--C 1.55 0.97 0 C-N-CA 125.852 1.661 . . . . 0.0 111.723 -179.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -69.44 160.35 50.13 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 123.353 2.702 . . . . 0.0 112.447 174.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 37.2 p -132.62 56.43 22.62 Favored Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 125.158 1.383 . . . . 0.0 113.98 -173.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -68.03 156.09 67.14 Favored 'Trans proline' 0 CA--C 1.542 0.925 0 C-N-CA 123.368 2.712 . . . . 0.0 112.891 178.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.5 pp -146.12 157.53 43.85 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.548 1.539 . . . . 0.0 111.784 173.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 83.5 p -140.0 -11.3 1.13 Allowed 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 115.876 1.806 . . . . 0.0 115.876 -173.112 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.2 t -152.92 154.1 34.36 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.409 1.084 . . . . 0.0 112.616 -178.187 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -129.95 9.42 5.34 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 127.233 2.213 . . . . 0.0 113.257 179.443 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 6.9 t -142.77 -178.53 5.84 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.272 1.429 . . . . 0.0 113.067 -172.136 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 56.23 50.02 14.22 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 126.315 1.846 . . . . 0.0 113.3 -179.349 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 25.8 m-20 -76.69 56.34 1.14 Allowed 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.536 1.535 . . . . 0.0 111.702 174.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 . . . . . 0 N--CA 1.478 0.925 0 C-N-CA 126.57 1.948 . . . . 0.0 114.16 -176.24 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.6 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -85.32 159.13 20.1 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.774 1.23 . . . . 0.0 111.294 167.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 95.1 mt -133.94 157.02 47.07 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.871 1.269 . . . . 0.0 112.529 -174.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 -82.09 140.31 33.92 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 123.908 0.883 . . . . 0.0 109.944 163.205 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -98.19 -20.3 17.36 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 -174.423 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -140.45 165.13 28.28 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.124 1.369 . . . . 0.0 112.492 -171.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 72.92 -162.93 54.9 Favored Glycine 0 CA--C 1.541 1.674 0 C-N-CA 124.2 0.905 . . . . 0.0 114.074 178.4 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -67.54 -17.0 48.36 Favored 'Trans proline' 0 CA--C 1.541 0.865 0 C-N-CA 123.325 2.683 . . . . 0.0 113.763 -176.243 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.0 mt -93.85 5.66 50.93 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.701 1.2 . . . . 0.0 113.915 175.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.86 121.53 9.46 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 120.823 1.647 . . . . 0.0 111.909 -178.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.37 8.09 85.61 Favored Glycine 0 CA--C 1.54 1.631 0 C-N-CA 125.358 1.456 . . . . 0.0 115.5 -174.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.43 ' HB3' ' HD2' ' A' ' 73' ' ' PRO . 18.3 mt -107.84 159.51 30.19 Favored Pre-proline 0 CA--C 1.558 1.258 0 C-N-CA 126.42 1.888 . . . . 0.0 111.469 -179.176 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.43 ' HD2' ' HB3' ' A' ' 72' ' ' LEU . 58.3 Cg_endo -71.75 166.27 30.0 Favored 'Trans proline' 0 C--N 1.354 0.853 0 C-N-CA 124.655 3.57 . . . . 0.0 113.968 -169.322 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 5.7 t -111.58 -26.35 3.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 123.856 0.862 . . . . 0.0 112.486 177.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 29.8 p -127.87 172.6 10.72 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 125.296 1.439 . . . . 0.0 114.236 179.478 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -68.51 -36.93 79.57 Favored 'General case' 0 N--CA 1.482 1.157 0 O-C-N 121.167 -0.958 . . . . 0.0 111.358 176.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 10.2 p -63.56 -42.6 98.34 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 118.492 -0.765 . . . . 0.0 111.761 169.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 84.5 m-20 -58.37 -50.98 71.73 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 119.582 1.083 . . . . 0.0 110.809 173.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.01 -41.19 97.8 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.565 0.746 . . . . 0.0 112.531 -178.229 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 33.6 ttt85 -65.58 -43.58 89.3 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.08 0.952 . . . . 0.0 112.063 177.513 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 70.4 t -64.47 -45.79 94.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 C-N-CA 123.756 0.822 . . . . 0.0 111.227 175.538 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 54.6 mt -61.28 -43.92 98.09 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 118.309 -0.853 . . . . 0.0 112.406 176.414 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 47.7 mt -55.5 -51.57 56.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 CA-C-N 119.143 0.883 . . . . 0.0 109.949 173.28 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -63.3 -46.97 84.25 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -178.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 55.4 m-20 -68.91 -45.9 69.67 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.84 0.856 . . . . 0.0 112.189 -177.131 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -63.62 -46.45 85.66 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 119.131 -0.461 . . . . 0.0 110.793 177.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.434 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 66.8 t90 -60.03 -46.04 90.83 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-O 117.657 -1.163 . . . . 0.0 111.658 172.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -56.19 -45.72 79.68 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 120.873 1.67 . . . . 0.0 112.877 179.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -67.75 -52.06 41.89 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 119.644 1.111 . . . . 0.0 112.401 177.103 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 13.1 mmm180 -56.84 -48.41 78.12 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 121.759 -0.588 . . . . 0.0 110.626 178.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.9 tmtt? -67.21 -30.14 69.99 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.593 1.557 . . . . 0.0 113.562 178.435 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -60.77 -36.52 79.15 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 120.293 1.406 . . . . 0.0 111.096 166.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 64.9 m -79.95 -20.69 45.03 Favored 'General case' 0 N--CA 1.482 1.166 0 N-CA-C 115.343 1.609 . . . . 0.0 115.343 167.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -141.5 73.34 24.82 Favored Pre-proline 0 CA--C 1.548 0.894 0 C-N-CA 127.084 2.153 . . . . 0.0 111.469 -166.078 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -61.31 -7.98 9.52 Favored 'Trans proline' 0 CA--C 1.546 1.084 0 C-N-CA 123.744 2.963 . . . . 0.0 116.325 -166.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 41.2 p90 -84.64 -10.17 57.58 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.586 1.954 . . . . 0.0 114.88 174.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 16.5 tp -65.48 135.47 55.21 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 119.862 1.21 . . . . 0.0 113.952 -167.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -83.57 156.08 22.95 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.761 1.225 . . . . 0.0 113.021 178.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.434 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -137.23 130.98 31.75 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 127.027 2.131 . . . . 0.0 109.228 -174.23 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -137.81 129.66 28.57 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.233 1.013 . . . . 0.0 110.829 178.062 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 63.8 mtt -126.72 16.21 7.5 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.469 1.508 . . . . 0.0 113.53 -178.077 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 47.6 t -63.3 148.97 46.81 Favored 'General case' 0 N--CA 1.47 0.575 0 O-C-N 121.573 -0.704 . . . . 0.0 110.615 165.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -56.51 -32.02 64.67 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 121.118 -0.989 . . . . 0.0 112.329 178.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 60.3 mtpt -59.78 -33.43 71.69 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.31 1.044 . . . . 0.0 112.997 174.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.27 -40.81 97.46 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 119.161 0.891 . . . . 0.0 111.486 173.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.87 -46.99 58.21 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 C-N-CA 123.814 0.846 . . . . 0.0 109.405 179.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.7 m-30 -56.24 -45.54 79.94 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 118.759 0.708 . . . . 0.0 112.568 176.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.09 -38.55 52.13 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 124.409 1.084 . . . . 0.0 112.121 -173.589 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 62.1 ttm-85 -75.61 -35.57 60.49 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.934 0.893 . . . . 0.0 112.494 175.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 46.7 m-85 -128.53 82.93 67.61 Favored Pre-proline 0 CA--C 1.546 0.795 0 C-N-CA 126.088 1.755 . . . . 0.0 110.724 -174.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -66.03 -18.54 57.06 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 123.088 2.526 . . . . 0.0 114.092 -172.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . 0.452 ' CE1' HD23 ' A' ' 113' ' ' LEU . 7.8 p-80 -73.83 -21.63 60.06 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.022 0.929 . . . . 0.0 113.333 173.009 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.452 HD23 ' CE1' ' A' ' 112' ' ' HIS . 0.1 OUTLIER -90.17 -8.36 51.38 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 126.113 1.765 . . . . 0.0 113.86 -173.163 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? . . . . . 0 C--O 1.254 1.311 0 C-N-CA 125.109 1.363 . . . . 0.0 110.977 175.418 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 12.3 t . . . . . 0 N--CA 1.474 0.752 0 CA-C-O 120.492 0.186 . . . . 0.0 111.458 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.1 p -149.11 146.67 17.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 125.308 1.443 . . . . 0.0 111.503 178.1 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.1 m -132.08 132.74 43.6 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.17 1.388 . . . . 0.0 111.013 177.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 54.6 p90 -154.93 162.86 40.96 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.084 1.354 . . . . 0.0 112.445 -177.141 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 173.6 147.66 6.06 Favored Glycine 0 CA--C 1.536 1.383 0 C-N-CA 124.693 1.14 . . . . 0.0 113.171 174.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -147.29 60.58 5.71 Favored Pre-proline 0 CA--C 1.554 1.122 0 C-N-CA 124.712 1.205 . . . . 0.0 112.534 -179.459 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -67.82 152.22 77.66 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 123.356 2.704 . . . . 0.0 112.586 179.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 9.3 t -147.3 73.52 11.88 Favored Pre-proline 0 N--CA 1.475 0.802 0 C-N-CA 124.548 1.139 . . . . 0.0 111.379 177.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -73.17 155.3 52.06 Favored 'Trans proline' 0 CA--C 1.542 0.896 0 C-N-CA 123.621 2.881 . . . . 0.0 112.824 -179.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -150.27 154.73 38.4 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.496 1.518 . . . . 0.0 112.307 174.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 32.9 m -127.24 -4.3 6.17 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 115.088 1.514 . . . . 0.0 115.088 -173.158 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 49.5 m -142.24 150.94 41.58 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.859 1.264 . . . . 0.0 112.606 -172.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -151.41 137.8 18.55 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.11 1.364 . . . . 0.0 111.467 177.333 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 75.6 p -111.25 -7.17 14.45 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 125.415 1.486 . . . . 0.0 114.801 -178.224 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -67.71 -12.3 60.21 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 -173.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -68.68 -21.81 64.41 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.683 1.193 . . . . 0.0 113.543 172.722 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 . . . . . 0 N--CA 1.476 0.853 0 C-N-CA 125.511 1.524 . . . . 0.0 113.605 177.253 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.546 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -85.04 156.89 20.91 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.539 1.136 . . . . 0.0 111.443 168.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 98.2 mt -131.97 156.27 46.49 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.028 1.331 . . . . 0.0 112.381 -175.259 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 84.9 m-70 -83.04 142.82 31.04 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.057 0.943 . . . . 0.0 109.755 163.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -103.14 -18.17 15.05 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 114.695 1.368 . . . . 0.0 114.695 -172.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -139.8 163.05 33.65 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.114 1.365 . . . . 0.0 112.459 -172.369 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.05 -160.91 54.12 Favored Glycine 0 CA--C 1.539 1.572 0 C-N-CA 124.137 0.875 . . . . 0.0 114.001 178.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -67.63 -16.4 46.7 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 123.339 2.693 . . . . 0.0 113.763 -176.536 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 98.6 mt -92.95 4.87 53.2 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.647 1.179 . . . . 0.0 113.807 174.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.84 114.0 2.33 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 121.233 1.833 . . . . 0.0 111.91 -179.081 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.68 5.86 68.41 Favored Glycine 0 CA--C 1.543 1.785 0 C-N-CA 125.322 1.439 . . . . 0.0 115.57 -173.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 6.0 mp -104.97 156.24 36.35 Favored Pre-proline 0 CA--C 1.556 1.191 0 C-N-CA 126.807 2.043 . . . . 0.0 111.63 178.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -67.87 163.29 36.09 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 124.912 3.741 . . . . 0.0 113.987 -170.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.8 t -105.42 -30.18 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 O-C-N 121.373 -0.829 . . . . 0.0 112.319 175.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 17.8 p -125.87 170.05 12.03 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 125.235 1.414 . . . . 0.0 114.266 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 37.5 ttt180 -62.07 -39.13 91.36 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.593 1.157 . . . . 0.0 111.084 174.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 18.5 t -62.62 -46.71 87.01 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.843 0.857 . . . . 0.0 111.101 171.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 78.5 m-20 -57.99 -48.94 78.51 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 118.852 0.751 . . . . 0.0 111.069 176.284 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.58 -42.87 97.56 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -179.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 70.2 ttp85 -67.07 -41.99 85.46 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 121.199 -0.938 . . . . 0.0 112.597 176.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 78.5 t -63.84 -43.4 97.84 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.034 0 C-N-CA 123.603 0.761 . . . . 0.0 111.14 175.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 55.1 mt -60.49 -47.19 87.21 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 118.169 -0.92 . . . . 0.0 112.102 175.062 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 60.6 mt -53.4 -50.28 49.2 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 CA-C-N 119.064 0.847 . . . . 0.0 110.111 173.619 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.414 ' HB2' ' HE1' ' A' ' 101' ' ' MET . 12.3 t80 -62.89 -51.16 68.06 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 112.916 0.709 . . . . 0.0 112.916 -178.135 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -70.87 -41.44 71.37 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -174.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 57.4 mm-40 -58.7 -53.52 57.41 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 118.574 -0.727 . . . . 0.0 110.057 169.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.42 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 61.4 t90 -55.9 -44.58 78.35 Favored 'General case' 0 C--O 1.218 -0.577 0 CA-C-O 117.444 -1.265 . . . . 0.0 112.081 178.124 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -56.33 -51.05 69.66 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 120.755 1.616 . . . . 0.0 112.856 176.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -68.13 -45.29 74.02 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 119.879 1.218 . . . . 0.0 112.618 179.469 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 31.4 mmt180 -59.79 -44.48 93.92 Favored 'General case' 0 C--O 1.218 -0.583 0 C-N-CA 123.773 0.829 . . . . 0.0 109.952 177.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -63.69 -36.55 84.21 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 126.055 1.742 . . . . 0.0 112.819 175.329 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -62.3 -30.82 71.41 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 119.381 0.992 . . . . 0.0 111.845 170.012 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 68.4 m -82.91 -20.97 34.38 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 115.44 1.644 . . . . 0.0 115.44 166.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -140.53 79.0 20.86 Favored Pre-proline 0 CA--C 1.547 0.86 0 C-N-CA 127.077 2.151 . . . . 0.0 111.419 -167.346 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -63.81 6.03 0.31 Allowed 'Trans proline' 0 CA--C 1.55 1.311 0 C-N-CA 124.252 3.301 . . . . 0.0 116.878 -169.184 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 40.5 p90 -103.55 -6.76 21.4 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 127.402 2.281 . . . . 0.0 114.668 175.425 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 13.7 tp -64.82 135.5 55.85 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 -165.381 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 85.0 mtp180 -86.21 156.57 20.25 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.593 1.557 . . . . 0.0 113.063 178.597 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.42 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -138.38 131.49 30.02 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.726 2.01 . . . . 0.0 110.043 -173.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 33.3 t0 -146.6 135.96 22.83 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.066 0.946 . . . . 0.0 111.432 177.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.414 ' HE1' ' HB2' ' A' ' 84' ' ' PHE . 66.3 mtt -133.3 3.41 3.64 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 114.467 1.284 . . . . 0.0 114.467 -173.503 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 72.5 m -60.6 145.05 50.33 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 119.166 0.894 . . . . 0.0 110.96 173.082 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.416 ' HA ' HG12 ' A' ' 106' ' ' ILE . 17.2 m-20 -61.82 -25.39 67.47 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 114.813 1.412 . . . . 0.0 114.813 -163.137 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -56.11 -38.38 70.69 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.091 0.956 . . . . 0.0 112.719 171.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.77 -35.75 75.28 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 123.8 0.84 . . . . 0.0 112.05 172.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.416 HG12 ' HA ' ' A' ' 103' ' ' ASP . 4.8 mm -78.35 -43.61 26.88 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 C-N-CA 123.85 0.86 . . . . 0.0 109.544 -175.052 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -59.5 -43.53 93.33 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.255 0.622 . . . . 0.0 111.932 173.463 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.72 -39.27 57.63 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.52 1.128 . . . . 0.0 112.774 -174.52 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 88.2 mtt-85 -69.63 -40.3 76.62 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.749 0.82 . . . . 0.0 112.478 172.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -127.67 77.89 75.57 Favored Pre-proline 0 CA--C 1.544 0.748 0 C-N-CA 125.094 1.358 . . . . 0.0 111.142 -168.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -68.02 -10.1 27.82 Favored 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 123.389 2.726 . . . . 0.0 114.097 -175.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 14.2 p-80 -78.9 -21.9 46.7 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.144 0.977 . . . . 0.0 113.469 169.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -89.7 -32.52 16.99 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.774 1.63 . . . . 0.0 112.462 -168.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 . . . . . 0 C--O 1.254 1.335 0 C-N-CA 124.723 1.209 . . . . 0.0 113.715 174.811 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.7 t . . . . . 0 N--CA 1.474 0.726 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.9 m -131.47 11.47 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 C-N-CA 125.809 1.644 . . . . 0.0 112.99 178.252 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 40.0 m -82.37 54.24 2.52 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 125.678 1.591 . . . . 0.0 113.276 -169.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 82.4 m-85 -133.72 166.13 23.33 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.907 1.683 . . . . 0.0 112.99 -172.114 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 104.87 107.38 3.21 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 125.732 1.635 . . . . 0.0 112.77 178.409 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -153.39 153.06 28.75 Favored Pre-proline 0 CA--C 1.552 1.037 0 C-N-CA 126.157 1.783 . . . . 0.0 111.049 177.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -71.17 140.94 38.48 Favored 'Trans proline' 0 CA--C 1.543 0.957 0 C-N-CA 123.148 2.565 . . . . 0.0 112.373 177.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 71.2 m -138.82 63.57 32.31 Favored Pre-proline 0 N--CA 1.477 0.888 0 C-N-CA 125.193 1.397 . . . . 0.0 111.847 -179.388 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -67.78 131.7 24.88 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 C-N-CA 123.337 2.691 . . . . 0.0 112.387 -177.071 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 62.3 tp -155.76 134.2 11.67 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.309 1.443 . . . . 0.0 111.051 178.265 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 31.6 t -154.83 131.35 10.54 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.648 1.179 . . . . 0.0 111.22 170.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.3 t -158.99 82.52 0.79 Allowed 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.849 1.259 . . . . 0.0 110.416 175.166 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -140.62 -11.81 1.02 Allowed 'General case' 0 N--CA 1.479 1.016 0 N-CA-C 115.797 1.777 . . . . 0.0 115.797 -174.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 21.3 t -65.39 111.98 3.31 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 119.516 1.053 . . . . 0.0 111.407 -171.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 53.63 20.46 2.17 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 125.867 1.667 . . . . 0.0 114.583 -173.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -75.3 -27.45 59.34 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 -169.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 . . . . . 0 CA--C 1.548 0.878 0 C-N-CA 125.893 1.677 . . . . 0.0 113.898 179.998 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.634 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -96.7 149.07 22.22 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.064 1.346 . . . . 0.0 112.401 174.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 89.5 mt -128.29 157.39 41.07 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.694 1.597 . . . . 0.0 111.741 -179.293 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -77.46 140.02 39.75 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.898 0.879 . . . . 0.0 110.479 167.195 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -99.1 -12.39 20.55 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 -174.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -149.49 168.16 24.24 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.786 1.235 . . . . 0.0 113.211 -172.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.78 -164.47 54.14 Favored Glycine 0 CA--C 1.54 1.615 0 C-N-CA 124.151 0.882 . . . . 0.0 114.094 179.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -67.72 -16.82 47.14 Favored 'Trans proline' 0 CA--C 1.542 0.925 0 C-N-CA 123.254 2.636 . . . . 0.0 113.674 -177.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.1 mt -92.49 4.42 53.55 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.784 1.234 . . . . 0.0 113.877 175.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.01 122.9 11.93 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 120.922 1.692 . . . . 0.0 112.088 -177.342 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.23 4.45 89.65 Favored Glycine 0 CA--C 1.54 1.612 0 C-N-CA 125.418 1.485 . . . . 0.0 115.384 -174.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 21.5 mt -103.85 160.05 27.33 Favored Pre-proline 0 CA--C 1.555 1.141 0 C-N-CA 126.204 1.802 . . . . 0.0 111.174 179.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -80.23 156.69 22.8 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 124.12 3.213 . . . . 0.0 113.664 -163.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 24.1 t -95.52 -36.32 6.59 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -177.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 22.2 p -123.52 174.24 7.52 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 124.965 1.306 . . . . 0.0 114.413 -178.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -64.12 -39.52 94.22 Favored 'General case' 0 N--CA 1.483 1.184 0 O-C-N 121.176 -0.953 . . . . 0.0 110.83 176.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 35.1 m -61.42 -45.1 95.74 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.196 0.998 . . . . 0.0 111.283 171.306 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -61.35 -46.92 88.22 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 118.842 0.746 . . . . 0.0 111.16 175.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.16 -38.69 89.99 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.467 -0.77 . . . . 0.0 112.313 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 69.4 ttt180 -67.3 -41.56 85.18 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 119.202 0.91 . . . . 0.0 112.622 173.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 59.7 t -61.12 -49.98 82.43 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 CA-C-N 118.713 0.688 . . . . 0.0 110.972 173.689 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -62.61 -40.75 97.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 118.319 -0.848 . . . . 0.0 112.464 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 48.8 mt -56.36 -50.72 70.6 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 CA-C-N 119.17 0.895 . . . . 0.0 110.31 170.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -64.29 -45.44 87.98 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -178.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 55.4 t30 -68.39 -46.58 69.63 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.918 0.887 . . . . 0.0 111.948 -177.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 55.6 mm-40 -60.19 -51.75 68.26 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 118.488 -0.767 . . . . 0.0 110.55 172.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.44 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 60.4 t90 -56.26 -47.17 79.06 Favored 'General case' 0 C--O 1.222 -0.358 0 CA-C-N 119.526 1.057 . . . . 0.0 111.929 177.673 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -58.39 -45.5 88.22 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 120.46 1.482 . . . . 0.0 113.027 178.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -69.46 -49.72 52.26 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-N 120.001 1.273 . . . . 0.0 112.747 178.126 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 32.6 mmt180 -59.0 -41.05 86.76 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.93 0.892 . . . . 0.0 109.839 178.066 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 21.5 ttpt -69.7 -31.86 70.13 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.088 1.355 . . . . 0.0 113.447 174.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -59.52 -33.22 71.1 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 120.022 1.283 . . . . 0.0 110.777 167.672 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 53.1 m -81.02 -24.32 37.99 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 115.453 1.649 . . . . 0.0 115.453 165.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -140.02 78.89 23.47 Favored Pre-proline 0 CA--C 1.552 1.024 0 C-N-CA 127.004 2.122 . . . . 0.0 112.251 -168.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -61.66 -5.81 6.34 Favored 'Trans proline' 0 CA--C 1.549 1.231 0 C-N-CA 123.859 3.039 . . . . 0.0 116.653 -168.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 41.4 p90 -90.89 -6.37 54.26 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.795 2.038 . . . . 0.0 114.887 175.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.3 tp -62.77 135.5 57.38 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 119.702 1.137 . . . . 0.0 113.776 -168.089 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 54.3 mmt-85 -86.06 157.36 20.08 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.61 1.164 . . . . 0.0 112.761 179.199 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.44 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -136.72 131.82 34.01 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 126.714 2.005 . . . . 0.0 110.04 -172.612 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 54.9 t0 -142.89 131.09 21.98 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.186 0.994 . . . . 0.0 111.12 176.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 64.7 mtt -127.71 6.75 6.18 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.359 1.464 . . . . 0.0 113.56 -177.277 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 71.3 m -63.21 147.48 50.81 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 118.884 0.766 . . . . 0.0 110.39 169.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -61.27 -28.33 69.11 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -163.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -57.11 -34.34 68.26 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.459 1.104 . . . . 0.0 113.41 172.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.7 -40.21 96.42 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 119.075 0.852 . . . . 0.0 111.704 173.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.63 -45.71 65.85 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 C-N-CA 124.406 1.083 . . . . 0.0 109.212 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 8.4 m-30 -56.92 -46.43 82.0 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 118.716 0.689 . . . . 0.0 112.279 175.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.72 -38.49 62.3 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.68 1.192 . . . . 0.0 112.57 -173.03 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 75.1 mtp85 -72.37 -38.85 68.42 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 172.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 27.3 m-85 -130.23 83.37 63.19 Favored Pre-proline 0 CA--C 1.548 0.866 0 C-N-CA 125.256 1.423 . . . . 0.0 110.902 -168.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -66.99 -16.79 50.5 Favored 'Trans proline' 0 CA--C 1.541 0.832 0 C-N-CA 123.04 2.493 . . . . 0.0 114.252 -171.478 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 12.4 p-80 -74.86 -23.45 58.42 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.153 0.981 . . . . 0.0 113.257 173.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -82.65 -24.36 33.81 Favored 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 125.719 1.608 . . . . 0.0 112.723 -171.708 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 8.3 tmm_? . . . . . 0 C--O 1.254 1.292 0 C-N-CA 125.162 1.385 . . . . 0.0 111.918 178.445 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 21.7 m . . . . . 0 N--CA 1.476 0.852 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.5 p -150.65 152.76 11.14 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 125.197 1.399 . . . . 0.0 111.359 -179.578 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 33.2 t -140.37 149.62 42.9 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.955 1.302 . . . . 0.0 112.039 176.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 22.4 t80 -134.98 28.94 3.47 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.887 1.675 . . . . 0.0 111.319 175.431 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 74.79 -156.98 50.04 Favored Glycine 0 CA--C 1.536 1.403 0 C-N-CA 124.282 0.944 . . . . 0.0 112.78 -168.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -130.77 63.15 69.02 Favored Pre-proline 0 CA--C 1.554 1.121 0 C-N-CA 124.837 1.255 . . . . 0.0 112.517 -178.539 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_endo -67.52 151.87 79.23 Favored 'Trans proline' 0 CA--C 1.542 0.919 0 C-N-CA 123.318 2.679 . . . . 0.0 112.523 177.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 78.6 p -152.11 155.97 33.66 Favored Pre-proline 0 N--CA 1.476 0.854 0 C-N-CA 125.358 1.463 . . . . 0.0 112.007 179.136 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -74.63 133.66 17.47 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 123.017 2.478 . . . . 0.0 112.009 177.295 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.3 mp -122.06 151.97 40.31 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.869 1.668 . . . . 0.0 111.018 175.298 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 78.1 p -147.62 149.02 31.74 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.24 1.416 . . . . 0.0 111.764 172.129 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.5 m -135.77 9.35 3.34 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 -170.039 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -146.78 140.18 25.64 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.788 1.235 . . . . 0.0 111.937 -175.495 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 15.4 t -154.09 152.31 30.3 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.339 1.456 . . . . 0.0 111.196 174.223 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 52.91 40.93 31.77 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 125.493 1.517 . . . . 0.0 113.953 177.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -74.23 82.69 1.84 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.505 1.122 . . . . 0.0 111.549 179.511 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 . . . . . 0 CA--C 1.551 1.013 0 C-N-CA 125.861 1.664 . . . . 0.0 113.701 -171.408 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.604 0 N-CA-C 112.425 0.528 . . . . 0.0 112.425 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -87.62 158.79 18.78 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.756 1.223 . . . . 0.0 111.562 167.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 95.8 mt -135.83 157.03 47.86 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 125.34 1.456 . . . . 0.0 111.812 -177.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -82.2 139.97 33.99 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.535 0.734 . . . . 0.0 109.463 162.487 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -101.28 -19.07 15.82 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -173.359 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -140.1 164.12 30.9 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 125.323 1.449 . . . . 0.0 112.145 -173.129 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 72.37 -161.37 54.33 Favored Glycine 0 CA--C 1.542 1.727 0 C-N-CA 124.105 0.86 . . . . 0.0 113.992 179.269 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -67.9 -16.8 46.23 Favored 'Trans proline' 0 CA--C 1.541 0.872 0 C-N-CA 123.325 2.684 . . . . 0.0 113.895 -174.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 89.5 mt -95.24 6.78 48.09 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.81 1.244 . . . . 0.0 113.829 175.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.2 113.52 1.97 Allowed 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 121.067 1.758 . . . . 0.0 112.018 -178.638 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.63 7.68 64.62 Favored Glycine 0 CA--C 1.542 1.779 0 C-N-CA 125.418 1.485 . . . . 0.0 115.672 -173.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 5.7 mp -108.61 155.73 40.02 Favored Pre-proline 0 CA--C 1.556 1.211 0 C-N-CA 126.666 1.986 . . . . 0.0 111.877 179.491 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -64.82 163.35 28.32 Favored 'Trans proline' 0 C--N 1.354 0.817 0 C-N-CA 125.207 3.938 . . . . 0.0 114.235 -172.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 9.1 t -106.96 -30.29 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 123.719 0.808 . . . . 0.0 112.041 174.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 24.2 p -126.88 169.52 13.18 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 125.161 1.385 . . . . 0.0 114.004 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 41.0 ptt180 -61.97 -36.07 80.35 Favored 'General case' 0 N--CA 1.482 1.138 0 O-C-N 121.306 -0.871 . . . . 0.0 111.789 173.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 22.3 m -63.86 -43.3 96.53 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.361 1.065 . . . . 0.0 110.845 172.754 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -60.81 -49.75 76.23 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 118.688 0.676 . . . . 0.0 111.2 174.494 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.41 -42.97 93.03 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-N 118.721 0.691 . . . . 0.0 112.308 -179.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.94 -49.04 76.34 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.261 1.024 . . . . 0.0 111.895 175.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 51.7 t -60.2 -47.59 91.51 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 123.638 0.775 . . . . 0.0 111.234 177.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 88.0 mt -61.6 -42.87 99.48 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 118.277 -0.868 . . . . 0.0 111.968 179.222 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 55.7 mt -56.79 -52.7 51.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 CA-C-N 119.147 0.885 . . . . 0.0 110.156 172.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -64.44 -45.97 85.15 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 -176.361 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 46.2 m-20 -67.2 -49.11 65.82 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.337 1.055 . . . . 0.0 111.811 -178.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -65.33 -43.22 91.63 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 118.927 -0.558 . . . . 0.0 110.972 179.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.42 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 58.2 t90 -57.48 -47.66 81.28 Favored 'General case' 0 C--O 1.217 -0.612 0 CA-C-O 117.217 -1.373 . . . . 0.0 111.315 170.693 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -61.13 -40.79 95.12 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 121.124 1.784 . . . . 0.0 113.519 -178.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -65.92 -51.58 57.37 Favored 'General case' 0 N--CA 1.478 0.965 0 CA-C-N 120.212 1.369 . . . . 0.0 111.896 175.253 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -55.28 -48.25 74.33 Favored 'General case' 0 C--O 1.215 -0.715 0 C-N-CA 122.921 0.488 . . . . 0.0 110.491 176.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.24 -33.19 75.19 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 126.772 2.029 . . . . 0.0 113.648 179.125 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 44.6 mttp -61.37 -31.46 71.35 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 120.163 1.347 . . . . 0.0 111.579 166.401 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 5.6 t -81.76 -24.86 35.78 Favored 'General case' 0 N--CA 1.484 1.262 0 N-CA-C 115.04 1.496 . . . . 0.0 115.04 165.281 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -137.8 72.69 48.23 Favored Pre-proline 0 CA--C 1.552 1.031 0 C-N-CA 127.708 2.403 . . . . 0.0 111.754 -165.42 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -61.52 -9.05 12.21 Favored 'Trans proline' 0 CA--C 1.547 1.13 0 C-N-CA 123.667 2.911 . . . . 0.0 116.296 -166.553 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 41.3 p90 -82.89 -15.15 52.58 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 126.267 1.827 . . . . 0.0 114.812 174.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 20.6 tp -60.54 134.82 57.45 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 114.514 1.301 . . . . 0.0 114.514 -162.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 6.7 mmp_? -74.92 155.0 37.91 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.753 1.221 . . . . 0.0 112.619 177.222 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.42 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -136.16 126.84 27.19 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 126.374 1.87 . . . . 0.0 109.989 -177.244 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 55.1 t0 -147.47 122.99 10.42 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.726 0.81 . . . . 0.0 110.738 171.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 3.4 ptt? -137.79 31.83 2.49 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.955 1.702 . . . . 0.0 111.707 173.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 27.1 t -62.12 152.62 32.41 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 121.582 -0.699 . . . . 0.0 110.143 161.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -53.82 -37.32 63.45 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 121.027 -1.046 . . . . 0.0 113.525 -169.831 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -61.32 -33.4 73.53 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.007 0.923 . . . . 0.0 112.729 176.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.4 -39.01 93.03 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 123.505 0.722 . . . . 0.0 111.777 173.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.98 -45.36 64.2 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 123.482 0.713 . . . . 0.0 109.301 179.246 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 10.8 m-30 -55.09 -46.46 75.49 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.032 0.533 . . . . 0.0 112.17 175.025 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.55 -31.02 41.96 Favored 'General case' 0 C--N 1.343 0.306 0 C-N-CA 124.712 1.205 . . . . 0.0 113.771 -172.683 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 86.0 mtt180 -82.78 -32.54 27.71 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.818 0.847 . . . . 0.0 112.854 173.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -126.86 73.93 75.95 Favored Pre-proline 0 CA--C 1.543 0.702 0 C-N-CA 125.723 1.609 . . . . 0.0 110.874 -173.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -66.71 -12.7 36.99 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 123.2 2.6 . . . . 0.0 113.874 -176.413 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 15.0 p-80 -73.65 -23.87 59.91 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.041 0.936 . . . . 0.0 113.258 170.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -85.79 -34.06 21.22 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.814 1.646 . . . . 0.0 112.102 -168.395 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 2.9 tmm_? . . . . . 0 C--O 1.256 1.397 0 C-N-CA 125.71 1.604 . . . . 0.0 111.117 176.681 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.3 t . . . . . 0 N--CA 1.474 0.756 0 CA-C-O 120.242 0.068 . . . . 0.0 110.881 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.6 p -151.85 141.16 15.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 124.651 1.18 . . . . 0.0 111.877 176.611 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 68.5 m -141.99 140.5 32.7 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.779 1.632 . . . . 0.0 110.82 175.777 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 55.4 p90 -153.47 163.52 39.8 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.67 1.188 . . . . 0.0 112.758 -179.494 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 85.5 134.3 3.27 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 125.502 1.525 . . . . 0.0 114.156 178.041 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -150.85 65.98 7.16 Favored Pre-proline 0 CA--C 1.554 1.1 0 C-N-CA 125.443 1.497 . . . . 0.0 111.208 178.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -68.23 143.97 60.87 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 123.508 2.805 . . . . 0.0 113.062 -174.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 59.3 p -148.98 47.68 0.52 Allowed Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 125.088 1.355 . . . . 0.0 113.83 178.555 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -64.24 139.92 68.41 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 123.118 2.545 . . . . 0.0 112.838 -176.562 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.8 tt -152.15 118.85 5.72 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.171 1.388 . . . . 0.0 110.01 179.432 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 23.2 t -152.02 146.4 25.54 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.477 1.111 . . . . 0.0 111.776 170.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 79.2 p -145.16 12.64 1.4 Allowed 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.476 1.51 . . . . 0.0 113.797 -178.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -111.86 157.77 20.23 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.028 1.331 . . . . 0.0 113.355 -170.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 8.6 t -146.75 165.82 28.49 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.576 1.55 . . . . 0.0 111.436 176.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 61.15 -8.01 0.08 Allowed 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 127.732 2.413 . . . . 0.0 116.998 -179.64 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -68.07 -13.88 62.54 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.066 1.346 . . . . 0.0 114.249 -177.689 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 . . . . . 0 CA--C 1.549 0.941 0 C-N-CA 125.811 1.644 . . . . 0.0 113.107 173.971 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.578 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -87.43 158.55 18.96 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.156 1.382 . . . . 0.0 111.227 167.204 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 96.6 mt -133.7 156.81 47.27 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.927 1.291 . . . . 0.0 112.379 -175.27 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 -79.41 137.48 37.28 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.438 0.695 . . . . 0.0 110.125 163.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -95.66 -15.11 22.93 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 -174.46 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -150.04 169.3 21.55 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.888 1.275 . . . . 0.0 112.944 -173.01 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.16 -164.5 54.91 Favored Glycine 0 CA--C 1.54 1.641 0 C-N-CA 124.107 0.861 . . . . 0.0 114.054 179.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -67.71 -17.42 47.66 Favored 'Trans proline' 0 CA--C 1.541 0.83 0 C-N-CA 123.312 2.675 . . . . 0.0 113.827 -176.091 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 98.0 mt -94.31 6.85 47.4 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.553 1.141 . . . . 0.0 113.878 175.225 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -54.67 122.06 9.83 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 120.829 1.649 . . . . 0.0 112.037 -178.262 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 82.3 8.32 86.49 Favored Glycine 0 CA--C 1.541 1.702 0 C-N-CA 125.138 1.351 . . . . 0.0 115.453 -175.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.453 ' HB3' ' HD2' ' A' ' 73' ' ' PRO . 25.4 mt -106.44 160.62 25.61 Favored Pre-proline 0 CA--C 1.558 1.256 0 C-N-CA 126.557 1.943 . . . . 0.0 111.189 178.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.453 ' HD2' ' HB3' ' A' ' 72' ' ' LEU . 50.1 Cg_endo -69.55 163.77 36.84 Favored 'Trans proline' 0 C--N 1.354 0.866 0 C-N-CA 124.386 3.391 . . . . 0.0 113.591 -169.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 11.3 t -105.83 -30.24 2.68 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 O-C-N 121.454 -0.779 . . . . 0.0 112.177 174.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 23.2 p -126.65 171.54 11.05 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 125.184 1.394 . . . . 0.0 114.099 -178.212 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 39.0 ttm180 -61.64 -37.98 86.0 Favored 'General case' 0 N--CA 1.48 1.054 0 O-C-N 121.487 -0.758 . . . . 0.0 110.947 171.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 10.1 t -59.47 -48.74 80.49 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 123.613 0.765 . . . . 0.0 110.331 172.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -60.44 -47.35 86.48 Favored 'General case' 0 CA--C 1.537 0.47 0 O-C-N 122.137 -0.352 . . . . 0.0 111.1 177.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.89 -44.32 97.03 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 118.733 0.697 . . . . 0.0 112.778 -179.592 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 57.8 ttm-85 -62.41 -46.98 86.1 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 119.112 0.869 . . . . 0.0 111.513 176.43 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 54.0 t -63.42 -46.23 95.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.055 0.942 . . . . 0.0 111.489 178.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 52.0 mt -60.66 -45.69 93.16 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 118.194 -0.908 . . . . 0.0 112.003 176.566 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 61.4 mt -54.58 -51.54 49.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 CA-C-N 119.263 0.938 . . . . 0.0 109.975 173.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.44 ' HB2' ' HE1' ' A' ' 101' ' ' MET . 17.5 t80 -62.91 -47.04 84.97 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -178.268 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 57.6 m-20 -69.7 -46.27 66.39 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.947 0.899 . . . . 0.0 112.051 -176.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -63.25 -44.62 94.66 Favored 'General case' 0 N--CA 1.465 0.303 0 O-C-N 121.993 -0.442 . . . . 0.0 111.551 176.343 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.444 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 66.7 t90 -61.11 -47.73 84.9 Favored 'General case' 0 C--O 1.219 -0.517 0 CA-C-O 117.622 -1.18 . . . . 0.0 111.226 172.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -54.48 -44.5 72.66 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 120.907 1.685 . . . . 0.0 112.883 178.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -67.44 -53.87 25.27 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 119.492 1.042 . . . . 0.0 112.632 176.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 77.2 mtm-85 -64.47 -35.0 79.52 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 121.275 -0.89 . . . . 0.0 111.885 -177.546 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.8 tmtt? -74.09 -30.13 62.2 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.359 1.464 . . . . 0.0 113.594 174.543 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -61.75 -35.27 77.63 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 120.051 1.296 . . . . 0.0 110.929 165.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 8.2 t -74.46 -34.27 63.1 Favored 'General case' 0 CA--C 1.553 1.086 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 167.425 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -133.78 80.65 55.0 Favored Pre-proline 0 CA--C 1.549 0.905 0 C-N-CA 127.029 2.132 . . . . 0.0 111.749 -168.212 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -61.8 -6.31 7.34 Favored 'Trans proline' 0 CA--C 1.546 1.091 0 C-N-CA 123.604 2.869 . . . . 0.0 116.345 -168.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 44.1 p90 -88.9 -3.93 58.6 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.694 1.998 . . . . 0.0 114.828 174.534 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.6 tp -66.57 133.38 50.2 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 120.09 1.313 . . . . 0.0 113.255 -173.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 50.9 ttp180 -85.11 152.27 23.52 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.233 1.413 . . . . 0.0 112.723 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.444 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -132.28 130.92 41.49 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.985 2.114 . . . . 0.0 109.826 -174.504 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -143.87 136.04 26.65 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.151 0.98 . . . . 0.0 110.754 176.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.44 ' HE1' ' HB2' ' A' ' 84' ' ' PHE . 66.4 mtt -132.63 15.71 4.4 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.769 1.228 . . . . 0.0 113.567 -177.193 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 74.7 m -69.37 154.18 42.43 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.457 -0.777 . . . . 0.0 110.925 172.533 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -56.94 -34.54 68.12 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 121.018 -1.051 . . . . 0.0 113.709 -168.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -61.64 -32.77 72.94 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 176.235 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.8 -39.72 92.74 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 119.182 0.901 . . . . 0.0 111.665 174.287 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -74.11 -46.57 44.83 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 C-N-CA 124.536 1.134 . . . . 0.0 109.478 179.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 13.8 m-30 -54.94 -45.21 74.83 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 119.064 0.847 . . . . 0.0 112.416 175.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -76.6 -38.3 55.02 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.909 1.284 . . . . 0.0 112.227 -173.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 72.6 mtt85 -70.14 -39.14 75.56 Favored 'General case' 0 N--CA 1.483 1.213 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 171.342 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 29.7 m-85 -130.59 82.81 63.91 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 125.435 1.494 . . . . 0.0 110.988 -165.61 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -69.05 -5.74 16.51 Favored 'Trans proline' 0 CA--C 1.54 0.788 0 C-N-CA 123.728 2.952 . . . . 0.0 114.726 -172.262 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 7.6 p-80 -86.92 -20.51 27.27 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.144 1.378 . . . . 0.0 113.801 170.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -92.39 -14.1 29.14 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 125.881 1.673 . . . . 0.0 113.679 -171.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 14.0 ptt180 . . . . . 0 C--O 1.253 1.261 0 C-N-CA 125.251 1.42 . . . . 0.0 113.515 173.297 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 66.1 m . . . . . 0 N--CA 1.475 0.812 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 23.9 m -138.29 152.95 26.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 125.636 1.574 . . . . 0.0 111.66 176.027 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 21.3 t -151.4 146.82 26.24 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.075 1.35 . . . . 0.0 110.916 175.083 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -138.96 148.57 43.69 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.888 1.275 . . . . 0.0 112.328 -172.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 81.89 129.93 1.2 Allowed Glycine 0 CA--C 1.538 1.492 0 C-N-CA 125.201 1.381 . . . . 0.0 113.26 -175.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -150.39 73.12 9.14 Favored Pre-proline 0 CA--C 1.553 1.06 0 C-N-CA 124.905 1.282 . . . . 0.0 111.336 -178.007 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -66.54 146.65 80.33 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 123.298 2.665 . . . . 0.0 112.481 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 33.3 p -146.17 60.54 6.39 Favored Pre-proline 0 N--CA 1.477 0.903 0 C-N-CA 124.782 1.233 . . . . 0.0 113.051 -174.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -62.16 142.85 93.41 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 123.17 2.58 . . . . 0.0 112.138 177.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -136.3 12.77 3.28 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 115.448 1.647 . . . . 0.0 115.448 -168.615 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 37.1 t -146.17 145.25 30.4 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.678 1.191 . . . . 0.0 112.157 178.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.4 t -141.12 19.07 2.27 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.914 1.685 . . . . 0.0 111.601 171.241 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.4 mp0 -105.56 153.21 22.08 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.798 1.639 . . . . 0.0 112.629 -168.218 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 6.7 t -137.07 53.39 1.89 Allowed 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.718 1.607 . . . . 0.0 110.663 179.135 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 58.67 14.18 3.0 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 126.246 1.819 . . . . 0.0 114.882 -174.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -81.01 -14.27 58.07 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.994 1.718 . . . . 0.0 114.959 -173.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 . . . . . 0 CA--C 1.55 0.952 0 C-N-CA 125.58 1.552 . . . . 0.0 113.03 176.985 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.615 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -91.33 155.78 18.26 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.152 1.381 . . . . 0.0 111.466 166.811 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 88.0 mt -132.5 158.03 43.14 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 125.05 1.34 . . . . 0.0 112.31 -174.201 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 -85.3 142.28 29.46 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.901 0.88 . . . . 0.0 110.042 163.001 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -102.48 -11.47 18.54 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 -171.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -149.19 167.12 26.83 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.658 1.183 . . . . 0.0 113.166 -172.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.02 -161.01 53.21 Favored Glycine 0 CA--C 1.541 1.709 0 C-N-CA 124.062 0.839 . . . . 0.0 113.854 179.645 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -67.63 -16.41 46.69 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 123.163 2.575 . . . . 0.0 113.563 -177.851 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 97.7 mt -93.3 5.22 52.27 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.657 1.183 . . . . 0.0 113.95 176.015 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.61 120.84 8.44 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-N 121.114 1.779 . . . . 0.0 112.025 -178.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 82.55 7.23 87.76 Favored Glycine 0 CA--C 1.54 1.652 0 C-N-CA 125.402 1.477 . . . . 0.0 115.45 -174.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.455 ' HB3' ' HD2' ' A' ' 73' ' ' PRO . 16.3 mt -104.68 159.86 27.92 Favored Pre-proline 0 CA--C 1.558 1.287 0 C-N-CA 126.371 1.868 . . . . 0.0 111.445 -178.66 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.455 ' HD2' ' HB3' ' A' ' 72' ' ' LEU . 68.5 Cg_endo -71.9 163.92 37.3 Favored 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 124.63 3.554 . . . . 0.0 114.163 -168.029 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 10.5 t -108.88 -26.55 3.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 123.902 0.881 . . . . 0.0 112.52 176.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 22.3 p -127.05 172.0 10.87 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 125.508 1.523 . . . . 0.0 113.924 178.292 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -64.83 -36.8 85.51 Favored 'General case' 0 N--CA 1.484 1.264 0 O-C-N 121.183 -0.948 . . . . 0.0 111.251 173.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 32.5 m -61.59 -46.82 88.24 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.948 0.899 . . . . 0.0 111.017 171.095 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -59.36 -46.55 88.33 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 118.776 0.716 . . . . 0.0 111.014 175.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.47 -41.55 98.85 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.692 0.797 . . . . 0.0 112.698 -178.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 60.6 mtp85 -67.81 -39.15 84.01 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.517 0.727 . . . . 0.0 112.396 175.401 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 73.4 t -64.15 -46.56 93.24 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.112 0 CA-C-N 118.847 0.748 . . . . 0.0 111.312 174.255 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.7 mp -60.29 -45.3 93.83 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 118.417 -0.802 . . . . 0.0 112.506 175.439 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 51.1 mt -54.4 -49.86 61.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 CA-C-N 118.969 0.804 . . . . 0.0 110.187 172.303 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 13.8 t80 -63.39 -51.25 66.62 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -177.305 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -67.11 -43.88 81.33 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 119.103 0.865 . . . . 0.0 112.455 -177.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -56.44 -52.69 63.72 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.237 0.615 . . . . 0.0 110.127 174.551 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.4 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 62.9 t90 -59.01 -47.76 84.03 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-O 117.09 -1.433 . . . . 0.0 111.631 176.59 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -56.62 -47.58 79.34 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 121.262 1.846 . . . . 0.0 113.249 -179.76 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -68.26 -47.7 67.03 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 119.516 1.053 . . . . 0.0 111.938 179.264 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 15.8 mmp_? -61.47 -44.57 96.86 Favored 'General case' 0 C--O 1.216 -0.702 0 O-C-N 121.642 -0.661 . . . . 0.0 110.596 178.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -61.75 -35.64 78.69 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 126.102 1.761 . . . . 0.0 113.147 174.335 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 63.0 tttm -62.34 -34.64 77.04 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 119.225 0.92 . . . . 0.0 111.263 170.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 7.9 t -77.72 -29.69 51.35 Favored 'General case' 0 CA--C 1.555 1.168 0 N-CA-C 114.762 1.393 . . . . 0.0 114.762 166.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -133.39 81.21 55.87 Favored Pre-proline 0 N--CA 1.476 0.86 0 C-N-CA 127.511 2.324 . . . . 0.0 111.94 -165.643 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -63.94 7.37 0.21 Allowed 'Trans proline' 0 CA--C 1.551 1.337 0 C-N-CA 124.456 3.437 . . . . 0.0 117.009 -169.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 39.5 p90 -105.24 -6.01 20.12 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 127.199 2.2 . . . . 0.0 114.785 176.33 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 12.9 tp -66.61 139.46 57.89 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.65 1.352 . . . . 0.0 114.65 -168.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 18.2 mmt85 -97.98 158.17 15.69 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 125.342 1.457 . . . . 0.0 112.908 -178.154 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.4 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -139.16 129.81 25.98 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 126.333 1.853 . . . . 0.0 110.297 -167.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -147.3 134.33 20.35 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.208 1.003 . . . . 0.0 111.19 177.475 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 64.4 mtt -131.14 3.65 4.36 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -172.183 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 70.4 m -63.84 153.25 37.28 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.541 0.736 . . . . 0.0 110.904 172.068 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -55.34 -33.25 63.19 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 -166.554 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 57.6 mtmt -59.4 -35.46 74.01 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.851 0.86 . . . . 0.0 113.285 174.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.52 -39.59 94.05 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.209 0.913 . . . . 0.0 111.723 173.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.77 -46.48 61.18 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 C-N-CA 124.212 1.005 . . . . 0.0 109.276 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 13.2 m-30 -56.66 -45.55 81.58 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 118.737 0.699 . . . . 0.0 112.511 174.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.4 tmt_? -75.74 -37.18 59.57 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.482 1.113 . . . . 0.0 112.255 -172.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 37.3 mtp85 -70.99 -38.83 72.7 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 118.587 0.63 . . . . 0.0 112.665 169.397 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -131.27 83.57 59.36 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 125.23 1.412 . . . . 0.0 111.263 -167.638 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -66.88 -18.52 52.59 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 122.846 2.364 . . . . 0.0 113.977 -172.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 8.8 p-80 -72.29 -24.56 61.35 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.901 0.88 . . . . 0.0 113.187 173.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.14 -14.01 48.37 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 126.004 1.722 . . . . 0.0 113.296 -175.837 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.326 0 C-N-CA 124.821 1.249 . . . . 0.0 112.723 178.578 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 85.0 p . . . . . 0 N--CA 1.478 0.975 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 12.7 p -156.71 -42.61 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.197 0 C-N-CA 124.54 1.136 . . . . 0.0 112.492 171.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 39.3 m 61.85 149.28 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 127.423 2.289 . . . . 0.0 115.377 -174.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -141.82 -15.66 0.8 Allowed 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 115.046 1.498 . . . . 0.0 115.046 -175.676 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -66.84 132.53 31.57 Favored Glycine 0 CA--C 1.536 1.377 0 O-C-N 121.108 -0.995 . . . . 0.0 113.5 -177.363 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -147.85 68.61 10.74 Favored Pre-proline 0 CA--C 1.553 1.074 0 C-N-CA 125.098 1.359 . . . . 0.0 111.479 -179.255 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -69.64 153.1 69.89 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 123.47 2.78 . . . . 0.0 112.775 -179.411 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 70.4 m -135.32 67.31 67.58 Favored Pre-proline 0 N--CA 1.475 0.812 0 C-N-CA 125.054 1.342 . . . . 0.0 111.926 -177.193 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -65.66 141.74 67.66 Favored 'Trans proline' 0 CA--C 1.542 0.904 0 C-N-CA 123.2 2.6 . . . . 0.0 111.939 177.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 27.0 tp -135.25 -10.69 2.21 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 114.336 1.235 . . . . 0.0 114.336 -171.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 32.1 p -79.15 141.54 37.16 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.362 1.065 . . . . 0.0 113.082 -178.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 47.4 m -139.27 19.42 2.58 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.841 1.256 . . . . 0.0 113.697 -174.301 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 54.76 30.94 14.48 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 125.241 1.417 . . . . 0.0 113.527 -173.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 29.9 p -87.95 154.77 20.25 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.123 1.769 . . . . 0.0 112.932 -179.589 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 59.41 15.44 4.42 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 115.734 1.753 . . . . 0.0 115.734 179.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -77.29 96.47 4.6 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 121.15 -0.969 . . . . 0.0 110.127 169.06 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 . . . . . 0 N--CA 1.477 0.899 0 C-N-CA 126.546 1.938 . . . . 0.0 115.91 177.434 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.588 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -87.01 146.33 26.16 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.725 1.21 . . . . 0.0 110.922 166.11 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.9 mt -128.13 157.54 40.48 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.449 1.1 . . . . 0.0 112.707 -169.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -77.82 138.11 38.78 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.901 0.88 . . . . 0.0 110.428 166.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -95.25 -15.13 23.44 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 114.478 1.288 . . . . 0.0 114.478 -175.21 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -150.19 169.72 20.65 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.876 1.27 . . . . 0.0 113.088 -172.54 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.2 -164.75 54.91 Favored Glycine 0 CA--C 1.54 1.605 0 C-N-CA 124.184 0.897 . . . . 0.0 114.138 179.385 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -67.69 -17.13 47.69 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 123.325 2.683 . . . . 0.0 113.788 -176.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.8 mt -94.58 6.61 48.34 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.785 1.234 . . . . 0.0 113.815 175.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -54.57 123.33 12.81 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 120.952 1.705 . . . . 0.0 112.256 -177.228 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 82.41 3.13 90.65 Favored Glycine 0 CA--C 1.541 1.678 0 C-N-CA 125.501 1.524 . . . . 0.0 115.378 -174.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.419 ' HB3' ' HD2' ' A' ' 73' ' ' PRO . 20.9 mt -102.01 163.54 17.56 Favored Pre-proline 0 CA--C 1.555 1.156 0 C-N-CA 126.265 1.826 . . . . 0.0 110.888 179.411 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.419 ' HD2' ' HB3' ' A' ' 72' ' ' LEU . 73.7 Cg_endo -76.33 157.33 37.21 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 124.186 3.257 . . . . 0.0 113.383 -164.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 35.3 t -92.99 -35.88 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 O-C-N 121.533 -0.729 . . . . 0.0 112.502 174.511 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 19.6 p -123.29 172.67 8.47 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 114.716 1.376 . . . . 0.0 114.716 -177.501 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 15.0 ptp180 -61.73 -36.66 81.61 Favored 'General case' 0 N--CA 1.482 1.162 0 O-C-N 121.448 -0.783 . . . . 0.0 111.934 173.148 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 25.3 m -66.07 -44.31 84.88 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.895 0.878 . . . . 0.0 110.705 173.16 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -61.23 -42.21 98.22 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 121.714 -0.616 . . . . 0.0 111.401 175.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.09 -44.48 92.23 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.105 0.962 . . . . 0.0 112.831 177.639 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 81.1 mtp180 -66.12 -40.7 90.9 Favored 'General case' 0 N--CA 1.478 0.974 0 O-C-N 121.415 -0.803 . . . . 0.0 112.262 176.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 78.4 t -63.79 -45.85 96.06 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 123.356 0.663 . . . . 0.0 111.071 174.159 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 15.8 mt -57.26 -48.88 77.75 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 118.466 -0.778 . . . . 0.0 112.035 174.11 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 52.8 mt -54.48 -49.42 65.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 CA-C-N 118.736 0.698 . . . . 0.0 110.294 176.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.405 ' HB2' ' HE1' ' A' ' 101' ' ' MET . 13.6 t80 -64.79 -51.62 61.23 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -179.32 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.9 t30 -66.36 -43.8 84.96 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 118.639 0.654 . . . . 0.0 112.544 -176.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -60.62 -51.27 70.11 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 118.845 -0.598 . . . . 0.0 110.025 174.044 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.405 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 62.5 t90 -56.26 -46.26 79.71 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-O 118.001 -0.999 . . . . 0.0 112.5 176.216 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -56.38 -51.31 68.78 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 120.053 1.297 . . . . 0.0 112.491 177.288 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -70.09 -45.58 66.66 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 119.75 1.159 . . . . 0.0 112.488 -178.112 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 58.1 mmt-85 -55.91 -44.01 77.88 Favored 'General case' 0 N--CA 1.475 0.789 0 O-C-N 121.839 -0.538 . . . . 0.0 109.642 174.327 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 78.8 tttt -69.24 -33.24 72.97 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 178.388 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -59.32 -32.5 70.12 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 119.941 1.246 . . . . 0.0 111.137 167.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 67.1 m -81.6 -24.26 36.57 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 115.374 1.62 . . . . 0.0 115.374 166.334 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -145.77 78.93 11.46 Favored Pre-proline 0 CA--C 1.552 1.029 0 C-N-CA 126.758 2.023 . . . . 0.0 111.974 -164.787 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_endo -60.87 -7.51 7.81 Favored 'Trans proline' 0 CA--C 1.548 1.209 0 C-N-CA 123.605 2.87 . . . . 0.0 116.682 -167.56 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 42.2 p90 -86.46 -2.8 58.76 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 126.996 2.118 . . . . 0.0 115.25 176.036 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.35 133.28 52.74 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 124.714 1.206 . . . . 0.0 114.153 -173.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -88.77 152.18 21.94 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 125.278 1.431 . . . . 0.0 113.0 176.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.405 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.3 tm? -133.36 129.22 37.15 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.63 1.572 . . . . 0.0 110.494 -174.06 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -145.99 134.98 22.61 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.319 1.048 . . . . 0.0 110.843 174.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.405 ' HE1' ' HB2' ' A' ' 84' ' ' PHE . 66.8 mtt -129.81 12.48 5.77 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.739 1.216 . . . . 0.0 113.818 -176.284 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 75.3 m -66.99 153.62 43.19 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 121.345 -0.847 . . . . 0.0 111.11 174.247 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -55.17 -36.08 65.47 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -169.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 59.2 mtmt -61.41 -33.19 73.27 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.052 0.941 . . . . 0.0 113.323 176.068 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.01 -40.43 97.73 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 119.194 0.906 . . . . 0.0 111.632 173.206 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.86 -46.14 61.93 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 C-N-CA 123.833 0.853 . . . . 0.0 109.541 -179.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 16.5 m-30 -55.58 -47.01 77.14 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.364 0.666 . . . . 0.0 112.641 174.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.4 tmt_? -77.51 -36.77 52.24 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 124.292 1.037 . . . . 0.0 112.254 -172.254 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 51.1 ttt85 -75.73 -34.56 60.35 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.831 0.852 . . . . 0.0 112.629 174.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 35.6 m-85 -130.74 88.64 45.75 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 125.588 1.555 . . . . 0.0 110.871 -175.316 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -67.51 -19.77 48.35 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 123.057 2.504 . . . . 0.0 114.6 -168.201 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 7.9 p-80 -73.78 -22.48 59.82 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.783 0.833 . . . . 0.0 113.07 173.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.5 4.96 37.61 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 126.571 1.948 . . . . 0.0 113.636 -177.773 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.256 1.402 0 C-N-CA 125.412 1.485 . . . . 0.0 111.433 172.255 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 79.6 p . . . . . 0 N--CA 1.475 0.785 0 CA-C-O 120.835 0.35 . . . . 0.0 111.617 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.3 p -151.54 140.94 15.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 124.492 1.117 . . . . 0.0 111.595 175.644 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.6 p -156.02 153.66 29.83 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.448 1.499 . . . . 0.0 111.797 174.074 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -153.69 156.09 37.19 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.028 1.331 . . . . 0.0 112.295 177.041 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 78.46 148.52 3.93 Favored Glycine 0 CA--C 1.54 1.614 0 C-N-CA 125.1 1.333 . . . . 0.0 114.228 -178.219 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -150.36 64.45 6.67 Favored Pre-proline 0 CA--C 1.555 1.142 0 C-N-CA 124.996 1.318 . . . . 0.0 111.941 179.133 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -68.68 131.09 21.99 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 123.19 2.594 . . . . 0.0 112.082 -179.29 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 73.2 m -140.58 68.97 31.55 Favored Pre-proline 0 N--CA 1.477 0.898 0 C-N-CA 125.162 1.385 . . . . 0.0 111.101 -178.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_endo -67.69 154.73 72.51 Favored 'Trans proline' 0 CA--C 1.543 0.96 0 C-N-CA 123.362 2.708 . . . . 0.0 112.492 179.581 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.1 mp -77.38 -21.38 53.31 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.893 0.877 . . . . 0.0 113.23 -176.499 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 14.0 t -151.97 159.6 43.72 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.636 1.575 . . . . 0.0 111.493 175.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.6 t -150.14 -42.51 0.13 Allowed 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.364 1.066 . . . . 0.0 112.458 178.566 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.6 mp0 -70.84 119.38 14.89 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.521 1.128 . . . . 0.0 112.274 -177.013 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 3.4 t -149.41 36.32 0.73 Allowed 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.627 1.171 . . . . 0.0 112.234 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -136.76 4.59 2.81 Favored 'General case' 0 N--CA 1.478 0.925 0 N-CA-C 114.989 1.477 . . . . 0.0 114.989 -169.491 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -72.86 -24.67 60.9 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 -173.103 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 . . . . . 0 CA--C 1.549 0.912 0 C-N-CA 125.935 1.694 . . . . 0.0 113.786 179.035 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.587 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -87.2 143.44 27.29 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.426 1.091 . . . . 0.0 110.938 169.722 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 59.9 mt -127.9 157.51 40.33 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.517 1.127 . . . . 0.0 112.482 -170.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 93.5 m-70 -79.1 139.15 38.15 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.939 0.896 . . . . 0.0 110.242 167.483 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -94.19 -23.68 17.81 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -174.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -141.14 166.44 24.76 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.192 1.397 . . . . 0.0 112.61 -170.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 74.18 -163.86 54.6 Favored Glycine 0 CA--C 1.539 1.574 0 C-N-CA 124.277 0.942 . . . . 0.0 114.166 178.056 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -67.41 -17.21 49.1 Favored 'Trans proline' 0 CA--C 1.541 0.86 0 C-N-CA 123.281 2.654 . . . . 0.0 113.778 -175.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.9 mt -93.49 5.11 52.7 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.656 1.182 . . . . 0.0 113.81 175.377 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.26 123.61 14.33 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 120.954 1.707 . . . . 0.0 112.318 -176.783 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 81.98 2.9 90.69 Favored Glycine 0 CA--C 1.541 1.681 0 C-N-CA 125.71 1.624 . . . . 0.0 115.339 -174.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 17.0 mt -101.63 162.49 20.27 Favored Pre-proline 0 CA--C 1.557 1.224 0 C-N-CA 126.07 1.748 . . . . 0.0 110.951 -179.107 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -77.69 155.29 31.14 Favored 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 124.113 3.209 . . . . 0.0 113.751 -164.107 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 45.1 t -91.53 -36.44 7.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 CA-C-O 118.514 -0.755 . . . . 0.0 112.574 175.271 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 16.9 p -124.68 172.77 9.01 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 115.038 1.496 . . . . 0.0 115.038 -177.425 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 56.5 ttt180 -59.26 -41.36 88.63 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 125.253 1.421 . . . . 0.0 111.192 174.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.3 t -62.71 -47.32 84.09 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 123.612 0.765 . . . . 0.0 110.832 171.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 69.0 m-20 -60.08 -42.21 94.12 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.418 -0.801 . . . . 0.0 111.862 178.341 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.04 -43.52 92.06 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.63 0.772 . . . . 0.0 112.696 177.486 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 92.5 mtt180 -66.63 -38.33 86.69 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 121.163 -0.961 . . . . 0.0 113.005 175.55 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 77.6 t -66.31 -43.49 91.48 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 CA-C-N 118.835 0.743 . . . . 0.0 111.321 174.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 16.5 mt -56.82 -48.39 78.1 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 118.595 0.634 . . . . 0.0 112.173 172.542 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 59.9 mt -54.83 -51.26 54.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 122.943 0.497 . . . . 0.0 110.082 175.364 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.466 ' HB2' ' HE1' ' A' ' 101' ' ' MET . 15.0 t80 -65.09 -48.0 75.25 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -177.001 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 20.1 t30 -69.64 -45.04 69.36 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.502 0.721 . . . . 0.0 112.246 -176.43 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 48.0 tt0 -66.04 -44.96 83.13 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 118.113 -0.946 . . . . 0.0 110.849 175.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.428 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 66.1 t90 -58.35 -46.0 87.11 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 119.987 1.267 . . . . 0.0 111.588 173.4 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -55.3 -46.15 76.23 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 120.71 1.595 . . . . 0.0 112.768 177.415 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -68.54 -52.24 34.18 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 119.533 1.061 . . . . 0.0 112.766 177.237 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 38.6 mmt180 -57.01 -45.34 83.12 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.447 0.699 . . . . 0.0 110.281 179.243 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.8 tmtt? -70.8 -29.49 65.68 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.785 1.634 . . . . 0.0 113.477 178.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 65.4 tttm -60.71 -35.34 76.07 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 120.237 1.381 . . . . 0.0 110.933 165.714 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 61.1 m -80.04 -23.47 41.39 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 115.226 1.565 . . . . 0.0 115.226 167.265 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -140.0 75.39 29.71 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 126.883 2.073 . . . . 0.0 111.8 -167.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -61.35 -6.23 6.49 Favored 'Trans proline' 0 CA--C 1.547 1.147 0 C-N-CA 123.947 3.098 . . . . 0.0 116.59 -167.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 41.3 p90 -87.44 -8.3 56.66 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 126.648 1.979 . . . . 0.0 114.938 174.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 16.2 tp -65.24 136.55 56.75 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 119.857 1.208 . . . . 0.0 114.048 -168.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 82.3 mtt85 -83.44 155.97 23.15 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.894 1.277 . . . . 0.0 113.084 179.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.428 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.4 tm? -138.8 128.29 24.54 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 126.606 1.962 . . . . 0.0 109.841 -174.672 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -146.5 137.48 24.23 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.111 0.964 . . . . 0.0 110.849 174.407 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.466 ' HE1' ' HB2' ' A' ' 84' ' ' PHE . 65.6 mtt -126.03 12.34 7.76 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.776 1.23 . . . . 0.0 113.713 -175.284 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 32.9 t -61.24 143.87 54.82 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.488 -0.758 . . . . 0.0 110.405 172.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 32.7 m-20 -60.51 -24.95 65.74 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 121.011 -1.056 . . . . 0.0 113.517 -172.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -56.25 -38.45 71.13 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.038 0.935 . . . . 0.0 112.609 169.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.42 -38.65 91.78 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.745 0.818 . . . . 0.0 112.035 173.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -70.38 -46.28 71.66 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 123.806 0.842 . . . . 0.0 109.396 -179.277 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 10.2 m-30 -58.83 -45.91 88.89 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 118.545 0.612 . . . . 0.0 112.284 174.448 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.09 -29.24 60.57 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 124.276 1.031 . . . . 0.0 113.267 -173.654 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -78.85 -38.91 36.76 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.085 0.954 . . . . 0.0 112.374 169.385 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -130.9 83.06 62.34 Favored Pre-proline 0 CA--C 1.546 0.814 0 C-N-CA 125.635 1.574 . . . . 0.0 110.84 -168.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.69 -15.46 44.53 Favored 'Trans proline' 0 CA--C 1.539 0.767 0 C-N-CA 123.067 2.511 . . . . 0.0 114.212 -170.706 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 12.5 p-80 -74.2 -22.71 59.26 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.083 0.953 . . . . 0.0 113.219 173.418 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -81.02 -25.63 37.03 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.389 1.475 . . . . 0.0 112.622 -171.435 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 69.9 ttp85 . . . . . 0 C--O 1.254 1.319 0 C-N-CA 124.585 1.154 . . . . 0.0 112.506 177.711 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 70.9 p . . . . . 0 N--CA 1.474 0.771 0 CA-C-O 121.133 0.492 . . . . 0.0 111.479 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 9.5 p -158.69 155.59 4.36 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 C-N-CA 125.091 1.357 . . . . 0.0 111.296 -178.183 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.2 p -143.14 149.39 38.01 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.923 1.289 . . . . 0.0 112.491 173.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -144.23 169.21 18.31 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 126.023 1.729 . . . . 0.0 111.815 -177.61 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 89.01 82.97 1.29 Allowed Glycine 0 CA--C 1.532 1.141 0 C-N-CA 124.712 1.149 . . . . 0.0 113.441 174.15 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.16 63.19 28.83 Favored Pre-proline 0 CA--C 1.554 1.119 0 C-N-CA 125.329 1.452 . . . . 0.0 111.434 175.093 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -68.38 150.26 75.79 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 123.606 2.87 . . . . 0.0 113.136 -175.625 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 54.1 p -146.51 50.78 1.05 Allowed Pre-proline 0 CA--C 1.552 1.023 0 C-N-CA 125.037 1.335 . . . . 0.0 113.841 -179.459 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -63.49 140.81 77.79 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 123.151 2.568 . . . . 0.0 112.447 -179.54 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -139.8 6.18 2.21 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 115.547 1.684 . . . . 0.0 115.547 -174.523 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.2 t -76.48 130.18 37.59 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 121.366 -0.834 . . . . 0.0 111.79 -178.235 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.4 t -158.09 150.22 21.98 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.33 1.452 . . . . 0.0 111.354 178.195 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -149.81 151.36 33.42 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.108 1.363 . . . . 0.0 112.236 175.118 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 12.3 t -152.58 99.68 2.49 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.763 1.225 . . . . 0.0 109.804 176.235 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -149.81 30.48 0.73 Allowed 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.28 1.032 . . . . 0.0 113.623 -168.652 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -75.51 61.11 1.26 Allowed 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.931 1.693 . . . . 0.0 112.268 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 . . . . . 0 N--CA 1.475 0.797 0 C-N-CA 126.413 1.885 . . . . 0.0 112.425 -170.907 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.488 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -86.58 155.06 20.61 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.523 1.129 . . . . 0.0 110.837 164.394 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 91.3 mt -132.99 157.32 45.49 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.803 1.241 . . . . 0.0 112.105 -175.129 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -81.81 137.53 35.28 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 123.352 0.661 . . . . 0.0 109.615 162.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -96.48 -21.59 17.63 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 114.426 1.269 . . . . 0.0 114.426 -173.422 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -140.8 165.53 27.27 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.202 1.401 . . . . 0.0 112.373 -171.535 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.17 -162.72 54.79 Favored Glycine 0 CA--C 1.54 1.629 0 C-N-CA 124.162 0.887 . . . . 0.0 114.124 178.296 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -67.85 -17.36 46.92 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 123.251 2.634 . . . . 0.0 113.809 -175.168 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 97.8 mt -94.13 6.26 49.15 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.557 1.143 . . . . 0.0 113.901 175.273 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.45 122.01 10.28 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 120.798 1.636 . . . . 0.0 112.123 -178.04 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.15 6.28 88.23 Favored Glycine 0 CA--C 1.541 1.693 0 C-N-CA 125.447 1.499 . . . . 0.0 115.432 -175.18 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.457 ' HB3' ' HD2' ' A' ' 73' ' ' PRO . 18.2 mt -103.99 160.77 25.0 Favored Pre-proline 0 CA--C 1.559 1.293 0 C-N-CA 126.137 1.775 . . . . 0.0 111.33 -179.208 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.457 ' HD2' ' HB3' ' A' ' 72' ' ' LEU . 67.9 Cg_endo -72.24 164.73 34.75 Favored 'Trans proline' 0 C--N 1.354 0.832 0 C-N-CA 124.307 3.338 . . . . 0.0 113.553 -168.497 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 10.6 t -110.12 -27.38 2.89 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 O-C-N 121.288 -0.883 . . . . 0.0 112.458 176.583 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 17.7 p -125.87 172.65 9.71 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 125.385 1.474 . . . . 0.0 114.203 179.726 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 10.1 mmt180 -60.19 -40.96 91.9 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 121.378 -0.826 . . . . 0.0 111.442 170.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 8.6 t -63.15 -44.28 95.98 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 122.617 0.367 . . . . 0.0 110.761 174.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -60.01 -45.14 93.74 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.717 -0.614 . . . . 0.0 111.417 175.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.72 -41.82 95.7 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.595 0.758 . . . . 0.0 112.67 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 34.0 mtp-105 -61.42 -45.8 92.8 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 118.803 0.729 . . . . 0.0 111.773 173.051 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 55.4 t -60.96 -49.78 83.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 124.046 0.938 . . . . 0.0 111.199 177.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.6 mp -60.13 -49.83 76.08 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 118.6 -0.714 . . . . 0.0 112.562 177.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 60.8 mt -54.47 -52.61 38.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-N 118.859 0.754 . . . . 0.0 110.199 175.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -65.44 -47.41 76.26 Favored 'General case' 0 C--O 1.224 -0.267 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -176.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -67.61 -45.95 73.99 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 119.47 1.032 . . . . 0.0 112.528 -178.071 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -64.86 -44.44 89.7 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 118.957 -0.544 . . . . 0.0 110.722 178.606 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.436 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 71.3 t90 -60.29 -46.0 91.4 Favored 'General case' 0 C--O 1.219 -0.545 0 CA-C-O 117.787 -1.102 . . . . 0.0 111.897 171.298 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -55.72 -49.2 73.67 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 121.042 1.747 . . . . 0.0 112.637 179.576 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -65.53 -53.71 38.42 Favored 'General case' 0 C--O 1.245 0.835 0 O-C-N 121.067 -1.02 . . . . 0.0 111.931 178.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 9.8 mmm180 -58.32 -47.12 84.72 Favored 'General case' 0 C--O 1.215 -0.739 0 C-N-CA 122.435 0.294 . . . . 0.0 111.039 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 13.7 tmtt? -67.37 -30.96 70.89 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.32 1.048 . . . . 0.0 113.192 178.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 8.9 mtpm? -66.64 -26.56 67.12 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 120.194 1.361 . . . . 0.0 112.531 168.565 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 79.8 p -91.06 -9.18 46.71 Favored 'General case' 0 N--CA 1.486 1.34 0 N-CA-C 116.185 1.92 . . . . 0.0 116.185 163.104 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -144.64 72.55 15.48 Favored Pre-proline 0 CA--C 1.552 1.02 0 C-N-CA 127.353 2.261 . . . . 0.0 111.4 -172.103 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -61.1 -7.78 8.72 Favored 'Trans proline' 0 CA--C 1.546 1.114 0 C-N-CA 123.835 3.024 . . . . 0.0 116.577 -166.277 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 41.0 p90 -84.31 -10.49 57.58 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 126.502 1.921 . . . . 0.0 115.037 174.506 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.4 tp -64.84 137.08 57.55 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.674 1.124 . . . . 0.0 113.747 -169.589 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 23.3 mmt85 -90.06 156.46 18.37 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.593 1.157 . . . . 0.0 112.78 -179.107 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.436 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.4 tm? -137.69 131.81 31.96 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 126.996 2.119 . . . . 0.0 109.266 -171.772 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 52.5 t0 -141.85 130.65 22.92 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.68 0.792 . . . . 0.0 111.041 175.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 65.0 mtt -122.8 9.23 9.45 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.836 1.654 . . . . 0.0 112.841 -179.732 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 28.9 t -64.52 153.73 38.14 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.026 0.93 . . . . 0.0 111.507 172.516 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -51.4 -38.28 52.64 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.238 1.015 . . . . 0.0 112.79 -179.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -58.78 -39.1 80.04 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.531 1.133 . . . . 0.0 112.914 176.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.24 -42.38 99.26 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 123.25 0.62 . . . . 0.0 111.551 175.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.02 -46.92 64.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.297 0 C-N-CA 123.651 0.781 . . . . 0.0 109.902 -179.036 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 18.8 m-30 -55.35 -46.48 76.4 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 118.869 0.759 . . . . 0.0 112.599 175.394 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 1.5 ttp85 -78.2 -35.18 48.87 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.906 0.882 . . . . 0.0 112.93 -172.053 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 61.7 ttm-85 -80.71 -37.24 30.98 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 124.433 1.093 . . . . 0.0 112.847 175.495 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -129.71 76.96 77.77 Favored Pre-proline 0 CA--C 1.547 0.846 0 C-N-CA 126.54 1.936 . . . . 0.0 110.893 -173.32 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -65.41 -17.67 58.26 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 123.109 2.54 . . . . 0.0 114.281 -172.598 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 7.6 p-80 -74.15 -23.98 59.34 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.078 0.951 . . . . 0.0 113.32 172.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -85.53 -4.79 59.26 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 126.278 1.831 . . . . 0.0 113.496 -178.795 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 57.5 ttp180 . . . . . 0 C--O 1.254 1.302 0 C-N-CA 125.405 1.482 . . . . 0.0 111.843 173.777 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 8.8 t . . . . . 0 N--CA 1.475 0.797 0 CA-C-O 120.666 0.269 . . . . 0.0 111.662 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.9 p -140.86 139.27 34.36 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 125.381 1.472 . . . . 0.0 111.354 175.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 80.2 p -154.01 162.14 41.42 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.726 1.611 . . . . 0.0 111.618 179.535 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 84.1 m-85 -133.43 132.43 41.11 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.632 1.173 . . . . 0.0 111.363 -177.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 72.5 165.08 8.05 Favored Glycine 0 CA--C 1.54 1.619 0 C-N-CA 124.605 1.097 . . . . 0.0 114.235 -172.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -146.95 55.31 2.39 Favored Pre-proline 0 CA--C 1.555 1.14 0 C-N-CA 124.617 1.167 . . . . 0.0 112.984 178.037 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -66.83 141.48 59.32 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.097 2.532 . . . . 0.0 112.378 -179.806 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 9.6 t -152.08 80.88 5.84 Favored Pre-proline 0 CA--C 1.545 0.773 0 C-N-CA 124.479 1.112 . . . . 0.0 110.88 176.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -78.13 95.72 1.08 Allowed 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 123.659 2.906 . . . . 0.0 111.562 -176.498 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 97.9 mt -115.69 -3.26 12.29 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.963 1.305 . . . . 0.0 114.397 -175.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 21.1 t -81.52 134.61 35.54 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.751 0.82 . . . . 0.0 112.054 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 81.4 p -158.42 163.15 37.48 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.525 1.53 . . . . 0.0 112.353 179.44 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -131.05 144.55 51.52 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.217 1.407 . . . . 0.0 111.181 173.244 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 59.8 m -142.44 151.47 41.8 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.745 1.218 . . . . 0.0 112.85 -172.477 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 57.01 25.64 10.94 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.983 1.713 . . . . 0.0 115.467 172.266 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -70.95 -22.42 62.22 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 114.29 1.218 . . . . 0.0 114.29 -174.339 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 . . . . . 0 CA--C 1.551 1.017 0 C-N-CA 125.906 1.682 . . . . 0.0 113.014 -179.239 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.566 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -92.93 154.54 18.13 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.128 1.371 . . . . 0.0 111.639 168.152 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 81.4 mt -129.25 157.12 42.75 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.145 1.378 . . . . 0.0 112.051 -176.284 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 79.3 m-70 -82.94 143.34 30.76 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.716 0.806 . . . . 0.0 109.584 162.347 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -107.13 -9.56 16.12 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 114.898 1.444 . . . . 0.0 114.898 -170.225 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -148.53 165.72 30.38 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.745 1.218 . . . . 0.0 112.957 -174.299 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 68.52 -158.9 52.32 Favored Glycine 0 CA--C 1.541 1.658 0 C-N-CA 123.931 0.777 . . . . 0.0 113.83 -179.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_endo -68.05 -15.45 43.26 Favored 'Trans proline' 0 CA--C 1.541 0.865 0 C-N-CA 123.268 2.645 . . . . 0.0 113.746 -177.441 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.0 mt -94.46 5.5 51.62 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.765 1.226 . . . . 0.0 113.949 176.301 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.93 114.12 2.41 Favored 'General case' 0 CA--C 1.549 0.907 0 CA-C-N 121.276 1.853 . . . . 0.0 111.995 -179.28 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.17 1.81 71.95 Favored Glycine 0 CA--C 1.542 1.763 0 C-N-CA 125.682 1.611 . . . . 0.0 115.694 -174.209 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 6.7 mp -98.61 157.17 34.74 Favored Pre-proline 0 CA--C 1.556 1.198 0 C-N-CA 126.792 2.037 . . . . 0.0 111.563 179.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -68.06 160.13 49.98 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 124.748 3.632 . . . . 0.0 113.664 -172.003 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 15.2 t -103.95 -30.77 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 O-C-N 121.445 -0.784 . . . . 0.0 112.2 175.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 22.3 p -124.96 170.31 11.24 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 125.143 1.377 . . . . 0.0 114.144 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 43.0 ttt-85 -59.97 -40.1 87.94 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.033 0.933 . . . . 0.0 111.119 173.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 37.4 m -62.77 -43.9 97.59 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.019 0.927 . . . . 0.0 111.291 172.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -60.59 -46.46 90.17 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 118.866 0.757 . . . . 0.0 111.274 175.069 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.19 -42.22 98.2 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 118.623 0.647 . . . . 0.0 112.55 179.587 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 74.5 mtp180 -64.45 -43.16 95.13 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 121.525 -0.735 . . . . 0.0 112.376 175.449 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 53.4 t -62.91 -48.33 88.55 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 C-N-CA 123.79 0.836 . . . . 0.0 111.142 176.195 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.7 mp -59.67 -45.15 92.91 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 118.45 -0.786 . . . . 0.0 112.602 176.542 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 49.7 mt -54.76 -51.49 51.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 CA-C-N 118.884 0.765 . . . . 0.0 110.157 173.346 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -65.44 -48.46 72.65 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 113.318 0.859 . . . . 0.0 113.318 -176.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 23.7 t30 -69.43 -42.78 74.56 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 118.627 0.648 . . . . 0.0 112.49 -176.704 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -65.01 -45.96 83.37 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 118.772 -0.633 . . . . 0.0 110.778 175.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.455 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 64.7 t90 -58.99 -47.34 85.53 Favored 'General case' 0 C--O 1.22 -0.454 0 CA-C-O 117.919 -1.039 . . . . 0.0 111.658 173.05 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -57.93 -45.22 86.9 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 120.645 1.566 . . . . 0.0 112.927 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -66.86 -52.76 39.77 Favored 'General case' 0 C--O 1.245 0.824 0 CA-C-N 119.599 1.09 . . . . 0.0 112.435 177.234 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -55.84 -48.51 75.36 Favored 'General case' 0 C--O 1.218 -0.595 0 O-C-N 121.776 -0.578 . . . . 0.0 110.16 177.513 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 18.5 ttpt -63.04 -34.02 76.67 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.214 1.405 . . . . 0.0 113.397 177.197 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -59.64 -33.66 71.81 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 119.998 1.272 . . . . 0.0 111.001 169.171 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 63.0 m -84.37 -17.66 38.69 Favored 'General case' 0 N--CA 1.484 1.234 0 N-CA-C 116.106 1.891 . . . . 0.0 116.106 165.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -143.09 72.89 18.29 Favored Pre-proline 0 CA--C 1.553 1.073 0 C-N-CA 127.266 2.226 . . . . 0.0 111.738 -165.278 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -61.84 -5.23 5.7 Favored 'Trans proline' 0 CA--C 1.547 1.166 0 C-N-CA 123.934 3.089 . . . . 0.0 116.649 -167.301 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 38.9 p90 -88.12 -9.11 54.27 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 126.921 2.088 . . . . 0.0 114.965 175.721 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.3 tp -65.43 137.5 57.51 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 114.725 1.38 . . . . 0.0 114.725 -164.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 34.4 mmt180 -84.21 155.01 22.71 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 125.139 1.376 . . . . 0.0 113.128 178.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.455 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -138.77 131.98 29.94 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.898 2.079 . . . . 0.0 109.681 -174.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 53.5 t0 -143.86 132.44 22.33 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.894 0.877 . . . . 0.0 111.152 174.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 66.7 mtt -125.9 2.21 7.35 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.313 1.445 . . . . 0.0 113.729 -176.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 73.4 m -62.73 144.7 56.14 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 118.96 0.8 . . . . 0.0 110.216 169.797 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -61.26 -25.04 66.82 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 -165.038 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -56.32 -34.48 66.58 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.86 0.864 . . . . 0.0 112.966 171.492 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.31 -40.04 95.0 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.508 0.723 . . . . 0.0 111.922 173.141 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.6 mp -73.28 -45.42 53.07 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 C-N-CA 124.204 1.001 . . . . 0.0 109.261 -179.621 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 11.7 m-30 -55.59 -46.15 77.29 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 118.618 0.644 . . . . 0.0 112.235 175.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.4 tmt_? -77.66 -39.92 43.45 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.65 1.18 . . . . 0.0 112.523 -173.524 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 62.2 ttm-85 -76.89 -35.69 57.24 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.144 0.978 . . . . 0.0 112.994 177.123 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 45.1 m-85 -127.19 72.68 76.96 Favored Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 125.991 1.717 . . . . 0.0 111.115 -174.534 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -66.68 -11.08 30.42 Favored 'Trans proline' 0 CA--C 1.542 0.898 0 C-N-CA 123.348 2.699 . . . . 0.0 114.171 -175.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 16.1 p-80 -74.83 -23.48 58.46 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.003 0.921 . . . . 0.0 113.343 171.296 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -81.04 -45.66 16.2 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.82 1.248 . . . . 0.0 111.892 -164.462 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 20.8 mmt85 . . . . . 0 C--O 1.253 1.268 0 C-N-CA 127.054 2.142 . . . . 0.0 111.121 172.794 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 70.4 p . . . . . 0 N--CA 1.477 0.91 0 N-CA-C 114.972 1.471 . . . . 0.0 114.972 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.0 m -84.92 -1.38 6.64 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 N-CA-C 115.294 1.59 . . . . 0.0 115.294 -169.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 30.2 m -73.4 -13.42 61.08 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 115.71 1.745 . . . . 0.0 115.71 -168.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -79.24 149.36 31.9 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -176.708 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 86.59 134.51 3.86 Favored Glycine 0 CA--C 1.538 1.476 0 C-N-CA 125.693 1.616 . . . . 0.0 114.341 175.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -151.78 67.26 7.15 Favored Pre-proline 0 CA--C 1.556 1.177 0 C-N-CA 125.099 1.36 . . . . 0.0 112.152 -179.824 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -70.32 146.65 57.35 Favored 'Trans proline' 0 CA--C 1.543 0.948 0 C-N-CA 123.369 2.712 . . . . 0.0 112.725 179.56 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 67.3 m -139.47 62.43 24.01 Favored Pre-proline 0 N--CA 1.479 1.014 0 C-N-CA 124.933 1.293 . . . . 0.0 112.637 -177.618 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -67.77 132.15 26.03 Favored 'Trans proline' 0 CA--C 1.542 0.923 0 C-N-CA 123.169 2.579 . . . . 0.0 112.095 179.629 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.3 tt -153.92 115.56 4.2 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.901 1.28 . . . . 0.0 110.341 179.067 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 76.2 p -155.41 148.48 24.61 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.787 1.235 . . . . 0.0 112.304 172.028 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.9 t -159.69 128.72 5.17 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.682 1.193 . . . . 0.0 111.269 172.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -155.97 124.59 5.93 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.981 1.312 . . . . 0.0 110.353 172.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 11.0 t -160.44 151.77 19.36 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.425 1.09 . . . . 0.0 112.426 177.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 47.54 63.05 2.15 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.634 1.974 . . . . 0.0 114.364 170.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -76.54 43.02 0.3 Allowed 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 124.914 1.285 . . . . 0.0 112.27 172.218 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 . . . . . 0 CA--C 1.548 0.892 0 C-N-CA 126.918 2.087 . . . . 0.0 113.575 -168.307 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.579 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -92.41 150.96 20.49 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.612 1.165 . . . . 0.0 111.681 168.844 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 99.5 mt -131.34 157.49 43.21 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.678 1.591 . . . . 0.0 111.28 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -79.23 143.37 35.38 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.809 0.843 . . . . 0.0 109.91 166.552 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -106.83 -9.01 16.51 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 -172.002 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -148.39 165.7 30.31 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.85 1.26 . . . . 0.0 112.924 -174.802 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 69.53 -161.16 52.68 Favored Glycine 0 CA--C 1.541 1.701 0 C-N-CA 123.942 0.782 . . . . 0.0 113.9 -179.33 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -68.07 -16.03 44.17 Favored 'Trans proline' 0 CA--C 1.541 0.851 0 C-N-CA 123.191 2.594 . . . . 0.0 113.72 -177.059 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.1 mt -92.91 4.28 54.2 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 124.813 1.245 . . . . 0.0 113.971 175.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.39 113.94 2.2 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-N 121.107 1.776 . . . . 0.0 112.088 -178.099 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 92.55 4.27 66.0 Favored Glycine 0 CA--C 1.544 1.864 0 C-N-CA 125.642 1.591 . . . . 0.0 115.704 -173.631 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 5.9 mp -105.45 154.77 38.83 Favored Pre-proline 0 CA--C 1.555 1.173 0 C-N-CA 126.831 2.052 . . . . 0.0 111.435 179.848 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -71.56 162.55 41.84 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 124.98 3.786 . . . . 0.0 113.859 -167.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 14.7 t -105.27 -32.88 2.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 O-C-N 121.441 -0.787 . . . . 0.0 113.09 -179.122 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 25.1 p -123.93 172.75 8.69 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 124.914 1.285 . . . . 0.0 113.988 179.364 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 41.5 mtp-105 -61.68 -40.5 95.21 Favored 'General case' 0 N--CA 1.482 1.156 0 O-C-N 121.378 -0.827 . . . . 0.0 110.562 175.054 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 31.3 m -61.67 -44.61 96.63 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 124.353 1.061 . . . . 0.0 111.237 173.321 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -61.16 -47.29 86.88 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 118.885 0.766 . . . . 0.0 111.233 175.116 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.21 -39.58 90.75 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.616 -0.677 . . . . 0.0 112.216 179.698 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 75.3 ttt180 -65.21 -42.07 93.86 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 121.422 -0.798 . . . . 0.0 112.354 174.14 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 68.1 t -63.07 -48.54 87.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 CA-C-N 118.786 0.721 . . . . 0.0 111.223 175.021 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -60.63 -45.11 95.29 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 118.628 -0.701 . . . . 0.0 111.952 178.178 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 52.9 mt -53.59 -51.69 40.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-N 118.736 0.698 . . . . 0.0 110.33 170.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.449 ' HB2' ' HE1' ' A' ' 101' ' ' MET . 20.8 t80 -64.15 -46.5 83.79 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 -176.298 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -70.71 -44.99 65.78 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.033 0.933 . . . . 0.0 112.353 -176.517 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -65.71 -44.01 87.37 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 118.766 -0.635 . . . . 0.0 111.091 176.091 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.437 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 68.3 t90 -60.02 -45.48 92.64 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-O 117.572 -1.204 . . . . 0.0 111.59 171.589 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -54.93 -48.68 72.81 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 120.836 1.653 . . . . 0.0 112.492 178.667 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -65.29 -51.5 60.3 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 119.68 1.127 . . . . 0.0 112.232 177.207 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 38.2 mmt180 -58.54 -46.25 87.22 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 122.99 0.516 . . . . 0.0 110.845 -178.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 3.5 tmtm? -69.27 -30.32 68.4 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 126.043 1.737 . . . . 0.0 113.509 178.661 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 90.8 mttt -65.83 -28.23 68.83 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 119.993 1.27 . . . . 0.0 111.98 166.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 68.5 m -82.9 -22.65 33.88 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 115.173 1.546 . . . . 0.0 115.173 163.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -140.44 75.83 26.48 Favored Pre-proline 0 N--CA 1.477 0.903 0 C-N-CA 127.105 2.162 . . . . 0.0 111.363 -167.332 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -58.63 -16.84 32.29 Favored 'Trans proline' 0 CA--C 1.542 0.907 0 C-N-CA 123.379 2.719 . . . . 0.0 116.039 -165.393 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 39.1 p90 -79.08 -9.78 59.64 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 126.611 1.964 . . . . 0.0 115.463 177.181 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 18.2 tp -64.05 135.42 56.39 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 120.098 1.317 . . . . 0.0 114.35 -167.069 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 7.5 tpm_? -77.9 146.65 35.46 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.939 1.696 . . . . 0.0 112.721 178.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.437 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.4 tm? -128.36 133.89 48.74 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 126.886 2.074 . . . . 0.0 109.847 179.533 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -149.62 134.3 17.69 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.901 0.881 . . . . 0.0 111.084 176.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.449 ' HE1' ' HB2' ' A' ' 84' ' ' PHE . 63.6 mtt -130.24 1.79 4.67 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.052 1.341 . . . . 0.0 114.288 -171.653 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 69.6 m -63.78 147.34 52.0 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.022 0.828 . . . . 0.0 111.067 173.097 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -58.52 -27.64 64.69 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 114.888 1.44 . . . . 0.0 114.888 -166.396 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -56.85 -37.37 71.2 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 119.035 0.834 . . . . 0.0 112.802 172.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.06 -37.1 86.2 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.661 0.784 . . . . 0.0 112.065 174.162 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.6 mp -73.65 -46.4 47.94 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 C-N-CA 124.104 0.962 . . . . 0.0 109.327 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 13.9 m-30 -56.17 -45.81 79.56 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 119.006 0.821 . . . . 0.0 112.334 174.391 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.46 -38.97 62.8 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 124.277 1.031 . . . . 0.0 112.283 -173.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 39.7 ttm105 -78.99 -34.78 43.79 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.836 0.854 . . . . 0.0 112.948 176.45 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 -128.21 78.16 75.86 Favored Pre-proline 0 CA--C 1.546 0.827 0 C-N-CA 126.396 1.879 . . . . 0.0 110.757 -174.329 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -66.16 -16.04 50.59 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 123.091 2.527 . . . . 0.0 114.231 -173.4 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 12.9 p-80 -73.99 -24.01 59.53 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.138 0.975 . . . . 0.0 113.444 172.48 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -82.18 -27.31 32.71 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 125.858 1.663 . . . . 0.0 112.252 -171.442 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 59.6 ttp180 . . . . . 0 C--O 1.254 1.311 0 C-N-CA 125.169 1.388 . . . . 0.0 112.291 175.994 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.6 t . . . . . 0 N--CA 1.477 0.906 0 N-CA-C 115.35 1.611 . . . . 0.0 115.35 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 15.1 m -143.33 152.83 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 126.831 2.053 . . . . 0.0 111.819 -174.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 26.4 m -73.66 -34.44 64.93 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 113.322 0.86 . . . . 0.0 113.322 -179.074 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 7.3 t80 52.09 37.18 20.81 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 126.289 1.836 . . . . 0.0 114.956 172.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -69.84 144.61 40.29 Favored Glycine 0 CA--C 1.537 1.46 0 O-C-N 121.247 -0.908 . . . . 0.0 113.747 -178.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -146.22 66.59 11.42 Favored Pre-proline 0 CA--C 1.554 1.124 0 C-N-CA 125.036 1.334 . . . . 0.0 111.878 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_endo -69.35 150.47 70.74 Favored 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 123.677 2.918 . . . . 0.0 113.094 -177.343 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.9 p -148.31 53.53 1.5 Allowed Pre-proline 0 CA--C 1.553 1.07 0 C-N-CA 125.094 1.357 . . . . 0.0 113.472 -179.458 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -66.02 144.77 77.39 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 123.413 2.742 . . . . 0.0 113.358 -176.176 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.4 mt -140.82 153.7 45.9 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.637 1.975 . . . . 0.0 110.939 176.571 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 81.9 p -152.26 161.46 42.57 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.783 1.233 . . . . 0.0 113.171 -179.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 63.0 m -137.61 148.67 46.02 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.904 1.682 . . . . 0.0 111.393 178.232 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -150.7 138.09 19.54 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.498 1.119 . . . . 0.0 112.121 -177.211 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 69.0 m -142.02 132.69 25.51 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 125.523 1.529 . . . . 0.0 111.132 177.435 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -146.72 -1.56 0.68 Allowed 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 115.396 1.628 . . . . 0.0 115.396 -177.451 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -70.26 -13.48 62.19 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 115.727 1.751 . . . . 0.0 115.727 -165.698 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 . . . . . 0 CA--C 1.548 0.898 0 C-N-CA 125.371 1.469 . . . . 0.0 113.033 173.061 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.546 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -89.25 159.57 17.36 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.792 1.237 . . . . 0.0 111.275 164.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 96.5 mt -135.52 156.17 49.32 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.047 1.339 . . . . 0.0 112.178 -176.059 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 87.3 m-70 -81.67 141.87 33.24 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.731 0.812 . . . . 0.0 109.479 162.12 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -104.82 -16.76 14.81 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 -172.415 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -139.58 162.67 34.53 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.155 1.382 . . . . 0.0 112.373 -173.061 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.84 -161.23 53.97 Favored Glycine 0 CA--C 1.541 1.671 0 C-N-CA 124.075 0.845 . . . . 0.0 113.99 179.065 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -67.81 -16.38 45.86 Favored 'Trans proline' 0 CA--C 1.542 0.902 0 C-N-CA 123.241 2.628 . . . . 0.0 113.835 -176.162 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 98.9 mt -92.82 4.28 54.13 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.697 1.199 . . . . 0.0 113.865 175.245 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.41 113.74 2.12 Favored 'General case' 0 CA--C 1.548 0.896 0 CA-C-N 121.097 1.771 . . . . 0.0 111.999 -179.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.93 6.16 65.53 Favored Glycine 0 CA--C 1.543 1.787 0 C-N-CA 125.453 1.501 . . . . 0.0 115.737 -173.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 6.0 mp -106.44 157.3 35.32 Favored Pre-proline 0 CA--C 1.558 1.267 0 C-N-CA 126.986 2.114 . . . . 0.0 111.318 178.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -71.36 163.9 37.53 Favored 'Trans proline' 0 C--N 1.355 0.882 0 C-N-CA 124.65 3.567 . . . . 0.0 113.833 -168.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 11.0 t -107.05 -27.88 2.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 123.658 0.783 . . . . 0.0 112.084 176.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 29.1 p -126.89 170.38 12.29 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 125.021 1.328 . . . . 0.0 114.471 -179.902 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 71.8 ttt180 -64.65 -39.36 93.56 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 124.618 1.167 . . . . 0.0 111.116 176.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 11.8 p -65.9 -40.58 91.66 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.275 1.03 . . . . 0.0 111.987 170.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 85.6 m-20 -58.82 -48.86 79.82 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 120.01 1.277 . . . . 0.0 110.846 172.297 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.22 -40.74 91.24 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 121.573 -0.704 . . . . 0.0 112.504 179.5 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 38.4 mmm-85 -61.55 -46.8 88.37 Favored 'General case' 0 N--CA 1.485 1.292 0 O-C-N 121.38 -0.825 . . . . 0.0 112.778 172.3 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 55.4 t -61.67 -46.07 97.33 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 C-N-CA 123.662 0.785 . . . . 0.0 111.058 177.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 56.5 mt -63.11 -43.49 98.28 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 117.839 -1.077 . . . . 0.0 112.107 178.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 54.5 mt -53.98 -52.6 34.82 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 CA-C-N 119.591 1.087 . . . . 0.0 110.146 171.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -63.33 -46.83 84.79 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 -177.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -69.91 -44.8 68.92 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 119.043 0.838 . . . . 0.0 112.233 -177.114 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -54.42 -54.85 35.15 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.951 0.9 . . . . 0.0 109.992 172.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.451 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 66.2 t90 -62.39 -42.76 99.67 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-O 117.771 -1.109 . . . . 0.0 112.436 178.805 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -57.56 -46.59 83.74 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 120.723 1.602 . . . . 0.0 112.513 178.408 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -66.65 -49.31 66.64 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 119.347 0.976 . . . . 0.0 112.036 176.399 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 6.1 mmp_? -53.9 -53.88 46.53 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.56 0.744 . . . . 0.0 110.053 177.487 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 45.7 tptt -64.04 -34.26 77.61 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 126.1 1.76 . . . . 0.0 113.374 -178.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt -59.7 -37.23 78.29 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.324 0.966 . . . . 0.0 111.086 169.453 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 70.7 m -81.71 -21.97 37.67 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 115.414 1.635 . . . . 0.0 115.414 169.116 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -143.52 84.82 9.78 Favored Pre-proline 0 N--CA 1.477 0.909 0 C-N-CA 125.913 1.685 . . . . 0.0 112.132 -161.063 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -60.45 -12.66 21.51 Favored 'Trans proline' 0 CA--C 1.544 1.019 0 C-N-CA 123.009 2.473 . . . . 0.0 115.288 -172.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 40.4 p90 -81.91 -8.07 59.65 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 115.509 1.67 . . . . 0.0 115.509 176.661 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.47 137.74 58.32 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 120.394 1.452 . . . . 0.0 113.444 -176.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 84.2 mtp180 -99.99 153.44 19.19 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 125.951 1.7 . . . . 0.0 112.277 175.021 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.451 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.4 tm? -128.4 130.99 48.48 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.769 1.628 . . . . 0.0 110.029 -174.29 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -142.01 131.08 23.23 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.244 1.018 . . . . 0.0 111.049 176.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 61.1 mtt -128.32 -0.37 5.7 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.737 1.384 . . . . 0.0 114.737 -171.824 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 63.6 m -65.77 150.86 47.84 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 118.769 0.713 . . . . 0.0 110.467 172.635 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 27.4 m-20 -59.86 -24.45 64.24 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 114.652 1.352 . . . . 0.0 114.652 -165.558 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -55.56 -36.76 67.17 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.678 0.791 . . . . 0.0 112.416 171.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.61 -39.31 90.77 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 118.868 0.758 . . . . 0.0 112.101 174.195 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.6 mp -73.14 -47.15 48.51 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 C-N-CA 124.341 1.056 . . . . 0.0 109.071 -179.307 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 11.3 m-30 -57.11 -44.41 83.22 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 118.669 0.668 . . . . 0.0 112.296 176.351 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.3 tmt_? -77.66 -38.29 48.05 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 124.656 1.182 . . . . 0.0 112.595 -173.246 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 46.8 mtt-85 -69.02 -41.92 77.1 Favored 'General case' 0 N--CA 1.483 1.181 0 CA-C-N 118.912 0.778 . . . . 0.0 112.506 169.473 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -130.35 71.15 82.38 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 125.43 1.492 . . . . 0.0 111.544 -164.145 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -66.33 -12.68 36.64 Favored 'Trans proline' 0 CA--C 1.54 0.813 0 C-N-CA 123.171 2.58 . . . . 0.0 113.739 -177.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 15.9 p-80 -72.83 -23.86 60.82 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.308 1.043 . . . . 0.0 113.442 172.413 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -80.79 -45.25 17.26 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.193 0.997 . . . . 0.0 112.528 -161.069 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 3.7 tmt_? . . . . . 0 C--O 1.253 1.278 0 C-N-CA 125.968 1.707 . . . . 0.0 110.752 -178.042 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 71.1 m . . . . . 0 N--CA 1.477 0.918 0 N-CA-C 111.529 0.196 . . . . 0.0 111.529 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 62.0 t -133.58 114.96 21.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 C-N-CA 125.179 1.391 . . . . 0.0 109.371 174.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.0 m -137.89 15.29 2.88 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 -171.389 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 36.2 p90 -112.54 163.04 14.97 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.512 1.525 . . . . 0.0 113.322 -173.517 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 130.86 89.68 0.51 Allowed Glycine 0 CA--C 1.533 1.163 0 C-N-CA 125.693 1.616 . . . . 0.0 112.236 177.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -144.36 64.23 11.97 Favored Pre-proline 0 CA--C 1.556 1.179 0 C-N-CA 124.702 1.201 . . . . 0.0 112.351 -178.475 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -69.52 157.54 60.49 Favored 'Trans proline' 0 CA--C 1.543 0.955 0 C-N-CA 123.65 2.9 . . . . 0.0 112.884 179.388 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 75.4 p -150.3 151.57 31.64 Favored Pre-proline 0 N--CA 1.476 0.844 0 C-N-CA 125.004 1.321 . . . . 0.0 112.732 178.167 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -74.97 156.07 43.11 Favored 'Trans proline' 0 CA--C 1.542 0.919 0 C-N-CA 123.61 2.873 . . . . 0.0 112.721 177.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.1 pp -151.19 165.63 33.33 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.142 1.377 . . . . 0.0 112.871 176.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.3 t 60.41 178.55 0.1 Allowed 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 126.604 1.962 . . . . 0.0 115.678 177.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 61.39 8.4 2.14 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 127.907 2.483 . . . . 0.0 116.566 179.441 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -63.0 -30.97 72.01 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 120.447 -1.408 . . . . 0.0 113.764 -168.565 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 76.7 p -99.22 0.55 43.46 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.368 1.467 . . . . 0.0 114.743 -176.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -136.75 -5.81 1.94 Allowed 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 116.215 1.931 . . . . 0.0 116.215 -169.565 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -58.74 -23.57 60.07 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 115.137 1.532 . . . . 0.0 115.137 -173.083 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.546 0.826 0 C-N-CA 126.915 2.086 . . . . 0.0 114.407 177.581 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.573 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -97.15 154.02 17.62 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.312 1.445 . . . . 0.0 111.987 171.194 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 98.2 mt -130.67 157.36 43.0 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 125.64 1.576 . . . . 0.0 111.186 178.518 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 83.2 m-70 -77.87 141.09 39.32 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.587 0.755 . . . . 0.0 109.82 165.425 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -102.89 -16.75 15.79 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 -174.396 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -139.87 163.0 33.81 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.264 1.425 . . . . 0.0 112.373 -173.093 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.86 -162.71 54.43 Favored Glycine 0 CA--C 1.541 1.686 0 C-N-CA 123.978 0.799 . . . . 0.0 114.159 179.02 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -68.0 -17.02 46.11 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 123.279 2.653 . . . . 0.0 113.887 -175.644 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 81.7 mt -92.25 4.88 52.35 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.741 1.216 . . . . 0.0 113.837 174.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.88 114.96 2.55 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 121.142 1.792 . . . . 0.0 112.061 -178.313 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 92.12 3.55 67.58 Favored Glycine 0 CA--C 1.543 1.792 0 C-N-CA 125.704 1.621 . . . . 0.0 115.592 -173.845 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 5.6 mp -105.09 155.36 37.81 Favored Pre-proline 0 CA--C 1.555 1.147 0 C-N-CA 126.841 2.056 . . . . 0.0 111.26 178.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -68.4 162.22 41.55 Favored 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 124.71 3.606 . . . . 0.0 113.459 -170.423 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 14.9 t -102.15 -33.72 3.49 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 O-C-N 121.428 -0.795 . . . . 0.0 112.706 178.329 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 27.1 p -123.98 173.87 7.96 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 125.053 1.341 . . . . 0.0 114.165 -178.618 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 55.4 ttt85 -61.28 -42.1 98.08 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.128 0.971 . . . . 0.0 110.914 173.054 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 32.9 m -61.16 -45.03 96.29 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.908 0.883 . . . . 0.0 110.941 173.353 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 78.2 m-20 -61.11 -47.02 88.19 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 118.644 0.657 . . . . 0.0 111.273 175.595 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.36 -41.24 88.79 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.458 -0.776 . . . . 0.0 112.708 179.461 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.7 tmt_? -65.38 -45.44 84.06 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 118.661 0.664 . . . . 0.0 111.818 174.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 76.6 t -62.21 -46.01 97.43 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 CA-C-N 118.712 0.687 . . . . 0.0 111.38 177.787 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -63.84 -44.93 91.71 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 118.099 -0.953 . . . . 0.0 112.375 177.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 50.2 mt -53.94 -51.78 42.28 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 CA-C-N 119.684 1.129 . . . . 0.0 109.819 171.319 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.441 ' HB2' ' HE1' ' A' ' 101' ' ' MET . 13.3 t80 -60.65 -52.41 65.27 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.09 0.556 . . . . 0.0 112.196 -176.561 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -78.63 -34.71 46.31 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -171.641 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -63.32 -44.22 95.56 Favored 'General case' 0 N--CA 1.467 0.377 0 O-C-N 121.807 -0.558 . . . . 0.0 110.051 169.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.442 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 68.2 t90 -59.41 -48.72 80.55 Favored 'General case' 0 C--O 1.216 -0.7 0 CA-C-O 116.834 -1.555 . . . . 0.0 111.753 170.658 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -51.59 -47.94 63.37 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 121.756 2.071 . . . . 0.0 112.606 179.394 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -68.12 -50.14 56.64 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 118.941 0.791 . . . . 0.0 112.432 178.705 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 90.0 mmt-85 -59.23 -45.14 91.93 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 121.471 -0.768 . . . . 0.0 110.474 178.825 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 47.1 tptt -61.31 -36.27 79.67 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 127.108 2.163 . . . . 0.0 113.078 174.833 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -61.33 -35.34 77.12 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.531 1.06 . . . . 0.0 111.145 169.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 60.6 m -80.31 -19.83 45.71 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 115.472 1.656 . . . . 0.0 115.472 167.096 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -142.07 78.71 16.92 Favored Pre-proline 0 N--CA 1.477 0.892 0 C-N-CA 127.004 2.122 . . . . 0.0 111.88 -166.151 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_endo -59.0 -15.81 29.45 Favored 'Trans proline' 0 CA--C 1.545 1.035 0 C-N-CA 123.121 2.547 . . . . 0.0 114.977 -173.487 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 39.4 p90 -78.89 -10.03 59.68 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.932 1.693 . . . . 0.0 115.3 174.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 14.6 tp -67.36 134.24 51.13 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 120.389 1.45 . . . . 0.0 113.849 -169.211 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 80.1 ttt180 -86.45 152.68 22.48 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 126.12 1.768 . . . . 0.0 112.494 178.171 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.442 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -131.4 131.49 43.66 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.824 2.05 . . . . 0.0 109.692 -177.05 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -143.49 135.26 26.48 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.945 0.898 . . . . 0.0 111.006 176.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.441 ' HE1' ' HB2' ' A' ' 84' ' ' PHE . 63.2 mtt -130.37 21.89 5.19 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.08 1.352 . . . . 0.0 112.782 -176.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 32.4 t -63.86 152.53 39.43 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.626 0.771 . . . . 0.0 111.173 173.315 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -52.02 -39.46 59.52 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.964 0.906 . . . . 0.0 112.329 179.349 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -59.32 -37.54 78.01 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.794 1.238 . . . . 0.0 112.78 176.426 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.3 -42.05 99.03 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 118.767 0.712 . . . . 0.0 111.638 176.388 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.26 -46.98 62.68 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 C-N-CA 123.384 0.674 . . . . 0.0 109.735 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 16.6 m-30 -56.11 -45.75 79.37 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 176.457 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.99 -38.31 37.11 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 124.417 1.087 . . . . 0.0 112.631 -172.098 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 56.0 ttt85 -75.7 -36.88 59.9 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.117 0.967 . . . . 0.0 112.631 175.265 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 38.4 m-85 -124.04 80.49 57.67 Favored Pre-proline 0 CA--C 1.545 0.773 0 C-N-CA 125.683 1.593 . . . . 0.0 110.929 -175.439 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -67.75 -9.54 25.86 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 123.326 2.684 . . . . 0.0 114.442 -173.684 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 10.7 p-80 -80.62 -18.54 47.85 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.343 1.057 . . . . 0.0 113.619 170.383 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.58 -10.8 26.4 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 126.666 1.986 . . . . 0.0 113.546 -172.512 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 6.5 ppt_? . . . . . 0 C--O 1.253 1.255 0 C-N-CA 124.621 1.168 . . . . 0.0 113.48 174.531 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 99.5 mtp . . . . . 0 N--CA 1.498 1.958 0 CA-C-O 119.743 -0.17 . . . . 0.0 110.643 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.32 169.28 22.35 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 124.961 1.305 . . . . 0.0 113.308 177.504 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 115.93 113.4 2.83 Favored Glycine 0 CA--C 1.533 1.215 0 C-N-CA 125.57 1.557 . . . . 0.0 113.559 170.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 78.0 p -157.38 154.33 28.72 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 126.096 1.758 . . . . 0.0 111.395 173.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 55.6 t-80 -153.77 136.75 15.46 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.392 1.077 . . . . 0.0 112.045 176.524 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 13.8 p80 -157.35 143.27 17.62 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.914 1.286 . . . . 0.0 111.666 165.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -160.81 142.86 12.44 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.118 1.367 . . . . 0.0 111.163 165.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -156.91 142.9 17.91 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.494 1.118 . . . . 0.0 112.13 167.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 48.7 p-80 -152.11 149.75 29.14 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.301 1.44 . . . . 0.0 111.36 164.192 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 44.1 p-80 -156.4 163.53 39.35 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.448 1.099 . . . . 0.0 113.339 176.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 81.49 154.92 12.86 Favored Glycine 0 CA--C 1.538 1.514 0 C-N-CA 125.232 1.396 . . . . 0.0 116.365 166.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 23.3 t -157.86 146.57 19.28 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 126.484 1.914 . . . . 0.0 110.31 172.161 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 22.2 m -140.19 152.92 21.95 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 125.124 1.37 . . . . 0.0 112.884 -176.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.6 m -140.97 155.82 46.17 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 125.967 1.707 . . . . 0.0 111.534 178.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 60.2 t80 -138.14 76.9 1.6 Allowed 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.645 1.178 . . . . 0.0 111.286 179.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -79.47 43.99 2.63 Favored Glycine 0 CA--C 1.537 1.46 0 C-N-CA 125.518 1.532 . . . . 0.0 114.589 -178.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -130.88 67.31 80.59 Favored Pre-proline 0 CA--C 1.553 1.084 0 C-N-CA 125.23 1.412 . . . . 0.0 112.953 -172.294 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -71.21 165.76 31.39 Favored 'Trans proline' 0 CA--C 1.544 1.017 0 C-N-CA 123.703 2.936 . . . . 0.0 112.617 174.232 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 61.8 m -129.42 66.41 76.8 Favored Pre-proline 0 N--CA 1.478 0.93 0 C-N-CA 124.93 1.292 . . . . 0.0 112.308 -178.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -70.4 159.24 53.6 Favored 'Trans proline' 0 CA--C 1.543 0.927 0 C-N-CA 123.559 2.839 . . . . 0.0 112.799 178.301 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 58.6 tp -146.05 130.55 17.79 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.033 1.333 . . . . 0.0 111.356 176.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 77.7 p -143.13 18.37 1.93 Allowed 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 125.089 1.356 . . . . 0.0 113.964 -177.125 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.0 t -90.11 2.39 55.32 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 114.633 1.345 . . . . 0.0 114.633 -167.397 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -137.4 127.3 25.69 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.832 1.253 . . . . 0.0 111.939 -176.418 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 69.3 m -136.88 62.48 1.6 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.976 2.11 . . . . 0.0 110.338 178.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 61.84 21.28 12.13 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.778 2.031 . . . . 0.0 115.237 -177.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -64.06 -25.78 68.26 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 115.106 1.521 . . . . 0.0 115.106 -171.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -126.58 5.41 6.82 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.632 1.573 . . . . 0.0 113.217 -179.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 47.8 mm -75.18 -31.82 25.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 O-C-N 120.956 -1.09 . . . . 0.0 111.534 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 45.9 m-20 57.23 -169.93 0.1 Allowed 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 126.465 1.906 . . . . 0.0 113.708 175.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 15.7 t80 56.11 32.62 20.44 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 125.697 1.599 . . . . 0.0 114.421 176.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 60.2 ttp -78.94 -40.95 30.55 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 121.297 -0.877 . . . . 0.0 112.359 -177.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 19.5 p -138.61 57.56 12.01 Favored Pre-proline 0 N--CA 1.481 1.102 0 C-N-CA 125.729 1.612 . . . . 0.0 112.187 -175.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -64.18 146.97 91.28 Favored 'Trans proline' 0 CA--C 1.549 1.263 0 C-N-CA 123.117 2.545 . . . . 0.0 112.579 -178.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -76.92 104.63 1.94 Allowed 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 123.5 2.8 . . . . 0.0 111.686 -178.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -141.12 149.82 42.04 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 125.468 1.507 . . . . 0.0 111.721 179.608 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -134.58 8.74 3.63 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 114.512 1.301 . . . . 0.0 114.512 178.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -147.14 160.7 42.12 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 126.218 1.807 . . . . 0.0 110.543 177.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -139.81 4.3 2.1 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.626 1.57 . . . . 0.0 114.397 -179.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -146.67 71.16 12.65 Favored Pre-proline 0 CA--C 1.546 0.795 0 C-N-CA 125.3 1.44 . . . . 0.0 108.794 173.694 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -79.69 138.18 13.28 Favored 'Trans proline' 0 CA--C 1.543 0.954 0 C-N-CA 122.896 2.397 . . . . 0.0 111.505 -176.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 77.53 115.88 0.17 Allowed Glycine 0 CA--C 1.537 1.437 0 C-N-CA 124.764 1.173 . . . . 0.0 112.675 -171.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -154.81 162.47 41.1 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.948 1.299 . . . . 0.0 112.226 -176.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.2 pp -130.22 167.95 17.61 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.593 1.957 . . . . 0.0 111.683 173.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -130.97 126.25 35.53 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.13 0.972 . . . . 0.0 111.883 174.255 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -83.67 143.95 29.73 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.348 1.059 . . . . 0.0 110.908 169.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 59.0 mt -128.08 157.66 40.1 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.336 1.054 . . . . 0.0 112.65 -169.496 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -79.2 138.82 38.0 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.22 1.008 . . . . 0.0 110.193 166.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -95.85 -15.3 22.57 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 114.658 1.355 . . . . 0.0 114.658 -173.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -150.28 169.4 21.45 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.721 1.209 . . . . 0.0 113.105 -172.242 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 72.49 -163.67 54.68 Favored Glycine 0 CA--C 1.54 1.65 0 C-N-CA 124.169 0.89 . . . . 0.0 114.041 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -67.63 -16.94 47.82 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 123.173 2.582 . . . . 0.0 113.713 -176.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.3 mt -94.01 5.88 50.28 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.723 1.209 . . . . 0.0 113.931 175.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.12 123.33 13.31 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 120.91 1.687 . . . . 0.0 112.387 -177.2 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 81.78 3.58 90.56 Favored Glycine 0 CA--C 1.54 1.641 0 C-N-CA 125.523 1.535 . . . . 0.0 115.323 -175.015 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 16.4 mt -101.46 162.1 21.53 Favored Pre-proline 0 CA--C 1.556 1.208 0 C-N-CA 126.145 1.778 . . . . 0.0 110.926 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -76.8 159.35 34.83 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 124.269 3.312 . . . . 0.0 113.562 -164.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 42.4 t -96.55 -33.85 4.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 CA-C-O 118.621 -0.704 . . . . 0.0 112.743 174.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 16.2 p -124.5 172.18 9.4 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 114.707 1.373 . . . . 0.0 114.707 -178.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 13.6 ptp180 -63.65 -35.03 79.19 Favored 'General case' 0 N--CA 1.482 1.125 0 O-C-N 121.358 -0.839 . . . . 0.0 112.052 174.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.0 t -64.98 -46.58 80.86 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.427 0.691 . . . . 0.0 110.411 171.134 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -59.78 -42.64 93.81 Favored 'General case' 0 CA--C 1.539 0.538 0 O-C-N 121.658 -0.651 . . . . 0.0 111.616 177.141 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.01 -43.66 94.98 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 123.957 0.903 . . . . 0.0 113.035 177.191 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.6 tmt_? -64.49 -43.61 93.6 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 119.311 0.959 . . . . 0.0 111.668 176.495 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 77.5 t -63.13 -44.34 99.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 123.605 0.762 . . . . 0.0 110.983 176.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 20.4 mt -57.89 -51.26 70.34 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 118.113 -0.946 . . . . 0.0 112.103 173.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 65.7 mt -54.37 -50.12 59.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 CA-C-N 119.25 0.932 . . . . 0.0 110.365 177.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.438 ' HB2' ' HE1' ' A' ' 101' ' ' MET . 16.0 t80 -64.19 -47.8 78.36 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 -178.104 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -70.45 -42.84 70.98 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 119.131 0.878 . . . . 0.0 112.466 -177.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -56.22 -54.79 41.06 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 124.286 1.034 . . . . 0.0 110.073 172.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.443 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 68.4 t90 -61.07 -45.37 95.03 Favored 'General case' 0 C--O 1.219 -0.505 0 CA-C-O 117.755 -1.117 . . . . 0.0 111.934 177.674 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -55.49 -47.69 75.76 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 120.562 1.528 . . . . 0.0 112.433 178.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -70.65 -48.44 54.92 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 119.524 1.056 . . . . 0.0 112.521 178.423 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.5 mmp_? -55.34 -49.8 71.3 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.063 0.545 . . . . 0.0 110.48 177.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.8 tmtt? -69.79 -29.23 66.49 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.882 1.673 . . . . 0.0 113.637 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 34.0 ttpt -58.92 -37.1 75.89 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 119.965 1.257 . . . . 0.0 110.851 165.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 68.3 m -81.89 -22.57 36.79 Favored 'General case' 0 N--CA 1.481 1.106 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 168.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -139.92 73.06 33.9 Favored Pre-proline 0 N--CA 1.477 0.916 0 C-N-CA 126.669 1.988 . . . . 0.0 111.534 -164.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -62.05 -6.68 8.34 Favored 'Trans proline' 0 CA--C 1.546 1.099 0 C-N-CA 124.095 3.196 . . . . 0.0 116.5 -165.168 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 37.7 p90 -83.9 -11.58 56.71 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 126.458 1.903 . . . . 0.0 114.875 175.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.5 tp -65.54 136.55 56.54 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 -167.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 27.2 mmm180 -84.23 156.07 22.18 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 124.886 1.275 . . . . 0.0 112.798 179.39 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.443 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -138.75 127.46 23.45 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 126.224 1.81 . . . . 0.0 110.1 -175.636 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -150.17 139.66 21.49 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.604 1.161 . . . . 0.0 111.772 177.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.438 ' HE1' ' HB2' ' A' ' 84' ' ' PHE . 62.6 mtt -135.01 11.04 3.6 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 114.098 1.148 . . . . 0.0 114.098 -167.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 29.8 m -63.02 155.02 28.8 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.117 0.967 . . . . 0.0 111.541 177.039 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -55.23 -36.31 65.86 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 121.09 -1.007 . . . . 0.0 113.448 -171.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -60.86 -34.16 74.18 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.964 0.905 . . . . 0.0 112.841 175.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.05 -41.84 98.55 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 119.071 0.851 . . . . 0.0 111.56 174.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.6 mp -71.34 -45.94 67.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 C-N-CA 123.855 0.862 . . . . 0.0 109.413 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 15.5 m-30 -56.21 -47.02 79.22 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 118.746 0.703 . . . . 0.0 112.693 174.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.9 tmt_? -76.0 -38.18 57.64 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.582 1.153 . . . . 0.0 112.366 -172.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 6.1 ttm180 -75.18 -41.28 58.32 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.675 0.79 . . . . 0.0 112.249 173.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 38.7 m-85 -124.6 81.43 60.3 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 126.028 1.731 . . . . 0.0 111.027 -173.009 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -66.28 -17.48 54.25 Favored 'Trans proline' 0 CA--C 1.539 0.75 0 C-N-CA 123.114 2.543 . . . . 0.0 114.499 -171.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 10.2 p-80 -74.25 -22.89 59.12 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.875 0.87 . . . . 0.0 113.299 173.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -84.32 -15.04 47.99 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 125.819 1.648 . . . . 0.0 113.162 -175.748 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 57.8 ttp180 . . . . . 0 C--O 1.254 1.299 0 C-N-CA 124.501 1.12 . . . . 0.0 111.985 174.018 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 99.0 mtp . . . . . 0 N--CA 1.497 1.921 0 N-CA-C 110.852 -0.055 . . . . 0.0 110.852 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 17.9 tpt180 -146.91 149.63 33.6 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 125.086 1.354 . . . . 0.0 111.494 179.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 76.65 177.84 45.13 Favored Glycine 0 CA--C 1.54 1.601 0 C-N-CA 124.615 1.102 . . . . 0.0 114.728 179.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 71.3 p -81.38 155.02 26.14 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.027 1.331 . . . . 0.0 113.239 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 32.4 p80 -138.48 6.97 2.55 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 114.987 1.477 . . . . 0.0 114.987 -173.289 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 56.2 t-80 -130.32 136.81 49.52 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.907 1.283 . . . . 0.0 112.214 -177.72 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 63.6 m80 -145.24 154.79 42.75 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.971 1.708 . . . . 0.0 111.358 -177.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 58.1 t-80 -148.31 142.2 25.77 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.586 1.154 . . . . 0.0 112.157 177.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 77.7 t60 -156.75 147.86 22.04 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.859 1.264 . . . . 0.0 112.647 177.462 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 24.9 m170 -139.13 132.39 29.91 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.964 1.706 . . . . 0.0 110.209 164.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -113.37 -1.14 24.9 Favored Glycine 0 CA--C 1.538 1.469 0 N-CA-C 116.613 1.405 . . . . 0.0 116.613 -171.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 78.8 p -146.49 153.1 40.03 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 119.401 1.6 . . . . 0.0 114.153 -172.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.8 p -156.4 148.11 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 126.263 1.825 . . . . 0.0 110.718 175.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 79.2 p -150.87 151.69 32.59 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.81 1.244 . . . . 0.0 112.552 174.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 38.6 t80 -153.9 155.87 36.5 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.082 1.353 . . . . 0.0 111.739 176.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -77.1 172.83 55.08 Favored Glycine 0 CA--C 1.539 1.568 0 C-N-CA 124.411 1.005 . . . . 0.0 114.801 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -148.13 148.42 29.41 Favored Pre-proline 0 CA--C 1.551 1.007 0 C-N-CA 125.076 1.35 . . . . 0.0 111.826 174.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -74.53 118.33 5.29 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 123.247 2.632 . . . . 0.0 111.708 178.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 68.6 m -139.2 61.63 21.67 Favored Pre-proline 0 N--CA 1.476 0.856 0 C-N-CA 125.068 1.347 . . . . 0.0 111.92 -179.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -66.22 126.39 15.63 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 123.2 2.6 . . . . 0.0 111.904 -178.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 21.9 tp -141.58 -3.35 1.16 Allowed 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 124.524 1.13 . . . . 0.0 113.963 -175.013 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 21.4 m -64.59 138.35 58.35 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.482 1.113 . . . . 0.0 113.202 -173.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 65.4 p -90.94 -16.56 27.87 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -178.565 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.1 pp20? -77.82 160.84 28.07 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 124.499 1.12 . . . . 0.0 113.6 179.198 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 81.4 p -122.05 20.73 10.68 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 125.816 1.646 . . . . 0.0 114.074 -170.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 60.64 -7.92 0.07 Allowed 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 127.805 2.442 . . . . 0.0 116.391 -170.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -64.19 -25.49 68.1 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 120.858 -1.151 . . . . 0.0 113.998 -177.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -92.67 -11.16 34.83 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.229 1.412 . . . . 0.0 114.604 176.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 44.7 mm -83.7 96.93 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 124.305 1.042 . . . . 0.0 110.031 -173.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 26.9 m-80 -106.37 -18.56 13.95 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.733 1.213 . . . . 0.0 113.724 -177.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 89.5 m-85 -140.86 157.85 44.8 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.746 1.618 . . . . 0.0 111.417 -177.229 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 44.2 tpp -144.84 -42.83 0.24 Allowed 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 177.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 21.1 p -130.46 59.26 44.38 Favored Pre-proline 0 N--CA 1.481 1.078 0 C-N-CA 125.23 1.412 . . . . 0.0 112.719 -177.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_endo -64.92 156.44 62.28 Favored 'Trans proline' 0 CA--C 1.55 1.308 0 C-N-CA 123.108 2.539 . . . . 0.0 112.515 176.331 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -69.13 149.13 70.57 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 123.481 2.787 . . . . 0.0 113.041 -178.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -140.0 13.5 2.45 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 114.394 1.257 . . . . 0.0 114.394 -175.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 61.1 tt0 -63.67 -29.63 70.84 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 120.899 -1.126 . . . . 0.0 113.782 -168.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -86.78 -10.77 52.81 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.204 1.001 . . . . 0.0 113.366 179.079 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -81.62 40.77 0.6 Allowed 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.344 1.458 . . . . 0.0 113.635 -172.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -148.28 69.34 10.57 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 125.449 1.5 . . . . 0.0 110.096 -177.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -81.03 -17.27 9.48 Favored 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 122.899 2.399 . . . . 0.0 114.198 -170.12 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 69.93 22.18 76.99 Favored Glycine 0 CA--C 1.537 1.443 0 N-CA-C 115.348 0.899 . . . . 0.0 115.348 173.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -142.92 154.2 43.85 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.301 1.44 . . . . 0.0 112.326 -176.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -122.99 170.5 10.07 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 127.082 2.153 . . . . 0.0 112.324 179.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -131.44 139.5 49.4 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.343 1.057 . . . . 0.0 113.217 178.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -91.24 163.47 14.23 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.642 1.577 . . . . 0.0 111.408 165.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 96.7 mt -136.64 157.18 47.38 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 125.147 1.379 . . . . 0.0 112.18 -176.337 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 84.8 m-70 -80.82 144.13 32.28 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.681 0.792 . . . . 0.0 109.906 162.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -109.01 -6.11 15.79 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.631 1.345 . . . . 0.0 114.631 -173.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -147.54 164.59 32.94 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.904 1.282 . . . . 0.0 112.917 -175.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 69.23 -161.77 52.07 Favored Glycine 0 CA--C 1.541 1.681 0 C-N-CA 123.888 0.756 . . . . 0.0 113.892 -179.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -68.09 -15.93 43.89 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 123.212 2.608 . . . . 0.0 113.752 -177.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 81.3 mt -92.49 4.2 53.98 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.815 1.246 . . . . 0.0 113.924 175.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.27 113.27 1.87 Allowed 'General case' 0 CA--C 1.548 0.893 0 CA-C-N 121.048 1.749 . . . . 0.0 111.807 -179.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.32 9.76 62.95 Favored Glycine 0 CA--C 1.542 1.743 0 C-N-CA 125.179 1.371 . . . . 0.0 115.676 -173.263 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 5.3 mp -111.84 156.56 41.46 Favored Pre-proline 0 CA--C 1.556 1.19 0 C-N-CA 126.911 2.084 . . . . 0.0 111.545 178.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -63.17 162.21 27.38 Favored 'Trans proline' 0 C--N 1.356 0.921 0 C-N-CA 125.056 3.837 . . . . 0.0 114.33 -172.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 8.2 t -105.5 -30.04 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 123.666 0.786 . . . . 0.0 111.824 172.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 26.6 p -126.9 170.71 11.96 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 125.087 1.355 . . . . 0.0 114.237 -178.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 42.9 ttm-85 -60.37 -41.4 93.65 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.011 0.924 . . . . 0.0 110.848 172.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 28.4 m -60.47 -45.45 93.69 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.903 0.881 . . . . 0.0 111.017 173.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -59.78 -49.32 78.19 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 118.443 0.565 . . . . 0.0 110.9 175.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.03 -43.73 98.46 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.633 0.773 . . . . 0.0 112.637 -177.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 73.0 ttt180 -68.91 -40.94 78.8 Favored 'General case' 0 N--CA 1.478 0.935 0 O-C-N 121.213 -0.929 . . . . 0.0 112.497 178.1 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 77.3 t -64.76 -42.22 94.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 CA-C-N 118.365 0.529 . . . . 0.0 111.192 175.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 87.4 mt -65.54 -41.56 92.9 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 118.179 -0.915 . . . . 0.0 112.541 176.267 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 47.7 mt -53.65 -50.89 47.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 CA-C-N 119.368 0.986 . . . . 0.0 109.729 169.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -64.19 -46.63 83.1 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 113.255 0.835 . . . . 0.0 113.255 -178.241 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -69.96 -44.41 69.56 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.136 0.975 . . . . 0.0 112.598 -176.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -61.04 -52.11 66.36 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 118.554 -0.736 . . . . 0.0 110.117 172.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.422 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 61.7 t90 -56.06 -46.44 78.93 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-N 119.452 1.024 . . . . 0.0 112.126 177.004 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -51.75 -55.36 20.13 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 119.72 1.145 . . . . 0.0 112.459 176.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -74.25 -42.97 58.81 Favored 'General case' 0 N--CA 1.473 0.68 0 O-C-N 121.137 -0.977 . . . . 0.0 112.822 -175.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 35.7 mmt180 -57.29 -45.34 84.21 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.296 0.638 . . . . 0.0 109.835 174.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.9 tmtt? -69.72 -32.18 70.6 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.106 0.962 . . . . 0.0 113.516 178.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 66.4 mttt -61.89 -31.14 71.4 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 119.761 1.164 . . . . 0.0 111.715 167.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 70.6 m -81.82 -24.21 36.01 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 115.14 1.533 . . . . 0.0 115.14 165.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -142.49 78.97 15.86 Favored Pre-proline 0 CA--C 1.55 0.949 0 C-N-CA 126.819 2.048 . . . . 0.0 111.561 -166.136 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -62.21 -5.08 5.97 Favored 'Trans proline' 0 CA--C 1.547 1.161 0 C-N-CA 123.707 2.938 . . . . 0.0 116.566 -167.005 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 39.5 p90 -88.04 -3.53 58.89 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.815 2.046 . . . . 0.0 115.065 175.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.84 141.82 43.3 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-N 119.96 1.255 . . . . 0.0 113.447 -177.634 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 1.9 mpp_? -103.24 153.82 19.99 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 125.255 1.422 . . . . 0.0 112.412 174.301 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.422 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.3 tm? -127.37 128.11 45.32 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.837 1.655 . . . . 0.0 110.264 -173.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 58.4 t0 -143.25 128.7 19.01 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.355 1.062 . . . . 0.0 110.956 179.203 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 65.3 mtt -127.47 10.76 6.75 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.459 1.504 . . . . 0.0 113.127 -177.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 72.6 m -68.14 152.44 45.48 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 121.42 -0.8 . . . . 0.0 111.383 172.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -57.21 -34.58 68.68 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -166.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 33.7 mmtp -59.12 -37.28 76.83 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.002 0.921 . . . . 0.0 112.484 177.03 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.38 -37.25 82.7 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.546 0.739 . . . . 0.0 111.844 173.073 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 2.5 mm -75.18 -44.0 43.69 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 C-N-CA 123.374 0.67 . . . . 0.0 109.396 -175.31 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 10.2 m-30 -60.86 -45.39 94.72 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 123.088 0.555 . . . . 0.0 112.106 174.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 6.5 tmm_? -74.15 -35.14 64.05 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.126 0.971 . . . . 0.0 112.52 -173.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 73.4 mtp85 -74.78 -40.61 61.07 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.702 0.801 . . . . 0.0 112.564 170.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 34.3 m-85 -130.3 77.38 76.29 Favored Pre-proline 0 CA--C 1.545 0.785 0 C-N-CA 125.594 1.558 . . . . 0.0 111.266 -169.164 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -66.51 -16.85 52.31 Favored 'Trans proline' 0 CA--C 1.539 0.767 0 C-N-CA 123.077 2.518 . . . . 0.0 113.979 -173.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 12.1 p-80 -74.05 -22.39 59.56 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.278 1.031 . . . . 0.0 113.495 172.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.47 -19.57 27.8 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 125.986 1.715 . . . . 0.0 112.753 -172.584 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 . . . . . 0 C--O 1.256 1.411 0 C-N-CA 124.625 1.17 . . . . 0.0 112.202 174.738 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 59.8 ttm . . . . . 0 N--CA 1.496 1.833 0 CA-C-O 119.793 -0.146 . . . . 0.0 110.741 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 39.2 ptt85 -135.19 146.74 49.0 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 125.187 1.395 . . . . 0.0 112.487 175.533 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -82.86 -21.66 59.1 Favored Glycine 0 CA--C 1.536 1.373 0 C-N-CA 124.243 0.925 . . . . 0.0 113.958 173.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 45.1 m -82.71 119.37 24.24 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.611 1.164 . . . . 0.0 112.319 -177.01 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 14.0 p80 -154.54 155.76 35.39 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.89 1.676 . . . . 0.0 111.198 168.385 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 71.7 m80 -87.81 67.8 9.21 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.854 1.262 . . . . 0.0 112.11 -172.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 55.9 t-80 -64.79 138.73 58.56 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.876 0.87 . . . . 0.0 112.756 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 6.8 p80 -153.64 161.94 41.7 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.041 1.736 . . . . 0.0 110.846 173.149 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 21.3 p80 -69.16 145.72 53.05 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -178.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 41.7 t60 -140.17 34.46 1.91 Allowed 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.323 1.049 . . . . 0.0 112.803 -172.118 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -67.76 151.96 52.34 Favored Glycine 0 CA--C 1.538 1.471 0 C-N-CA 124.087 0.851 . . . . 0.0 113.55 178.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 88.6 p -147.67 158.79 44.17 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.183 1.393 . . . . 0.0 112.79 -179.284 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.3 p -150.89 148.51 14.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 125.391 1.476 . . . . 0.0 111.027 178.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.2 t -148.18 141.74 25.44 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.623 1.169 . . . . 0.0 111.668 175.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -152.3 154.51 35.83 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.713 1.605 . . . . 0.0 110.912 176.416 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 173.62 -154.81 20.84 Favored Glycine 0 CA--C 1.534 1.276 0 C-N-CA 123.702 0.668 . . . . 0.0 114.148 -178.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . 50.71 56.43 17.23 Favored Pre-proline 0 CA--C 1.557 1.243 0 C-N-CA 126.323 1.849 . . . . 0.0 114.981 -179.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -66.75 159.44 51.26 Favored 'Trans proline' 0 CA--C 1.544 0.981 0 C-N-CA 123.242 2.628 . . . . 0.0 112.328 174.346 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 37.3 p -136.57 56.78 14.33 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 124.835 1.254 . . . . 0.0 113.863 -173.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -64.67 143.29 80.44 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 123.208 2.605 . . . . 0.0 112.233 177.051 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 58.2 tp -153.34 142.65 21.55 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.86 1.264 . . . . 0.0 111.715 -177.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 66.5 p -145.57 140.69 27.6 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.201 1.4 . . . . 0.0 111.354 168.125 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.4 m -141.02 13.22 2.24 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 -169.045 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -148.1 156.35 42.51 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.672 1.189 . . . . 0.0 113.466 -170.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 19.4 t -154.55 148.39 25.54 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.471 1.508 . . . . 0.0 111.156 175.014 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 56.95 24.25 9.19 Favored 'General case' 0 CA--C 1.552 1.019 0 C-N-CA 125.676 1.59 . . . . 0.0 114.712 178.114 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -75.7 -24.8 56.26 Favored 'General case' 0 N--CA 1.475 0.799 0 O-C-N 120.816 -1.177 . . . . 0.0 113.918 -174.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -130.93 6.0 4.6 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.624 1.57 . . . . 0.0 114.693 -175.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 53.8 mt -81.27 103.94 9.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 O-C-N 121.278 -0.889 . . . . 0.0 109.746 -176.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 59.5 t-20 -150.15 130.34 13.62 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.582 1.553 . . . . 0.0 110.486 177.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 35.1 t80 -104.42 -5.49 21.62 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.024 1.33 . . . . 0.0 113.851 -179.401 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 93.7 mtp -80.65 -3.93 52.36 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 114.684 1.365 . . . . 0.0 114.684 -170.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.5 t -120.08 111.63 35.35 Favored Pre-proline 0 N--CA 1.476 0.869 0 C-N-CA 124.849 1.26 . . . . 0.0 111.616 -179.302 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -85.12 162.2 11.55 Favored 'Trans proline' 0 CA--C 1.549 1.252 0 C-N-CA 123.703 2.935 . . . . 0.0 112.851 -179.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -82.74 14.67 2.25 Favored 'Trans proline' 0 CA--C 1.548 1.214 0 C-N-CA 124.443 3.429 . . . . 0.0 114.788 -175.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -68.21 -23.9 64.88 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 114.76 1.393 . . . . 0.0 114.76 -169.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -152.13 145.22 24.56 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.412 1.485 . . . . 0.0 111.238 177.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 31.0 mp0 -68.89 -46.19 68.99 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.088 0.955 . . . . 0.0 112.343 -178.317 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 50.07 37.72 15.0 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 126.013 1.725 . . . . 0.0 115.08 170.034 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 61.7 tt0 -154.65 75.65 5.62 Favored Pre-proline 0 CA--C 1.547 0.837 0 C-N-CA 124.758 1.223 . . . . 0.0 109.697 -173.306 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -81.16 -16.58 9.68 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 122.585 2.19 . . . . 0.0 114.147 -167.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 66.75 32.57 81.65 Favored Glycine 0 CA--C 1.537 1.407 0 N-CA-C 115.42 0.928 . . . . 0.0 115.42 167.106 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -134.16 152.69 51.95 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.211 1.404 . . . . 0.0 112.474 -175.208 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -96.87 168.45 10.48 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 126.383 1.873 . . . . 0.0 112.323 172.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -118.17 123.66 46.07 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.332 1.053 . . . . 0.0 112.032 173.376 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -84.61 144.05 28.86 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.437 1.095 . . . . 0.0 110.7 166.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.4 mt -128.05 157.55 40.38 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.408 1.083 . . . . 0.0 112.441 -169.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -78.07 138.72 38.91 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.896 0.879 . . . . 0.0 110.044 166.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -94.09 -22.75 18.3 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 114.321 1.23 . . . . 0.0 114.321 -175.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -140.68 165.91 26.19 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.99 1.316 . . . . 0.0 112.855 -170.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.37 -163.14 54.81 Favored Glycine 0 CA--C 1.54 1.599 0 C-N-CA 124.247 0.927 . . . . 0.0 114.201 177.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -67.49 -17.08 48.62 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 123.314 2.676 . . . . 0.0 113.754 -176.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.5 mt -93.94 5.0 53.1 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.662 1.185 . . . . 0.0 113.782 175.641 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.32 123.69 14.64 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 120.936 1.698 . . . . 0.0 112.282 -177.06 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 82.58 3.04 90.68 Favored Glycine 0 CA--C 1.541 1.664 0 C-N-CA 125.631 1.586 . . . . 0.0 115.321 -174.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.402 ' HB3' ' HD2' ' A' ' 73' ' ' PRO . 18.0 mt -102.1 161.63 22.8 Favored Pre-proline 0 CA--C 1.556 1.184 0 C-N-CA 126.057 1.743 . . . . 0.0 111.087 -179.214 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.402 ' HD2' ' HB3' ' A' ' 72' ' ' LEU . 73.5 Cg_endo -77.06 156.65 34.05 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 124.208 3.272 . . . . 0.0 113.837 -164.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 39.2 t -94.73 -35.73 6.37 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 O-C-N 121.569 -0.707 . . . . 0.0 112.82 176.45 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 19.9 p -123.44 172.67 8.53 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 125.229 1.412 . . . . 0.0 114.017 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 47.7 ttp180 -64.7 -36.43 84.26 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 121.11 -0.994 . . . . 0.0 110.97 174.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 30.4 m -60.53 -44.27 96.25 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.476 0.71 . . . . 0.0 110.937 170.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 -63.19 -43.67 97.56 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.48 -0.762 . . . . 0.0 111.74 176.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.6 -41.45 96.22 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 118.79 0.723 . . . . 0.0 112.743 177.372 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 22.9 tpp85 -61.75 -45.89 91.98 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.096 1.359 . . . . 0.0 111.762 175.047 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 73.4 t -65.08 -44.14 95.76 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 123.705 0.802 . . . . 0.0 111.11 177.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 17.9 mt -56.46 -49.71 73.81 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 118.603 -0.713 . . . . 0.0 111.997 173.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 51.8 mt -54.24 -52.05 42.02 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 CA-C-N 118.573 0.624 . . . . 0.0 110.322 176.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 22.5 t80 -66.6 -47.19 73.45 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -177.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -68.33 -45.47 72.82 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 118.722 0.692 . . . . 0.0 112.244 -177.552 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 58.1 mm-40 -60.51 -51.4 69.62 Favored 'General case' 0 C--N 1.342 0.248 0 CA-C-O 118.38 -0.819 . . . . 0.0 109.926 174.278 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.445 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 67.5 t90 -56.6 -43.61 80.3 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 119.797 1.18 . . . . 0.0 112.598 177.63 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -59.04 -49.64 77.1 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 119.849 1.204 . . . . 0.0 113.109 177.009 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -71.56 -46.31 59.78 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 119.673 1.124 . . . . 0.0 112.471 -179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 33.4 mmt180 -58.8 -44.6 90.83 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.752 0.821 . . . . 0.0 109.721 176.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 74.5 tttt -70.8 -29.41 65.59 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 176.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -59.47 -35.2 73.64 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 119.922 1.237 . . . . 0.0 110.857 166.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 8.4 t -78.22 -32.9 50.12 Favored 'General case' 0 CA--C 1.553 1.088 0 N-CA-C 114.617 1.34 . . . . 0.0 114.617 167.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -132.97 77.82 67.22 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 127.196 2.198 . . . . 0.0 112.198 -166.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -63.9 5.79 0.34 Allowed 'Trans proline' 0 CA--C 1.549 1.247 0 C-N-CA 124.697 3.598 . . . . 0.0 117.532 -165.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 31.2 p90 -99.78 -6.01 27.67 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 127.306 2.242 . . . . 0.0 114.806 177.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 13.1 tp -65.77 139.51 58.35 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 115.224 1.565 . . . . 0.0 115.224 -167.011 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 11.6 ptp85 -90.02 157.74 17.67 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 125.834 1.653 . . . . 0.0 113.788 176.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.445 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.4 tm? -137.95 130.95 30.13 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 126.935 2.094 . . . . 0.0 109.924 -172.348 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -142.03 136.65 30.45 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.288 1.035 . . . . 0.0 110.632 172.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 61.9 mtt -123.61 5.76 8.89 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.912 1.285 . . . . 0.0 114.268 -172.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 35.0 t -63.74 148.22 49.7 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 119.011 0.823 . . . . 0.0 111.557 178.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -53.82 -31.86 50.76 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 121.202 -0.937 . . . . 0.0 112.813 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 53.8 tptt -54.93 -41.24 70.78 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.956 1.302 . . . . 0.0 112.623 172.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.68 -36.41 83.77 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.159 0.983 . . . . 0.0 112.263 176.363 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.9 mp -74.35 -46.51 43.6 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 C-N-CA 124.185 0.994 . . . . 0.0 109.458 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -56.43 -44.74 80.69 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 119.076 0.853 . . . . 0.0 112.132 174.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.3 tmt_? -72.4 -40.55 67.12 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 124.576 1.15 . . . . 0.0 112.26 -174.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 73.4 mtt85 -72.04 -38.75 69.46 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 173.091 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -131.48 79.39 69.54 Favored Pre-proline 0 CA--C 1.545 0.753 0 C-N-CA 125.584 1.553 . . . . 0.0 110.822 -166.6 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -66.85 -16.05 48.88 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 123.064 2.509 . . . . 0.0 113.986 -173.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 12.1 p-80 -73.49 -23.94 60.11 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.052 0.941 . . . . 0.0 113.134 172.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.44 -27.99 37.83 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.579 1.552 . . . . 0.0 112.3 -173.201 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 51.8 ttt85 . . . . . 0 C--O 1.255 1.359 0 C-N-CA 124.69 1.196 . . . . 0.0 112.288 175.357 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.9 ptt? . . . . . 0 N--CA 1.498 1.96 0 CA-C-O 121.043 0.449 . . . . 0.0 111.786 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -150.67 164.18 36.73 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.944 1.298 . . . . 0.0 112.883 178.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 83.01 154.57 16.52 Favored Glycine 0 CA--C 1.537 1.434 0 C-N-CA 125.24 1.4 . . . . 0.0 114.412 179.094 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 66.5 m -145.15 160.96 40.62 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 125.798 1.639 . . . . 0.0 112.15 -175.046 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 63.9 m80 -128.57 152.45 48.3 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.531 1.532 . . . . 0.0 111.352 175.233 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 34.6 p-80 -136.62 175.86 9.22 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.388 1.475 . . . . 0.0 113.402 -168.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 45.3 t60 55.87 48.46 18.01 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 125.849 1.66 . . . . 0.0 113.842 177.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 93.4 m-70 -77.76 -20.66 53.03 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.27 1.028 . . . . 0.0 113.642 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 51.3 m80 -78.11 140.32 39.05 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.104 1.362 . . . . 0.0 113.055 -170.487 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 21.4 p80 -153.89 160.62 42.22 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.445 1.498 . . . . 0.0 111.565 174.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 162.48 164.5 17.6 Favored Glycine 0 CA--C 1.535 1.297 0 C-N-CA 124.069 0.842 . . . . 0.0 114.123 176.312 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.6 t -152.89 154.66 35.52 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 125.507 1.523 . . . . 0.0 111.088 174.131 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 9.7 p -83.73 143.77 11.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 124.444 1.098 . . . . 0.0 112.02 -178.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 50.4 m -79.44 152.94 30.02 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.04 0.936 . . . . 0.0 112.379 175.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -124.55 146.8 48.81 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.937 1.295 . . . . 0.0 111.566 176.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 72.56 177.19 30.65 Favored Glycine 0 CA--C 1.539 1.546 0 C-N-CA 123.993 0.806 . . . . 0.0 113.73 -169.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -149.27 151.32 33.66 Favored Pre-proline 0 CA--C 1.55 0.952 0 C-N-CA 125.033 1.333 . . . . 0.0 111.929 179.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.48 149.33 68.54 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 123.209 2.606 . . . . 0.0 112.219 175.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 49.8 m -75.01 147.58 83.76 Favored Pre-proline 0 N--CA 1.474 0.728 0 C-N-CA 123.921 0.888 . . . . 0.0 112.791 -178.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -71.06 164.82 34.43 Favored 'Trans proline' 0 CA--C 1.543 0.95 0 C-N-CA 123.522 2.815 . . . . 0.0 112.322 172.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.3 tt -136.34 127.71 28.4 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.975 1.31 . . . . 0.0 110.836 178.159 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 31.2 m -139.8 29.71 2.1 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.286 1.435 . . . . 0.0 112.591 -173.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.5 m -74.39 -10.07 59.21 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 115.921 1.823 . . . . 0.0 115.921 -164.076 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -129.08 136.09 49.78 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.939 1.296 . . . . 0.0 111.884 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 81.7 p -158.54 166.66 31.61 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.425 1.49 . . . . 0.0 112.575 -177.361 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 61.12 21.35 11.76 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 115.35 1.611 . . . . 0.0 115.35 172.292 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -74.45 -19.61 60.33 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 120.769 -1.207 . . . . 0.0 114.158 -175.009 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -137.89 13.37 2.9 Favored 'General case' 0 CA--C 1.553 1.058 0 C-N-CA 125.416 1.486 . . . . 0.0 113.41 -177.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 44.8 mm -100.03 136.77 29.93 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.816 1.247 . . . . 0.0 111.796 -171.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 54.3 t30 58.15 49.06 11.94 Favored 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 126.207 1.803 . . . . 0.0 114.679 174.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -114.55 29.35 8.09 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.295 1.438 . . . . 0.0 113.169 175.168 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 1.5 pmm? -130.1 153.15 48.78 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 126.064 1.746 . . . . 0.0 112.607 -179.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 18.3 p -137.57 65.35 47.5 Favored Pre-proline 0 N--CA 1.481 1.104 0 C-N-CA 125.173 1.389 . . . . 0.0 112.685 -170.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -63.66 156.14 59.04 Favored 'Trans proline' 0 CA--C 1.549 1.274 0 C-N-CA 123.039 2.492 . . . . 0.0 112.646 174.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -74.18 119.39 5.79 Favored 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 123.27 2.647 . . . . 0.0 112.304 -176.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -138.45 144.82 40.28 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.656 1.582 . . . . 0.0 111.55 179.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 82.6 mt-30 -131.25 15.23 5.09 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 124.819 1.248 . . . . 0.0 113.488 -178.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 55.52 29.89 14.2 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 125.544 1.538 . . . . 0.0 113.895 -175.44 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -130.38 69.59 1.45 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.11 1.764 . . . . 0.0 110.709 -174.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -146.25 73.66 13.09 Favored Pre-proline 0 CA--C 1.545 0.778 0 C-N-CA 125.254 1.422 . . . . 0.0 109.129 -178.127 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -81.28 73.93 5.7 Favored 'Trans proline' 0 CA--C 1.542 0.912 0 C-N-CA 123.973 3.116 . . . . 0.0 110.8 -171.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 92.58 151.63 27.91 Favored Glycine 0 CA--C 1.538 1.491 0 C-N-CA 125.423 1.487 . . . . 0.0 112.253 -163.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -125.46 21.71 7.81 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.971 1.308 . . . . 0.0 113.894 -169.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -72.79 154.9 40.44 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.997 1.319 . . . . 0.0 111.348 176.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -143.16 151.51 40.74 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.406 1.483 . . . . 0.0 112.804 175.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -95.23 150.52 20.14 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.981 1.312 . . . . 0.0 112.137 173.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 91.5 mt -130.43 157.62 42.11 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.623 1.569 . . . . 0.0 111.675 -179.164 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -79.06 141.26 37.55 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.102 0.961 . . . . 0.0 110.463 168.004 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -100.25 -11.85 20.02 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 -173.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -149.41 167.83 25.08 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.791 1.236 . . . . 0.0 113.233 -172.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.41 -163.62 54.11 Favored Glycine 0 CA--C 1.54 1.647 0 C-N-CA 124.16 0.886 . . . . 0.0 114.014 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -67.64 -16.56 46.97 Favored 'Trans proline' 0 CA--C 1.542 0.882 0 C-N-CA 123.262 2.642 . . . . 0.0 113.686 -177.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.0 mt -92.89 4.66 53.51 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.702 1.201 . . . . 0.0 113.873 175.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.63 122.62 11.76 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 120.874 1.67 . . . . 0.0 112.016 -177.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.2 5.06 89.35 Favored Glycine 0 CA--C 1.541 1.704 0 C-N-CA 125.399 1.476 . . . . 0.0 115.404 -174.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 18.7 mt -104.74 159.07 30.55 Favored Pre-proline 0 CA--C 1.556 1.177 0 C-N-CA 126.227 1.811 . . . . 0.0 111.263 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -79.38 160.12 25.89 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 124.523 3.482 . . . . 0.0 113.805 -164.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 19.1 t -102.36 -33.15 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 N-CA-C 113.381 0.882 . . . . 0.0 113.381 -175.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 19.7 p -123.44 171.28 9.59 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 114.3 1.222 . . . . 0.0 114.3 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 46.3 ttt180 -61.83 -40.14 94.24 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 124.356 1.063 . . . . 0.0 110.767 177.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 31.4 m -63.6 -44.42 94.06 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 124.683 1.193 . . . . 0.0 111.552 171.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 78.5 m-20 -60.1 -47.0 87.72 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.007 0.821 . . . . 0.0 110.993 174.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.66 -39.56 91.82 Favored 'General case' 0 CA--C 1.541 0.596 0 O-C-N 121.405 -0.81 . . . . 0.0 112.575 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 78.9 ttt180 -64.49 -43.66 93.46 Favored 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 119.24 0.927 . . . . 0.0 112.344 172.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 54.9 t -60.62 -49.24 85.25 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 CA-C-N 118.797 0.726 . . . . 0.0 111.182 175.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -62.64 -42.66 99.73 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 118.22 -0.895 . . . . 0.0 112.15 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 56.0 mt -55.86 -51.37 61.1 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 CA-C-N 119.408 1.004 . . . . 0.0 110.471 170.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 20.2 t80 -63.67 -47.63 80.44 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -175.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 12.3 t30 -68.99 -44.07 73.57 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 118.913 0.779 . . . . 0.0 112.169 -179.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -56.21 -53.5 56.46 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 122.701 0.401 . . . . 0.0 110.059 174.285 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.448 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 62.6 t90 -59.37 -46.8 87.64 Favored 'General case' 0 C--O 1.218 -0.587 0 CA-C-O 117.415 -1.278 . . . . 0.0 111.793 177.226 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -55.91 -48.76 75.09 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 120.928 1.694 . . . . 0.0 113.306 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -69.01 -47.4 65.59 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.171 0.896 . . . . 0.0 111.982 179.279 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 38.8 mmm-85 -59.16 -47.63 84.59 Favored 'General case' 0 C--O 1.216 -0.67 0 O-C-N 121.645 -0.659 . . . . 0.0 110.699 177.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 18.9 tptm -62.42 -35.09 78.15 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 126.07 1.748 . . . . 0.0 113.043 176.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 14.9 tmtt? -59.44 -36.82 76.65 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 119.603 1.092 . . . . 0.0 111.126 168.458 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 66.5 m -81.7 -18.34 44.73 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 115.926 1.824 . . . . 0.0 115.926 168.691 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -140.13 84.07 15.19 Favored Pre-proline 0 N--CA 1.477 0.903 0 C-N-CA 126.603 1.961 . . . . 0.0 111.88 -165.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -62.04 -0.92 1.91 Allowed 'Trans proline' 0 CA--C 1.549 1.256 0 C-N-CA 124.274 3.316 . . . . 0.0 116.598 -171.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 31.3 p90 -98.25 -10.96 23.17 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.667 1.987 . . . . 0.0 115.161 177.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 11.1 tp -66.82 137.73 56.82 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 114.671 1.36 . . . . 0.0 114.671 -166.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 18.6 mmt85 -99.37 159.25 15.15 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 126.05 1.74 . . . . 0.0 112.44 -179.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.448 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.4 tm? -137.07 133.51 35.5 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.573 1.949 . . . . 0.0 109.958 -169.556 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 54.0 t0 -141.43 130.53 23.34 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.186 0.994 . . . . 0.0 111.079 176.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 65.4 mtt -124.47 6.88 8.3 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.259 1.423 . . . . 0.0 113.409 -179.002 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 68.7 m -64.18 147.25 52.76 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 121.496 -0.753 . . . . 0.0 110.547 168.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.4 -26.23 67.71 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 113.526 0.935 . . . . 0.0 113.526 -166.009 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 61.0 mtpt -56.95 -34.79 68.37 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.76 1.224 . . . . 0.0 113.248 172.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.92 -39.69 92.93 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 118.914 0.779 . . . . 0.0 111.613 173.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.6 mp -73.62 -46.13 48.94 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 C-N-CA 124.299 1.039 . . . . 0.0 109.24 -179.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.4 m-30 -55.87 -46.13 78.34 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 119.152 0.887 . . . . 0.0 112.464 175.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.72 -41.59 44.53 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.387 1.075 . . . . 0.0 112.532 -173.087 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 6.9 ttm180 -75.27 -39.81 59.4 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.642 0.777 . . . . 0.0 112.447 176.563 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -124.73 74.58 64.19 Favored Pre-proline 0 CA--C 1.547 0.854 0 C-N-CA 125.999 1.72 . . . . 0.0 111.214 -172.521 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -67.09 -10.25 27.91 Favored 'Trans proline' 0 CA--C 1.538 0.694 0 C-N-CA 123.521 2.814 . . . . 0.0 114.626 -173.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 14.7 p-80 -77.98 -24.55 47.99 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.341 1.056 . . . . 0.0 113.407 172.079 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -77.76 -48.84 15.64 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.292 1.037 . . . . 0.0 112.057 -161.447 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 10.7 mmt180 . . . . . 0 C--O 1.254 1.301 0 C-N-CA 126.442 1.897 . . . . 0.0 112.923 179.633 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 99.5 mtp . . . . . 0 N--CA 1.497 1.921 0 N-CA-C 110.888 -0.041 . . . . 0.0 110.888 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -146.42 160.8 41.6 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 125.165 1.386 . . . . 0.0 113.427 177.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -160.08 16.49 0.21 Allowed Glycine 0 CA--C 1.539 1.557 0 C-N-CA 124.528 1.061 . . . . 0.0 115.461 176.593 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 79.4 p -83.67 158.51 21.81 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.011 1.325 . . . . 0.0 113.85 -175.072 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 46.8 p-80 -137.95 160.51 39.13 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.557 1.543 . . . . 0.0 111.596 172.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 20.9 t60 -142.98 82.86 1.78 Allowed 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.209 1.004 . . . . 0.0 111.418 -178.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 57.3 t-80 -151.96 144.16 23.95 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.848 1.259 . . . . 0.0 111.665 175.107 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 48.1 p-80 -151.62 146.57 25.92 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.248 1.419 . . . . 0.0 111.51 173.003 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 66.9 t60 -156.91 155.46 31.42 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.237 1.415 . . . . 0.0 111.687 177.097 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 46.7 t-80 -147.47 141.22 25.68 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.975 1.31 . . . . 0.0 111.688 170.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -172.25 31.27 0.12 Allowed Glycine 0 CA--C 1.537 1.425 0 N-CA-C 115.218 0.847 . . . . 0.0 115.218 178.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.2 t -148.51 142.66 26.03 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 118.642 1.221 . . . . 0.0 113.021 -176.142 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 13.1 p -153.75 142.94 14.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 126.0 1.72 . . . . 0.0 110.271 174.236 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 82.1 p -155.62 159.95 40.04 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.331 1.053 . . . . 0.0 113.366 -178.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 90.7 t80 -148.08 151.37 35.54 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.458 1.503 . . . . 0.0 111.252 170.016 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -179.71 47.33 0.08 OUTLIER Glycine 0 CA--C 1.532 1.156 0 C-N-CA 123.848 0.737 . . . . 0.0 113.772 177.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -129.09 62.11 60.63 Favored Pre-proline 0 CA--C 1.554 1.117 0 C-N-CA 124.429 1.092 . . . . 0.0 113.944 -171.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -69.97 168.74 20.95 Favored 'Trans proline' 0 CA--C 1.545 1.054 0 C-N-CA 123.379 2.72 . . . . 0.0 112.163 169.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 14.8 t -134.88 83.8 39.76 Favored Pre-proline 0 N--CA 1.474 0.764 0 C-N-CA 124.465 1.106 . . . . 0.0 111.316 176.093 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -80.22 64.03 8.82 Favored 'Trans proline' 0 CA--C 1.546 1.115 0 C-N-CA 124.454 3.436 . . . . 0.0 111.475 -179.413 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -75.77 -6.61 51.45 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 115.784 1.772 . . . . 0.0 115.784 -170.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.2 m -64.11 139.67 58.79 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.633 1.173 . . . . 0.0 113.132 -175.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 77.9 p -133.41 15.05 4.11 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 125.19 1.396 . . . . 0.0 114.291 -171.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -64.03 -27.92 69.45 Favored 'General case' 0 N--CA 1.476 0.871 0 O-C-N 120.901 -1.125 . . . . 0.0 113.691 -171.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 31.1 p -79.84 -45.89 17.89 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.579 1.151 . . . . 0.0 112.214 171.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 57.8 mt-10 -60.21 -27.0 66.82 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.78 1.232 . . . . 0.0 112.868 179.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -67.37 -14.18 62.69 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.018 1.327 . . . . 0.0 114.239 175.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -135.54 -3.28 2.37 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 115.624 1.713 . . . . 0.0 115.624 179.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 91.8 mt -123.4 115.29 45.01 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 125.987 1.715 . . . . 0.0 109.642 176.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -87.48 51.15 2.15 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 124.831 1.252 . . . . 0.0 111.188 177.77 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 56.26 24.4 8.15 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 126.55 1.94 . . . . 0.0 115.779 177.214 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 14.5 ttt -136.02 20.36 3.24 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.761 1.225 . . . . 0.0 113.722 -170.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 16.7 m -128.46 80.8 71.84 Favored Pre-proline 0 N--CA 1.482 1.147 0 C-N-CA 124.209 1.003 . . . . 0.0 110.899 -176.06 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -71.53 159.56 50.91 Favored 'Trans proline' 0 CA--C 1.548 1.185 0 C-N-CA 123.391 2.727 . . . . 0.0 112.374 175.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -69.35 153.82 70.24 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 123.434 2.756 . . . . 0.0 112.755 176.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -132.29 10.98 4.53 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 114.537 1.31 . . . . 0.0 114.537 -175.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 31.0 tt0 -77.89 -27.88 49.75 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 113.547 0.943 . . . . 0.0 113.547 -174.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 60.78 -28.25 0.05 OUTLIER 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 128.838 2.855 . . . . 0.0 117.095 -177.071 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 52.75 37.6 24.21 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 126.782 2.033 . . . . 0.0 115.296 172.092 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -143.86 51.02 1.43 Allowed Pre-proline 0 CA--C 1.555 1.136 0 C-N-CA 124.888 1.275 . . . . 0.0 113.383 -178.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -76.88 164.82 29.43 Favored 'Trans proline' 0 CA--C 1.544 0.984 0 C-N-CA 123.699 2.933 . . . . 0.0 114.4 -170.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 87.76 148.18 14.41 Favored Glycine 0 CA--C 1.538 1.478 0 C-N-CA 125.545 1.545 . . . . 0.0 115.906 168.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -150.6 143.3 24.54 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.145 1.778 . . . . 0.0 110.989 173.108 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -124.55 158.03 33.96 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 125.575 1.55 . . . . 0.0 111.597 -177.025 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -128.16 124.54 37.11 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.006 1.322 . . . . 0.0 111.34 168.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -84.36 143.71 29.3 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.318 1.047 . . . . 0.0 111.22 170.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 58.3 mt -126.88 157.46 39.3 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.718 1.207 . . . . 0.0 112.629 -170.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -79.41 137.47 37.28 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.01 0.924 . . . . 0.0 110.24 166.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -93.74 -16.9 23.74 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 -174.211 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -150.65 170.31 19.49 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.772 1.229 . . . . 0.0 113.005 -172.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.59 -163.99 54.79 Favored Glycine 0 CA--C 1.54 1.655 0 C-N-CA 124.155 0.883 . . . . 0.0 114.049 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -67.58 -17.11 48.2 Favored 'Trans proline' 0 CA--C 1.542 0.882 0 C-N-CA 123.265 2.643 . . . . 0.0 113.752 -176.075 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.7 mt -95.32 6.89 47.8 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.699 1.199 . . . . 0.0 113.834 175.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -54.7 123.46 13.34 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 120.853 1.66 . . . . 0.0 112.442 -176.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 81.63 3.0 90.72 Favored Glycine 0 CA--C 1.54 1.625 0 C-N-CA 125.577 1.561 . . . . 0.0 115.387 -175.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.431 ' HB3' ' HD2' ' A' ' 73' ' ' PRO . 19.0 mt -100.57 161.21 24.68 Favored Pre-proline 0 CA--C 1.555 1.144 0 C-N-CA 126.062 1.745 . . . . 0.0 111.0 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.431 ' HD2' ' HB3' ' A' ' 72' ' ' LEU . 71.8 Cg_endo -75.24 157.24 41.87 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 124.197 3.265 . . . . 0.0 113.63 -165.74 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 52.0 t -92.5 -36.27 7.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 O-C-N 121.434 -0.791 . . . . 0.0 112.719 175.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 16.4 p -122.41 172.36 8.39 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 124.999 1.319 . . . . 0.0 114.496 -178.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 34.6 ptt-85 -63.48 -34.4 77.69 Favored 'General case' 0 N--CA 1.483 1.193 0 O-C-N 121.298 -0.876 . . . . 0.0 112.26 172.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 17.7 t -66.4 -44.96 81.57 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.16 0.584 . . . . 0.0 110.605 171.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -60.4 -43.16 96.94 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.619 -0.676 . . . . 0.0 111.397 175.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.47 -43.97 97.53 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.775 0.83 . . . . 0.0 112.78 176.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 60.3 ttp180 -65.34 -41.75 93.6 Favored 'General case' 0 N--CA 1.477 0.917 0 O-C-N 121.341 -0.849 . . . . 0.0 112.233 177.115 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 71.0 t -63.73 -45.0 98.52 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 C-N-CA 123.65 0.78 . . . . 0.0 111.073 175.42 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 21.4 mt -58.61 -48.96 79.22 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 118.56 -0.733 . . . . 0.0 112.335 174.148 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 57.2 mt -54.2 -51.12 50.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-N 118.598 0.636 . . . . 0.0 109.915 176.232 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.406 ' HB2' ' HE1' ' A' ' 101' ' ' MET . 12.7 t80 -64.17 -50.65 67.33 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.856 0.687 . . . . 0.0 112.856 -177.695 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -66.46 -45.79 78.58 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 119.193 0.906 . . . . 0.0 112.395 -177.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -62.2 -45.83 91.6 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 119.135 -0.459 . . . . 0.0 110.505 178.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 68.6 t90 -60.09 -46.58 89.12 Favored 'General case' 0 C--O 1.217 -0.617 0 CA-C-O 117.506 -1.235 . . . . 0.0 111.953 172.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -57.35 -45.15 84.64 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 121.149 1.795 . . . . 0.0 113.042 179.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -69.53 -50.02 48.94 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 119.559 1.072 . . . . 0.0 112.187 178.213 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -56.64 -49.74 74.11 Favored 'General case' 0 C--O 1.216 -0.672 0 O-C-N 121.789 -0.569 . . . . 0.0 110.602 176.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.9 tmtt? -66.44 -30.92 71.38 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.664 1.586 . . . . 0.0 113.634 179.271 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 2.4 tmpt? -58.73 -37.92 77.22 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 120.015 1.279 . . . . 0.0 110.756 165.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 51.5 m -83.03 -16.94 45.07 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 115.575 1.694 . . . . 0.0 115.575 169.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -142.91 72.11 18.99 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 127.328 2.251 . . . . 0.0 111.194 -166.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -61.56 -6.26 6.87 Favored 'Trans proline' 0 CA--C 1.548 1.185 0 C-N-CA 123.921 3.081 . . . . 0.0 116.545 -165.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 38.9 p90 -86.13 -9.78 56.02 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 126.76 2.024 . . . . 0.0 115.032 174.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.6 tp -65.76 138.06 57.68 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 114.762 1.393 . . . . 0.0 114.762 -165.463 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 82.0 mtp180 -84.26 155.23 22.55 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 125.737 1.615 . . . . 0.0 112.997 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -138.52 129.87 27.34 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 126.608 1.963 . . . . 0.0 109.947 -173.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 50.8 t0 -147.4 131.54 17.35 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.084 0.954 . . . . 0.0 111.439 -179.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.406 ' HE1' ' HB2' ' A' ' 84' ' ' PHE . 65.6 mtt -132.3 6.03 4.14 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 114.526 1.306 . . . . 0.0 114.526 -171.199 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 66.6 m -63.44 155.87 27.83 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 121.313 -0.867 . . . . 0.0 111.591 174.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 24.1 p-10 -48.62 -43.41 36.28 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.288 1.218 . . . . 0.0 114.288 -176.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 62.1 mtpt -55.5 -38.02 68.64 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.858 1.263 . . . . 0.0 113.52 173.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.87 -40.73 96.39 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 119.26 0.936 . . . . 0.0 111.931 176.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -73.75 -45.96 48.64 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 C-N-CA 124.617 1.167 . . . . 0.0 109.73 -179.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 14.9 m-30 -56.93 -45.13 82.96 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 118.806 0.73 . . . . 0.0 112.61 175.094 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -74.51 -36.4 63.2 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.44 1.096 . . . . 0.0 111.99 -174.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 72.1 mtt85 -70.16 -40.28 74.83 Favored 'General case' 0 N--CA 1.484 1.229 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 169.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 35.3 m-85 -132.22 88.41 40.4 Favored Pre-proline 0 CA--C 1.546 0.792 0 C-N-CA 125.398 1.479 . . . . 0.0 110.87 -167.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -68.05 -19.96 44.88 Favored 'Trans proline' 0 CA--C 1.538 0.711 0 C-N-CA 122.795 2.33 . . . . 0.0 114.013 -170.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 8.4 p-80 -71.94 -23.63 61.49 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 123.619 0.767 . . . . 0.0 112.919 173.01 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -85.31 1.93 46.27 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 126.56 1.944 . . . . 0.0 113.593 -179.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? . . . . . 0 C--O 1.253 1.256 0 C-N-CA 125.715 1.606 . . . . 0.0 110.84 172.404 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.4 mtt . . . . . 0 N--CA 1.498 1.958 0 CA-C-O 120.148 0.023 . . . . 0.0 110.969 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 94.8 mtt-85 -129.69 165.5 21.71 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 125.886 1.674 . . . . 0.0 112.392 -179.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 92.98 142.2 11.38 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 125.751 1.643 . . . . 0.0 113.737 178.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 13.6 t -155.45 156.76 35.87 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.939 1.695 . . . . 0.0 110.947 178.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -135.31 154.7 51.44 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.202 1.401 . . . . 0.0 112.654 -175.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 33.1 t-80 -143.94 158.9 43.4 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.723 1.609 . . . . 0.0 111.387 179.444 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 25.4 p80 -141.34 161.57 37.57 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 125.03 1.332 . . . . 0.0 113.046 -175.186 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 62.3 m80 -135.74 153.69 51.48 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.096 1.359 . . . . 0.0 112.367 -172.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -147.78 146.93 29.37 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.129 1.372 . . . . 0.0 111.384 174.071 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 34.0 t-80 -148.49 136.16 20.66 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.823 1.249 . . . . 0.0 111.155 175.026 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -88.13 146.71 19.84 Favored Glycine 0 CA--C 1.538 1.486 0 C-N-CA 124.341 0.972 . . . . 0.0 113.985 -179.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 69.9 m -133.01 144.64 50.22 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.497 1.519 . . . . 0.0 111.748 179.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.6 p -152.2 146.3 15.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 C-N-CA 124.751 1.221 . . . . 0.0 111.803 179.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.1 p -148.01 149.92 33.03 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.74 1.616 . . . . 0.0 111.292 171.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -154.63 164.33 38.9 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.41 1.084 . . . . 0.0 112.756 -175.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 101.74 132.82 7.86 Favored Glycine 0 CA--C 1.535 1.317 0 C-N-CA 125.673 1.606 . . . . 0.0 113.908 173.347 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -155.24 154.65 28.94 Favored Pre-proline 0 CA--C 1.552 1.034 0 C-N-CA 126.321 1.849 . . . . 0.0 111.137 178.363 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo -69.9 153.1 68.67 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 123.142 2.562 . . . . 0.0 112.343 174.171 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 67.8 m -134.53 66.17 69.23 Favored Pre-proline 0 N--CA 1.477 0.894 0 C-N-CA 124.709 1.204 . . . . 0.0 112.445 -175.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -66.97 135.68 38.57 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 123.102 2.535 . . . . 0.0 111.567 175.301 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 90.0 mt -142.85 152.47 42.2 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.474 1.509 . . . . 0.0 112.158 -176.249 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 54.7 p -80.41 161.2 25.07 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.204 1.402 . . . . 0.0 112.353 169.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 88.6 p -145.96 -4.73 0.63 Allowed 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.565 1.32 . . . . 0.0 114.565 -178.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -121.6 -3.14 9.32 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 126.322 1.849 . . . . 0.0 114.765 -171.507 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 42.3 m -73.17 141.32 47.4 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.059 0.944 . . . . 0.0 113.481 -173.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 60.42 10.04 2.28 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 116.859 2.17 . . . . 0.0 116.859 171.453 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -69.46 -20.58 63.75 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 114.789 1.403 . . . . 0.0 114.789 -174.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -142.39 11.99 1.93 Allowed 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 124.991 1.317 . . . . 0.0 114.532 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 19.1 mt -137.85 127.22 34.45 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 124.797 1.239 . . . . 0.0 110.918 -172.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 15.1 t-20 41.91 50.17 4.11 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 126.697 1.999 . . . . 0.0 114.165 167.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 65.3 t80 -56.57 -51.61 67.97 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 -161.561 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 40.7 ttp -157.87 52.25 0.45 Allowed 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.654 1.182 . . . . 0.0 111.005 176.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 19.7 p -125.3 51.85 5.84 Favored Pre-proline 0 N--CA 1.484 1.235 0 N-CA-C 115.203 1.557 . . . . 0.0 115.203 -168.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -73.73 162.0 40.55 Favored 'Trans proline' 0 CA--C 1.551 1.337 0 C-N-CA 123.218 2.612 . . . . 0.0 112.583 170.244 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -72.22 167.03 27.98 Favored 'Trans proline' 0 CA--C 1.546 1.097 0 C-N-CA 123.628 2.886 . . . . 0.0 112.475 170.119 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -141.13 150.06 42.33 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.835 1.254 . . . . 0.0 112.895 176.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -166.12 167.18 16.54 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 126.315 1.846 . . . . 0.0 111.452 174.041 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -134.46 162.39 32.38 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 126.305 1.842 . . . . 0.0 110.711 175.167 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 51.76 55.91 8.62 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 125.937 1.695 . . . . 0.0 114.015 175.395 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -135.25 46.78 1.91 Allowed Pre-proline 0 CA--C 1.553 1.091 0 C-N-CA 124.884 1.274 . . . . 0.0 113.036 178.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -72.4 158.51 51.23 Favored 'Trans proline' 0 CA--C 1.542 0.891 0 C-N-CA 123.048 2.499 . . . . 0.0 112.909 -172.642 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 70.86 23.77 77.65 Favored Glycine 0 CA--C 1.539 1.555 0 C-N-CA 123.732 0.682 . . . . 0.0 114.795 177.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.16 113.94 5.51 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.72 1.208 . . . . 0.0 111.881 -177.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 97.1 mt -133.8 164.7 26.67 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 127.187 2.195 . . . . 0.0 110.83 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -121.33 122.25 39.45 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.328 1.051 . . . . 0.0 112.142 176.062 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -82.78 146.35 29.02 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.218 1.007 . . . . 0.0 110.898 167.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 61.5 mt -128.9 157.78 40.63 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.57 1.148 . . . . 0.0 112.712 -169.53 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 -80.8 141.62 34.53 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.074 0.95 . . . . 0.0 110.206 166.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -100.16 -13.1 19.08 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 114.811 1.411 . . . . 0.0 114.811 -171.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -149.56 167.74 25.46 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.586 1.154 . . . . 0.0 113.221 -172.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.69 -162.03 53.72 Favored Glycine 0 CA--C 1.541 1.704 0 C-N-CA 124.17 0.891 . . . . 0.0 113.916 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -67.52 -16.44 47.25 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 123.194 2.596 . . . . 0.0 113.649 -177.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 97.2 mt -92.68 4.22 54.12 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.756 1.222 . . . . 0.0 113.915 175.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.1 122.21 11.17 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 120.941 1.7 . . . . 0.0 112.139 -177.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 82.64 4.62 90.02 Favored Glycine 0 CA--C 1.539 1.593 0 C-N-CA 125.457 1.503 . . . . 0.0 115.372 -174.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.421 ' HB3' ' HD2' ' A' ' 73' ' ' PRO . 16.5 mt -102.1 159.86 28.12 Favored Pre-proline 0 CA--C 1.555 1.14 0 C-N-CA 126.15 1.78 . . . . 0.0 111.271 -179.172 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.421 ' HD2' ' HB3' ' A' ' 72' ' ' LEU . 74.4 Cg_endo -75.78 160.45 37.56 Favored 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 124.317 3.344 . . . . 0.0 113.884 -165.296 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 29.6 t -103.24 -32.01 2.99 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 178.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 18.1 p -124.51 170.42 10.91 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 125.181 1.393 . . . . 0.0 113.898 177.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 39.3 ttm180 -66.03 -34.58 78.42 Favored 'General case' 0 N--CA 1.48 1.046 0 O-C-N 121.019 -1.05 . . . . 0.0 111.113 178.359 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 34.2 m -61.51 -46.54 89.54 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.028 0.931 . . . . 0.0 111.255 168.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -60.22 -44.51 95.13 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 119.14 0.882 . . . . 0.0 111.426 176.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.39 -41.1 96.84 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.439 0.696 . . . . 0.0 112.538 178.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 20.7 ttp180 -67.88 -40.51 83.53 Favored 'General case' 0 N--CA 1.479 1.005 0 O-C-N 121.114 -0.991 . . . . 0.0 112.344 176.357 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 72.2 t -62.74 -45.18 99.47 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 C-N-CA 123.486 0.715 . . . . 0.0 110.799 175.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 23.7 mt -58.27 -49.05 78.5 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 118.389 -0.815 . . . . 0.0 112.193 173.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 51.9 mt -52.76 -52.12 30.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 CA-C-N 118.796 0.726 . . . . 0.0 110.043 176.012 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -65.95 -50.83 63.0 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 -176.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -68.57 -43.03 77.44 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 118.933 0.788 . . . . 0.0 112.511 -175.259 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -64.85 -45.88 84.23 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 118.639 -0.696 . . . . 0.0 110.48 175.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.413 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 68.1 t90 -58.98 -47.35 85.47 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-O 117.08 -1.438 . . . . 0.0 111.579 173.21 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -55.15 -49.32 72.11 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 121.329 1.877 . . . . 0.0 112.771 178.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -64.47 -51.73 61.57 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 121.124 -0.985 . . . . 0.0 112.427 179.015 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 10.3 mmm180 -58.22 -47.47 83.4 Favored 'General case' 0 C--O 1.213 -0.829 0 C-N-CA 123.114 0.566 . . . . 0.0 110.51 177.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 18.8 tptp -60.17 -37.33 79.85 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 125.936 1.695 . . . . 0.0 113.143 177.414 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 61.1 mtpt -62.89 -31.16 72.16 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 119.194 0.906 . . . . 0.0 111.866 170.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 68.7 m -83.15 -20.06 35.45 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 115.922 1.823 . . . . 0.0 115.922 165.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -145.16 77.81 12.72 Favored Pre-proline 0 N--CA 1.479 0.988 0 C-N-CA 127.06 2.144 . . . . 0.0 111.254 -162.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -56.77 -24.25 54.48 Favored 'Trans proline' 0 CA--C 1.546 1.077 0 C-N-CA 122.624 2.216 . . . . 0.0 114.756 -170.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 44.8 p90 -71.85 -6.55 42.54 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 116.043 1.868 . . . . 0.0 116.043 177.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 14.0 tp -70.58 131.83 44.57 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 120.981 1.719 . . . . 0.0 114.101 -170.444 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 41.4 ptt180 -87.79 160.07 18.18 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 124.904 1.282 . . . . 0.0 113.735 176.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.413 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.4 tm? -139.17 129.83 25.99 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.741 2.016 . . . . 0.0 109.995 -169.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -147.87 135.04 20.43 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.287 1.035 . . . . 0.0 111.332 178.147 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 63.8 mtt -129.82 1.48 4.87 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 114.731 1.382 . . . . 0.0 114.731 -169.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 66.2 m -62.36 151.1 37.74 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 119.057 0.844 . . . . 0.0 111.613 175.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 43.2 p-10 -50.74 -37.81 44.0 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 114.65 1.352 . . . . 0.0 114.65 -174.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt -52.97 -40.05 63.42 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.408 1.483 . . . . 0.0 113.167 173.317 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.5 -39.01 89.41 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 123.625 0.77 . . . . 0.0 112.042 176.226 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.6 mp -73.83 -45.19 50.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 C-N-CA 123.391 0.677 . . . . 0.0 109.3 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 9.9 m-30 -55.94 -44.51 78.45 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 118.779 0.718 . . . . 0.0 112.214 175.199 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.0 -39.72 55.19 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.975 1.31 . . . . 0.0 112.49 -174.497 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 94.5 mtt-85 -74.89 -36.52 62.24 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.888 0.875 . . . . 0.0 112.704 175.268 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 48.3 m-85 -131.68 75.92 75.56 Favored Pre-proline 0 CA--C 1.546 0.816 0 C-N-CA 125.958 1.703 . . . . 0.0 110.834 -170.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -66.12 -14.92 46.55 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.083 2.522 . . . . 0.0 114.031 -175.303 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 13.2 p-80 -73.52 -24.39 60.14 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.198 0.999 . . . . 0.0 113.279 171.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.71 -53.71 5.99 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.861 1.265 . . . . 0.0 112.061 -162.591 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 65.7 ttt-85 . . . . . 0 C--O 1.253 1.28 0 C-N-CA 126.635 1.974 . . . . 0.0 112.737 -176.181 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.497 1.903 0 N-CA-C 110.625 -0.139 . . . . 0.0 110.625 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 53.9 ptt85 -144.29 159.92 41.89 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 125.262 1.425 . . . . 0.0 112.946 179.271 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 139.75 133.45 3.01 Favored Glycine 0 CA--C 1.536 1.353 0 C-N-CA 125.623 1.582 . . . . 0.0 112.811 175.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 65.7 m -144.18 146.48 32.74 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.425 1.49 . . . . 0.0 111.766 -177.125 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 20.3 p80 -151.54 152.89 33.55 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.028 1.331 . . . . 0.0 112.093 174.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 54.8 t-80 -157.16 145.46 19.43 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.074 1.349 . . . . 0.0 111.602 175.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 51.9 p-80 -151.06 144.71 25.02 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.959 1.304 . . . . 0.0 111.482 168.26 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 38.0 t-80 -156.4 151.33 26.16 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.05 1.34 . . . . 0.0 111.285 174.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 24.8 p80 -153.21 166.31 32.95 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.538 1.135 . . . . 0.0 113.175 -178.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 60.1 m80 -133.73 149.33 51.48 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.842 1.657 . . . . 0.0 111.267 172.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 158.26 125.61 0.84 Allowed Glycine 0 CA--C 1.534 1.23 0 C-N-CA 124.119 0.866 . . . . 0.0 113.358 172.391 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 21.5 t -158.01 145.78 18.49 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.238 1.415 . . . . 0.0 111.256 174.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 48.3 t -138.98 130.23 34.85 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 C-N-CA 125.469 1.507 . . . . 0.0 109.777 177.112 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 68.4 m -140.26 135.87 32.73 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.024 1.329 . . . . 0.0 111.427 178.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -154.04 155.32 35.28 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.135 1.374 . . . . 0.0 111.69 176.281 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -172.41 130.1 1.85 Allowed Glycine 0 CA--C 1.533 1.216 0 C-N-CA 124.345 0.974 . . . . 0.0 112.421 171.067 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -146.65 61.32 6.7 Favored Pre-proline 0 CA--C 1.553 1.092 0 C-N-CA 124.91 1.284 . . . . 0.0 111.757 178.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -67.75 150.18 78.94 Favored 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 123.371 2.714 . . . . 0.0 112.834 -177.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 75.1 p -153.23 153.78 29.91 Favored Pre-proline 0 N--CA 1.474 0.757 0 C-N-CA 125.324 1.449 . . . . 0.0 112.131 178.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.11 152.08 67.35 Favored 'Trans proline' 0 CA--C 1.54 0.82 0 C-N-CA 123.106 2.537 . . . . 0.0 112.178 175.047 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 60.5 tp -146.82 134.78 21.41 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.747 1.219 . . . . 0.0 111.529 -179.297 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.8 t -151.47 146.2 25.75 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.981 1.312 . . . . 0.0 110.996 169.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 78.9 p -141.92 9.13 1.92 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.144 1.378 . . . . 0.0 113.987 -176.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -112.43 120.46 41.73 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.799 1.24 . . . . 0.0 112.34 -172.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 40.4 m -124.23 3.85 8.52 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.942 1.297 . . . . 0.0 113.755 176.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 58.09 17.03 4.19 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 126.452 1.901 . . . . 0.0 115.539 -178.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -76.12 -24.14 54.93 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 114.036 1.125 . . . . 0.0 114.036 -174.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -118.29 -0.22 11.55 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.702 1.601 . . . . 0.0 114.472 -179.218 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 13.3 mt -90.73 57.42 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 C-N-CA 124.78 1.232 . . . . 0.0 109.728 -173.23 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -91.68 -26.94 18.4 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.008 1.323 . . . . 0.0 113.484 -175.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 95.0 m-85 -93.67 133.69 36.76 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.161 0.984 . . . . 0.0 113.072 -171.129 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 40.3 tpp -149.78 34.93 0.68 Allowed 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.932 1.693 . . . . 0.0 110.097 171.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 3.4 p -140.04 68.78 35.09 Favored Pre-proline 0 N--CA 1.477 0.898 0 C-N-CA 125.033 1.333 . . . . 0.0 112.357 -153.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -65.94 158.63 53.09 Favored 'Trans proline' 0 CA--C 1.549 1.235 0 C-N-CA 123.204 2.603 . . . . 0.0 112.367 173.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -70.01 151.37 67.59 Favored 'Trans proline' 0 CA--C 1.542 0.88 0 C-N-CA 123.51 2.807 . . . . 0.0 113.036 179.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 -125.61 21.1 7.81 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 125.348 1.459 . . . . 0.0 112.809 -177.5 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 23.0 mm-40 -134.02 157.38 46.24 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.903 1.681 . . . . 0.0 111.746 -179.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -117.22 39.08 3.35 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.276 1.43 . . . . 0.0 111.909 -175.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 52.13 40.09 27.98 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 126.202 1.801 . . . . 0.0 114.766 175.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -144.1 49.14 1.0 Allowed Pre-proline 0 CA--C 1.552 1.038 0 C-N-CA 124.897 1.279 . . . . 0.0 112.839 -178.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -71.03 159.09 53.5 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 123.306 2.671 . . . . 0.0 112.823 -173.494 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 70.03 28.43 71.72 Favored Glycine 0 CA--C 1.537 1.463 0 C-N-CA 123.619 0.628 . . . . 0.0 114.233 179.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.35 119.94 11.27 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.933 1.293 . . . . 0.0 112.21 -176.025 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 94.3 mt -133.66 168.5 18.57 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 127.565 2.346 . . . . 0.0 110.64 177.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -128.66 142.13 51.12 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.285 1.034 . . . . 0.0 113.411 177.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -88.48 154.89 19.99 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.757 1.223 . . . . 0.0 111.114 164.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 91.6 mt -132.59 157.55 44.45 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.952 1.301 . . . . 0.0 112.112 -175.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -81.24 138.61 35.76 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.468 0.707 . . . . 0.0 109.974 163.218 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -97.26 -20.57 17.8 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 -174.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -140.66 165.47 27.4 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.211 1.405 . . . . 0.0 112.428 -171.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.17 -163.27 54.89 Favored Glycine 0 CA--C 1.54 1.648 0 C-N-CA 124.246 0.927 . . . . 0.0 114.13 178.115 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -67.74 -17.14 47.42 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 123.267 2.645 . . . . 0.0 113.833 -175.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.2 mt -94.08 5.95 50.09 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 124.612 1.165 . . . . 0.0 113.935 175.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.42 122.37 11.05 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 120.875 1.67 . . . . 0.0 112.123 -177.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.25 5.66 88.68 Favored Glycine 0 CA--C 1.541 1.718 0 C-N-CA 125.568 1.556 . . . . 0.0 115.469 -175.104 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.461 ' HB3' ' HD2' ' A' ' 73' ' ' PRO . 20.3 mt -104.02 160.71 25.2 Favored Pre-proline 0 CA--C 1.557 1.228 0 C-N-CA 126.348 1.859 . . . . 0.0 111.295 -179.481 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.461 ' HD2' ' HB3' ' A' ' 72' ' ' LEU . 60.8 Cg_endo -71.36 164.95 34.01 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 124.318 3.346 . . . . 0.0 113.408 -169.165 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.9 t -107.53 -29.58 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 O-C-N 121.324 -0.86 . . . . 0.0 112.468 175.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 22.1 p -125.73 172.12 10.07 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 125.31 1.444 . . . . 0.0 114.056 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 34.6 ptt-85 -63.42 -35.6 80.97 Favored 'General case' 0 N--CA 1.48 1.071 0 O-C-N 121.284 -0.885 . . . . 0.0 111.92 173.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 37.2 m -65.39 -44.08 88.62 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.971 0.909 . . . . 0.0 110.95 172.491 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 76.3 m-20 -60.52 -46.42 90.19 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 118.522 0.601 . . . . 0.0 111.066 175.043 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.94 -42.3 98.95 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.61 0.764 . . . . 0.0 112.611 179.512 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 62.8 ttp85 -64.55 -42.84 95.43 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 118.962 0.801 . . . . 0.0 112.234 175.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 54.5 t -62.39 -47.87 91.01 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 123.752 0.821 . . . . 0.0 111.078 176.128 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.2 mp -58.95 -48.63 80.82 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 118.519 -0.753 . . . . 0.0 112.791 175.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 55.2 mt -55.49 -51.03 61.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 CA-C-N 118.775 0.716 . . . . 0.0 110.173 176.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -65.62 -49.19 69.62 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -177.399 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -66.72 -46.61 74.97 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 118.986 0.812 . . . . 0.0 112.299 -177.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -60.31 -49.71 76.51 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 118.458 -0.782 . . . . 0.0 110.25 175.044 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.424 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 64.3 t90 -56.44 -47.12 79.78 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-O 117.719 -1.134 . . . . 0.0 112.116 176.385 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -57.15 -48.26 79.13 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 120.792 1.633 . . . . 0.0 113.078 178.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -68.92 -48.52 63.08 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 119.902 1.228 . . . . 0.0 112.399 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 34.2 mmt180 -60.54 -39.62 88.57 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.673 0.789 . . . . 0.0 110.175 178.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -72.64 -30.13 64.04 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 125.057 1.343 . . . . 0.0 113.581 176.302 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.7 mmtp -62.29 -31.46 72.06 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 120.135 1.334 . . . . 0.0 111.412 165.412 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 60.2 m -80.0 -25.76 40.16 Favored 'General case' 0 N--CA 1.483 1.193 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 165.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -139.85 78.58 24.87 Favored Pre-proline 0 N--CA 1.478 0.961 0 C-N-CA 126.775 2.03 . . . . 0.0 111.667 -168.41 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -59.93 -11.78 16.43 Favored 'Trans proline' 0 CA--C 1.546 1.121 0 C-N-CA 123.539 2.826 . . . . 0.0 116.495 -166.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 40.6 p90 -85.08 -7.11 59.24 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 126.778 2.031 . . . . 0.0 115.21 176.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.4 tp -62.32 137.73 58.31 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 114.515 1.302 . . . . 0.0 114.515 -167.56 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 30.1 mmm180 -83.83 154.74 23.33 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 125.258 1.423 . . . . 0.0 113.113 179.107 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.424 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -137.62 130.35 29.98 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.826 2.05 . . . . 0.0 109.671 -175.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 59.2 t0 -143.74 129.61 19.43 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.011 0.924 . . . . 0.0 111.004 176.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 66.1 mtt -124.98 13.54 8.45 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.476 1.511 . . . . 0.0 112.952 -179.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 38.8 t -59.9 148.45 34.91 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.568 -0.707 . . . . 0.0 110.906 170.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -54.66 -35.25 63.33 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.21 -0.931 . . . . 0.0 112.437 -178.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 64.4 mttp -60.3 -36.19 77.33 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.369 1.067 . . . . 0.0 113.039 175.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.49 -41.06 98.55 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 118.95 0.795 . . . . 0.0 111.429 174.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.79 -46.91 59.16 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 C-N-CA 123.791 0.837 . . . . 0.0 109.758 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 16.9 m-30 -55.08 -46.42 75.44 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 118.89 0.768 . . . . 0.0 112.575 175.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.7 tmt_? -76.71 -38.47 54.27 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.508 1.123 . . . . 0.0 112.332 -172.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 19.9 ttm180 -75.9 -37.13 59.12 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.804 0.842 . . . . 0.0 112.646 175.328 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 34.9 m-85 -128.1 82.81 67.73 Favored Pre-proline 0 CA--C 1.547 0.864 0 C-N-CA 126.13 1.772 . . . . 0.0 110.648 -173.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -66.01 -19.68 57.63 Favored 'Trans proline' 0 CA--C 1.539 0.738 0 C-N-CA 122.971 2.447 . . . . 0.0 114.174 -172.051 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 8.1 p-80 -72.09 -20.6 61.62 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.917 0.887 . . . . 0.0 113.294 172.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -91.88 -0.91 57.52 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 127.015 2.126 . . . . 0.0 113.578 -178.531 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.231 0 C-N-CA 124.769 1.228 . . . . 0.0 111.211 170.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.0 ttt . . . . . 0 N--CA 1.495 1.803 0 N-CA-C 110.66 -0.126 . . . . 0.0 110.66 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 16.2 ptm180 -88.13 162.98 16.43 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 124.528 1.131 . . . . 0.0 113.636 -179.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 85.16 148.06 9.79 Favored Glycine 0 CA--C 1.537 1.447 0 C-N-CA 125.462 1.506 . . . . 0.0 114.379 177.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.6 t -157.58 166.62 32.41 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.079 1.752 . . . . 0.0 110.883 177.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 52.4 p-80 -141.19 151.38 43.77 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.271 1.428 . . . . 0.0 112.548 179.254 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 63.6 m80 -143.11 157.43 44.53 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.441 1.496 . . . . 0.0 111.915 -174.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 21.5 p80 -147.01 160.02 42.87 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.998 1.319 . . . . 0.0 111.878 173.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 65.1 m80 -140.02 153.02 46.7 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.198 1.399 . . . . 0.0 111.807 -176.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 55.3 p-80 -148.51 165.51 30.99 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.17 1.388 . . . . 0.0 112.548 -179.374 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 54.5 p-80 -145.54 163.61 34.21 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.767 1.627 . . . . 0.0 111.76 178.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 175.37 -175.28 47.17 Favored Glycine 0 CA--C 1.537 1.414 0 C-N-CA 123.958 0.789 . . . . 0.0 114.337 179.306 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 64.1 m -133.36 161.06 35.53 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.923 1.689 . . . . 0.0 111.784 -178.498 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 27.0 m -126.7 155.38 37.28 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 125.221 1.408 . . . . 0.0 112.547 -178.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 79.8 p -145.02 155.7 43.51 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.689 1.595 . . . . 0.0 111.988 177.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 51.1 p90 -153.54 165.58 35.42 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.057 1.343 . . . . 0.0 112.535 -175.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 81.94 162.53 30.41 Favored Glycine 0 CA--C 1.538 1.507 0 C-N-CA 124.992 1.282 . . . . 0.0 114.742 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -152.34 154.15 31.71 Favored Pre-proline 0 CA--C 1.55 0.97 0 C-N-CA 125.852 1.661 . . . . 0.0 111.723 -179.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -69.44 160.35 50.13 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 123.353 2.702 . . . . 0.0 112.447 174.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 37.2 p -132.62 56.43 22.62 Favored Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 125.158 1.383 . . . . 0.0 113.98 -173.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -68.03 156.09 67.14 Favored 'Trans proline' 0 CA--C 1.542 0.925 0 C-N-CA 123.368 2.712 . . . . 0.0 112.891 178.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.5 pp -146.12 157.53 43.85 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.548 1.539 . . . . 0.0 111.784 173.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 83.5 p -140.0 -11.3 1.13 Allowed 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 115.876 1.806 . . . . 0.0 115.876 -173.112 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.2 t -152.92 154.1 34.36 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.409 1.084 . . . . 0.0 112.616 -178.187 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -129.95 9.42 5.34 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 127.233 2.213 . . . . 0.0 113.257 179.443 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 6.9 t -142.77 -178.53 5.84 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.272 1.429 . . . . 0.0 113.067 -172.136 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 56.23 50.02 14.22 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 126.315 1.846 . . . . 0.0 113.3 -179.349 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 25.8 m-20 -76.69 56.34 1.14 Allowed 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.536 1.535 . . . . 0.0 111.702 174.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 57.06 29.84 17.19 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 126.57 1.948 . . . . 0.0 114.16 -176.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 1.4 pp -68.66 -3.05 2.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 N-CA-C 116.0 1.852 . . . . 0.0 116.0 -169.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 -84.69 2.03 43.69 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 124.907 1.283 . . . . 0.0 113.982 175.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 37.3 p90 -55.13 -26.8 40.85 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 115.46 1.652 . . . . 0.0 115.46 -174.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 25.6 ptp -76.42 -2.83 33.91 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 115.769 1.766 . . . . 0.0 115.769 -167.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.0 t -137.04 75.48 47.71 Favored Pre-proline 0 N--CA 1.478 0.949 0 C-N-CA 124.165 0.986 . . . . 0.0 112.745 -176.226 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -71.19 152.34 61.72 Favored 'Trans proline' 0 CA--C 1.549 1.264 0 C-N-CA 123.193 2.595 . . . . 0.0 112.086 173.365 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -77.14 140.03 19.52 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 123.243 2.629 . . . . 0.0 112.881 -177.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -147.94 1.75 0.67 Allowed 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -105.33 6.61 32.86 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 114.609 1.337 . . . . 0.0 114.609 -160.167 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -133.91 134.83 43.11 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.908 1.283 . . . . 0.0 111.434 -178.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 49.77 44.16 24.83 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 125.982 1.713 . . . . 0.0 114.039 177.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -144.69 55.24 3.05 Favored Pre-proline 0 CA--C 1.551 0.987 0 C-N-CA 124.365 1.066 . . . . 0.0 111.88 -172.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -75.55 131.11 13.33 Favored 'Trans proline' 0 CA--C 1.542 0.877 0 C-N-CA 122.871 2.381 . . . . 0.0 112.099 -171.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 61.55 -158.94 31.22 Favored Glycine 0 CA--C 1.54 1.627 0 C-N-CA 124.043 0.83 . . . . 0.0 113.872 -175.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -141.49 93.04 2.52 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.23 1.012 . . . . 0.0 111.52 172.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 5.1 mp -134.35 150.39 50.92 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 126.524 1.929 . . . . 0.0 110.386 176.266 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -140.45 130.19 24.39 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.928 0.891 . . . . 0.0 112.266 173.227 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -85.32 159.13 20.1 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.774 1.23 . . . . 0.0 111.294 167.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 95.1 mt -133.94 157.02 47.07 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.871 1.269 . . . . 0.0 112.529 -174.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 -82.09 140.31 33.92 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 123.908 0.883 . . . . 0.0 109.944 163.205 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -98.19 -20.3 17.36 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 -174.423 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -140.45 165.13 28.28 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.124 1.369 . . . . 0.0 112.492 -171.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 72.92 -162.93 54.9 Favored Glycine 0 CA--C 1.541 1.674 0 C-N-CA 124.2 0.905 . . . . 0.0 114.074 178.4 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -67.54 -17.0 48.36 Favored 'Trans proline' 0 CA--C 1.541 0.865 0 C-N-CA 123.325 2.683 . . . . 0.0 113.763 -176.243 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.0 mt -93.85 5.66 50.93 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.701 1.2 . . . . 0.0 113.915 175.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.86 121.53 9.46 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 120.823 1.647 . . . . 0.0 111.909 -178.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.37 8.09 85.61 Favored Glycine 0 CA--C 1.54 1.631 0 C-N-CA 125.358 1.456 . . . . 0.0 115.5 -174.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.43 ' HB3' ' HD2' ' A' ' 73' ' ' PRO . 18.3 mt -107.84 159.51 30.19 Favored Pre-proline 0 CA--C 1.558 1.258 0 C-N-CA 126.42 1.888 . . . . 0.0 111.469 -179.176 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.43 ' HD2' ' HB3' ' A' ' 72' ' ' LEU . 58.3 Cg_endo -71.75 166.27 30.0 Favored 'Trans proline' 0 C--N 1.354 0.853 0 C-N-CA 124.655 3.57 . . . . 0.0 113.968 -169.322 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 5.7 t -111.58 -26.35 3.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 123.856 0.862 . . . . 0.0 112.486 177.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 29.8 p -127.87 172.6 10.72 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 125.296 1.439 . . . . 0.0 114.236 179.478 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -68.51 -36.93 79.57 Favored 'General case' 0 N--CA 1.482 1.157 0 O-C-N 121.167 -0.958 . . . . 0.0 111.358 176.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 10.2 p -63.56 -42.6 98.34 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 118.492 -0.765 . . . . 0.0 111.761 169.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 84.5 m-20 -58.37 -50.98 71.73 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 119.582 1.083 . . . . 0.0 110.809 173.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.01 -41.19 97.8 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.565 0.746 . . . . 0.0 112.531 -178.229 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 33.6 ttt85 -65.58 -43.58 89.3 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.08 0.952 . . . . 0.0 112.063 177.513 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 70.4 t -64.47 -45.79 94.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 C-N-CA 123.756 0.822 . . . . 0.0 111.227 175.538 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 54.6 mt -61.28 -43.92 98.09 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 118.309 -0.853 . . . . 0.0 112.406 176.414 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 47.7 mt -55.5 -51.57 56.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 CA-C-N 119.143 0.883 . . . . 0.0 109.949 173.28 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -63.3 -46.97 84.25 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -178.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 55.4 m-20 -68.91 -45.9 69.67 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.84 0.856 . . . . 0.0 112.189 -177.131 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -63.62 -46.45 85.66 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 119.131 -0.461 . . . . 0.0 110.793 177.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.434 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 66.8 t90 -60.03 -46.04 90.83 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-O 117.657 -1.163 . . . . 0.0 111.658 172.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -56.19 -45.72 79.68 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 120.873 1.67 . . . . 0.0 112.877 179.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -67.75 -52.06 41.89 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 119.644 1.111 . . . . 0.0 112.401 177.103 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 13.1 mmm180 -56.84 -48.41 78.12 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 121.759 -0.588 . . . . 0.0 110.626 178.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.9 tmtt? -67.21 -30.14 69.99 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.593 1.557 . . . . 0.0 113.562 178.435 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -60.77 -36.52 79.15 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 120.293 1.406 . . . . 0.0 111.096 166.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 64.9 m -79.95 -20.69 45.03 Favored 'General case' 0 N--CA 1.482 1.166 0 N-CA-C 115.343 1.609 . . . . 0.0 115.343 167.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -141.5 73.34 24.82 Favored Pre-proline 0 CA--C 1.548 0.894 0 C-N-CA 127.084 2.153 . . . . 0.0 111.469 -166.078 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -61.31 -7.98 9.52 Favored 'Trans proline' 0 CA--C 1.546 1.084 0 C-N-CA 123.744 2.963 . . . . 0.0 116.325 -166.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 41.2 p90 -84.64 -10.17 57.58 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.586 1.954 . . . . 0.0 114.88 174.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 16.5 tp -65.48 135.47 55.21 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 119.862 1.21 . . . . 0.0 113.952 -167.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -83.57 156.08 22.95 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.761 1.225 . . . . 0.0 113.021 178.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.434 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -137.23 130.98 31.75 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 127.027 2.131 . . . . 0.0 109.228 -174.23 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -137.81 129.66 28.57 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.233 1.013 . . . . 0.0 110.829 178.062 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 63.8 mtt -126.72 16.21 7.5 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.469 1.508 . . . . 0.0 113.53 -178.077 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 47.6 t -63.3 148.97 46.81 Favored 'General case' 0 N--CA 1.47 0.575 0 O-C-N 121.573 -0.704 . . . . 0.0 110.615 165.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -56.51 -32.02 64.67 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 121.118 -0.989 . . . . 0.0 112.329 178.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 60.3 mtpt -59.78 -33.43 71.69 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.31 1.044 . . . . 0.0 112.997 174.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.27 -40.81 97.46 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 119.161 0.891 . . . . 0.0 111.486 173.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.87 -46.99 58.21 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 C-N-CA 123.814 0.846 . . . . 0.0 109.405 179.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.7 m-30 -56.24 -45.54 79.94 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 118.759 0.708 . . . . 0.0 112.568 176.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.09 -38.55 52.13 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 124.409 1.084 . . . . 0.0 112.121 -173.589 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 62.1 ttm-85 -75.61 -35.57 60.49 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.934 0.893 . . . . 0.0 112.494 175.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 46.7 m-85 -128.53 82.93 67.61 Favored Pre-proline 0 CA--C 1.546 0.795 0 C-N-CA 126.088 1.755 . . . . 0.0 110.724 -174.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -66.03 -18.54 57.06 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 123.088 2.526 . . . . 0.0 114.092 -172.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . 0.452 ' CE1' HD23 ' A' ' 113' ' ' LEU . 7.8 p-80 -73.83 -21.63 60.06 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.022 0.929 . . . . 0.0 113.333 173.009 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.452 HD23 ' CE1' ' A' ' 112' ' ' HIS . 0.1 OUTLIER -90.17 -8.36 51.38 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 126.113 1.765 . . . . 0.0 113.86 -173.163 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? . . . . . 0 C--O 1.254 1.311 0 C-N-CA 125.109 1.363 . . . . 0.0 110.977 175.418 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.3 mtt . . . . . 0 N--CA 1.499 1.986 0 N-CA-C 110.414 -0.217 . . . . 0.0 110.414 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 74.7 ttt180 -148.96 151.23 34.24 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 125.074 1.35 . . . . 0.0 111.981 -178.279 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 87.86 151.38 21.83 Favored Glycine 0 CA--C 1.537 1.425 0 C-N-CA 125.378 1.466 . . . . 0.0 114.378 176.625 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 77.4 p -157.01 163.54 38.98 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 125.908 1.683 . . . . 0.0 112.285 -177.391 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -145.6 134.97 23.06 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.001 1.32 . . . . 0.0 111.243 177.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 50.8 m80 -138.78 1.12 2.07 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.604 1.162 . . . . 0.0 114.103 -176.293 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 46.8 m80 -75.19 139.6 42.75 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.474 1.11 . . . . 0.0 112.748 -167.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 15.8 t60 -151.22 166.44 30.87 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.124 1.37 . . . . 0.0 111.982 -175.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 20.2 p80 -140.23 154.16 46.79 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.535 1.534 . . . . 0.0 112.348 178.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 28.8 p80 -150.16 167.04 28.02 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.829 1.251 . . . . 0.0 112.923 -175.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 83.19 159.93 28.46 Favored Glycine 0 CA--C 1.538 1.48 0 C-N-CA 124.985 1.279 . . . . 0.0 114.667 179.539 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 12.3 t -155.16 158.33 38.78 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.579 1.552 . . . . 0.0 111.458 179.08 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.1 p -149.11 146.67 17.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 125.308 1.443 . . . . 0.0 111.503 178.1 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.1 m -132.08 132.74 43.6 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.17 1.388 . . . . 0.0 111.013 177.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 54.6 p90 -154.93 162.86 40.96 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.084 1.354 . . . . 0.0 112.445 -177.141 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 173.6 147.66 6.06 Favored Glycine 0 CA--C 1.536 1.383 0 C-N-CA 124.693 1.14 . . . . 0.0 113.171 174.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -147.29 60.58 5.71 Favored Pre-proline 0 CA--C 1.554 1.122 0 C-N-CA 124.712 1.205 . . . . 0.0 112.534 -179.459 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -67.82 152.22 77.66 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 123.356 2.704 . . . . 0.0 112.586 179.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 9.3 t -147.3 73.52 11.88 Favored Pre-proline 0 N--CA 1.475 0.802 0 C-N-CA 124.548 1.139 . . . . 0.0 111.379 177.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -73.17 155.3 52.06 Favored 'Trans proline' 0 CA--C 1.542 0.896 0 C-N-CA 123.621 2.881 . . . . 0.0 112.824 -179.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -150.27 154.73 38.4 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.496 1.518 . . . . 0.0 112.307 174.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 32.9 m -127.24 -4.3 6.17 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 115.088 1.514 . . . . 0.0 115.088 -173.158 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 49.5 m -142.24 150.94 41.58 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.859 1.264 . . . . 0.0 112.606 -172.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -151.41 137.8 18.55 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.11 1.364 . . . . 0.0 111.467 177.333 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 75.6 p -111.25 -7.17 14.45 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 125.415 1.486 . . . . 0.0 114.801 -178.224 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -67.71 -12.3 60.21 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 -173.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -68.68 -21.81 64.41 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.683 1.193 . . . . 0.0 113.543 172.722 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -119.54 -14.85 9.08 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.511 1.524 . . . . 0.0 113.605 177.253 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 33.0 mt -120.04 77.78 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 126.516 1.926 . . . . 0.0 108.697 -179.615 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -111.37 -6.18 14.53 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 114.698 1.37 . . . . 0.0 114.698 -168.076 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 56.8 t80 -138.79 134.25 33.18 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.473 1.509 . . . . 0.0 112.118 -178.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 10.4 tpt -155.86 35.65 0.35 Allowed 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.101 1.361 . . . . 0.0 111.67 172.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 13.4 p -129.65 65.02 73.83 Favored Pre-proline 0 N--CA 1.482 1.162 0 C-N-CA 124.486 1.114 . . . . 0.0 113.974 -163.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -66.27 161.52 40.17 Favored 'Trans proline' 0 CA--C 1.551 1.331 0 C-N-CA 123.44 2.76 . . . . 0.0 112.52 171.28 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -67.22 148.72 81.0 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 123.472 2.782 . . . . 0.0 112.991 178.448 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -106.68 -5.5 18.55 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 114.516 1.302 . . . . 0.0 114.516 -171.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -138.23 128.78 26.4 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.565 1.146 . . . . 0.0 112.155 -175.391 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -159.46 165.58 32.79 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 126.446 1.899 . . . . 0.0 111.148 174.217 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 50.77 50.04 19.8 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 125.706 1.602 . . . . 0.0 115.015 168.056 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 7.2 tp-100 -139.6 66.65 35.68 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 124.766 1.227 . . . . 0.0 110.416 178.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -83.22 157.57 14.98 Favored 'Trans proline' 0 CA--C 1.542 0.92 0 C-N-CA 123.531 2.82 . . . . 0.0 113.778 -167.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 76.35 163.49 15.83 Favored Glycine 0 CA--C 1.539 1.564 0 C-N-CA 125.243 1.401 . . . . 0.0 115.308 176.046 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -151.55 141.64 22.19 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.235 1.414 . . . . 0.0 111.707 176.133 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 5.0 mp -136.74 157.24 47.21 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.978 1.711 . . . . 0.0 110.902 176.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -132.19 128.31 37.71 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.419 1.087 . . . . 0.0 111.885 169.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -85.04 156.89 20.91 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.539 1.136 . . . . 0.0 111.443 168.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 98.2 mt -131.97 156.27 46.49 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.028 1.331 . . . . 0.0 112.381 -175.259 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 84.9 m-70 -83.04 142.82 31.04 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.057 0.943 . . . . 0.0 109.755 163.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -103.14 -18.17 15.05 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 114.695 1.368 . . . . 0.0 114.695 -172.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -139.8 163.05 33.65 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.114 1.365 . . . . 0.0 112.459 -172.369 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.05 -160.91 54.12 Favored Glycine 0 CA--C 1.539 1.572 0 C-N-CA 124.137 0.875 . . . . 0.0 114.001 178.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -67.63 -16.4 46.7 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 123.339 2.693 . . . . 0.0 113.763 -176.536 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 98.6 mt -92.95 4.87 53.2 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.647 1.179 . . . . 0.0 113.807 174.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.84 114.0 2.33 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 121.233 1.833 . . . . 0.0 111.91 -179.081 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.68 5.86 68.41 Favored Glycine 0 CA--C 1.543 1.785 0 C-N-CA 125.322 1.439 . . . . 0.0 115.57 -173.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 6.0 mp -104.97 156.24 36.35 Favored Pre-proline 0 CA--C 1.556 1.191 0 C-N-CA 126.807 2.043 . . . . 0.0 111.63 178.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -67.87 163.29 36.09 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 124.912 3.741 . . . . 0.0 113.987 -170.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.8 t -105.42 -30.18 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 O-C-N 121.373 -0.829 . . . . 0.0 112.319 175.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 17.8 p -125.87 170.05 12.03 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 125.235 1.414 . . . . 0.0 114.266 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 37.5 ttt180 -62.07 -39.13 91.36 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.593 1.157 . . . . 0.0 111.084 174.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 18.5 t -62.62 -46.71 87.01 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.843 0.857 . . . . 0.0 111.101 171.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 78.5 m-20 -57.99 -48.94 78.51 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 118.852 0.751 . . . . 0.0 111.069 176.284 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.58 -42.87 97.56 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -179.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 70.2 ttp85 -67.07 -41.99 85.46 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 121.199 -0.938 . . . . 0.0 112.597 176.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 78.5 t -63.84 -43.4 97.84 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.034 0 C-N-CA 123.603 0.761 . . . . 0.0 111.14 175.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 55.1 mt -60.49 -47.19 87.21 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 118.169 -0.92 . . . . 0.0 112.102 175.062 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 60.6 mt -53.4 -50.28 49.2 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 CA-C-N 119.064 0.847 . . . . 0.0 110.111 173.619 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.414 ' HB2' ' HE1' ' A' ' 101' ' ' MET . 12.3 t80 -62.89 -51.16 68.06 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 112.916 0.709 . . . . 0.0 112.916 -178.135 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -70.87 -41.44 71.37 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -174.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 57.4 mm-40 -58.7 -53.52 57.41 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 118.574 -0.727 . . . . 0.0 110.057 169.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.42 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 61.4 t90 -55.9 -44.58 78.35 Favored 'General case' 0 C--O 1.218 -0.577 0 CA-C-O 117.444 -1.265 . . . . 0.0 112.081 178.124 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -56.33 -51.05 69.66 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 120.755 1.616 . . . . 0.0 112.856 176.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -68.13 -45.29 74.02 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 119.879 1.218 . . . . 0.0 112.618 179.469 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 31.4 mmt180 -59.79 -44.48 93.92 Favored 'General case' 0 C--O 1.218 -0.583 0 C-N-CA 123.773 0.829 . . . . 0.0 109.952 177.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -63.69 -36.55 84.21 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 126.055 1.742 . . . . 0.0 112.819 175.329 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -62.3 -30.82 71.41 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 119.381 0.992 . . . . 0.0 111.845 170.012 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 68.4 m -82.91 -20.97 34.38 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 115.44 1.644 . . . . 0.0 115.44 166.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -140.53 79.0 20.86 Favored Pre-proline 0 CA--C 1.547 0.86 0 C-N-CA 127.077 2.151 . . . . 0.0 111.419 -167.346 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -63.81 6.03 0.31 Allowed 'Trans proline' 0 CA--C 1.55 1.311 0 C-N-CA 124.252 3.301 . . . . 0.0 116.878 -169.184 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 40.5 p90 -103.55 -6.76 21.4 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 127.402 2.281 . . . . 0.0 114.668 175.425 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 13.7 tp -64.82 135.5 55.85 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 -165.381 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 85.0 mtp180 -86.21 156.57 20.25 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.593 1.557 . . . . 0.0 113.063 178.597 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.42 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -138.38 131.49 30.02 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.726 2.01 . . . . 0.0 110.043 -173.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 33.3 t0 -146.6 135.96 22.83 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.066 0.946 . . . . 0.0 111.432 177.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.414 ' HE1' ' HB2' ' A' ' 84' ' ' PHE . 66.3 mtt -133.3 3.41 3.64 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 114.467 1.284 . . . . 0.0 114.467 -173.503 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 72.5 m -60.6 145.05 50.33 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 119.166 0.894 . . . . 0.0 110.96 173.082 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.416 ' HA ' HG12 ' A' ' 106' ' ' ILE . 17.2 m-20 -61.82 -25.39 67.47 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 114.813 1.412 . . . . 0.0 114.813 -163.137 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -56.11 -38.38 70.69 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.091 0.956 . . . . 0.0 112.719 171.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.77 -35.75 75.28 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 123.8 0.84 . . . . 0.0 112.05 172.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.416 HG12 ' HA ' ' A' ' 103' ' ' ASP . 4.8 mm -78.35 -43.61 26.88 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 C-N-CA 123.85 0.86 . . . . 0.0 109.544 -175.052 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -59.5 -43.53 93.33 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.255 0.622 . . . . 0.0 111.932 173.463 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.72 -39.27 57.63 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.52 1.128 . . . . 0.0 112.774 -174.52 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 88.2 mtt-85 -69.63 -40.3 76.62 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.749 0.82 . . . . 0.0 112.478 172.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -127.67 77.89 75.57 Favored Pre-proline 0 CA--C 1.544 0.748 0 C-N-CA 125.094 1.358 . . . . 0.0 111.142 -168.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -68.02 -10.1 27.82 Favored 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 123.389 2.726 . . . . 0.0 114.097 -175.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 14.2 p-80 -78.9 -21.9 46.7 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.144 0.977 . . . . 0.0 113.469 169.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -89.7 -32.52 16.99 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.774 1.63 . . . . 0.0 112.462 -168.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 . . . . . 0 C--O 1.254 1.335 0 C-N-CA 124.723 1.209 . . . . 0.0 113.715 174.811 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.5 mpp? . . . . . 0 N--CA 1.497 1.91 0 CA-C-O 120.7 0.286 . . . . 0.0 111.486 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 14.0 ptt180 -69.19 152.47 45.05 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 125.314 1.445 . . . . 0.0 113.657 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 171.46 116.48 0.39 Allowed Glycine 0 CA--C 1.534 1.232 0 C-N-CA 125.018 1.294 . . . . 0.0 112.26 176.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 78.7 p -110.94 -0.29 16.82 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 125.48 1.512 . . . . 0.0 114.601 -173.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -120.75 148.39 44.04 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.628 1.571 . . . . 0.0 112.344 -177.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 53.6 p-80 -148.38 160.5 42.95 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.97 1.708 . . . . 0.0 111.683 178.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 39.8 t-80 -143.45 152.68 41.82 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.552 1.141 . . . . 0.0 111.723 175.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 46.2 p-80 -87.92 -18.74 28.49 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 115.003 1.483 . . . . 0.0 115.003 -172.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 58.0 t-80 -95.9 135.65 37.37 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 119.169 0.895 . . . . 0.0 113.261 -173.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 64.5 t60 -155.58 150.21 26.19 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.598 1.559 . . . . 0.0 111.132 169.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 158.44 160.34 10.23 Favored Glycine 0 CA--C 1.535 1.322 0 C-N-CA 124.503 1.049 . . . . 0.0 114.264 173.639 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.7 t -153.63 145.03 23.11 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.065 1.346 . . . . 0.0 111.816 173.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.9 m -131.47 11.47 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 C-N-CA 125.809 1.644 . . . . 0.0 112.99 178.252 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 40.0 m -82.37 54.24 2.52 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 125.678 1.591 . . . . 0.0 113.276 -169.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 82.4 m-85 -133.72 166.13 23.33 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.907 1.683 . . . . 0.0 112.99 -172.114 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 104.87 107.38 3.21 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 125.732 1.635 . . . . 0.0 112.77 178.409 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -153.39 153.06 28.75 Favored Pre-proline 0 CA--C 1.552 1.037 0 C-N-CA 126.157 1.783 . . . . 0.0 111.049 177.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -71.17 140.94 38.48 Favored 'Trans proline' 0 CA--C 1.543 0.957 0 C-N-CA 123.148 2.565 . . . . 0.0 112.373 177.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 71.2 m -138.82 63.57 32.31 Favored Pre-proline 0 N--CA 1.477 0.888 0 C-N-CA 125.193 1.397 . . . . 0.0 111.847 -179.388 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -67.78 131.7 24.88 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 C-N-CA 123.337 2.691 . . . . 0.0 112.387 -177.071 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 62.3 tp -155.76 134.2 11.67 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.309 1.443 . . . . 0.0 111.051 178.265 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 31.6 t -154.83 131.35 10.54 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.648 1.179 . . . . 0.0 111.22 170.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.3 t -158.99 82.52 0.79 Allowed 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.849 1.259 . . . . 0.0 110.416 175.166 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -140.62 -11.81 1.02 Allowed 'General case' 0 N--CA 1.479 1.016 0 N-CA-C 115.797 1.777 . . . . 0.0 115.797 -174.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 21.3 t -65.39 111.98 3.31 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 119.516 1.053 . . . . 0.0 111.407 -171.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 53.63 20.46 2.17 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 125.867 1.667 . . . . 0.0 114.583 -173.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -75.3 -27.45 59.34 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 -169.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -137.82 12.22 2.91 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 125.893 1.677 . . . . 0.0 113.898 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 23.2 mm -87.93 67.64 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 124.495 1.118 . . . . 0.0 110.484 -170.519 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 64.4 t-20 -146.74 127.63 14.46 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.585 1.554 . . . . 0.0 110.73 177.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 21.0 t80 -133.87 14.29 3.97 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.898 1.279 . . . . 0.0 113.292 177.075 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 23.7 ptp -104.63 3.03 31.2 Favored 'General case' 0 N--CA 1.48 1.028 0 N-CA-C 115.041 1.497 . . . . 0.0 115.041 -171.564 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.9 t -142.0 74.25 21.88 Favored Pre-proline 0 N--CA 1.477 0.891 0 C-N-CA 124.433 1.093 . . . . 0.0 111.675 179.052 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -70.97 156.84 59.47 Favored 'Trans proline' 0 CA--C 1.55 1.281 0 C-N-CA 123.39 2.727 . . . . 0.0 112.488 177.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -71.09 153.55 62.71 Favored 'Trans proline' 0 CA--C 1.542 0.916 0 C-N-CA 123.588 2.858 . . . . 0.0 112.869 178.372 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -126.49 9.46 7.17 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 124.555 1.142 . . . . 0.0 113.957 -176.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 18.9 mm100 -131.59 151.73 51.36 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.732 1.613 . . . . 0.0 112.054 -179.718 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -150.72 165.21 34.15 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.707 2.003 . . . . 0.0 110.883 174.3 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 51.72 41.53 29.11 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 125.503 1.521 . . . . 0.0 114.646 176.363 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -141.96 58.5 8.14 Favored Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 125.44 1.496 . . . . 0.0 109.692 179.564 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -72.34 151.9 54.63 Favored 'Trans proline' 0 CA--C 1.542 0.897 0 C-N-CA 123.245 2.63 . . . . 0.0 112.433 -170.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 74.71 -39.39 1.1 Allowed Glycine 0 CA--C 1.539 1.539 0 C-N-CA 125.808 1.671 . . . . 0.0 114.791 -176.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . 58.64 25.88 13.82 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 126.718 2.007 . . . . 0.0 115.87 176.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 11.0 mp -73.21 153.3 40.73 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.749 1.22 . . . . 0.0 111.643 171.052 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -146.43 153.09 40.06 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.894 1.678 . . . . 0.0 112.661 173.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -96.7 149.07 22.22 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.064 1.346 . . . . 0.0 112.401 174.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 89.5 mt -128.29 157.39 41.07 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.694 1.597 . . . . 0.0 111.741 -179.293 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -77.46 140.02 39.75 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.898 0.879 . . . . 0.0 110.479 167.195 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -99.1 -12.39 20.55 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 -174.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -149.49 168.16 24.24 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.786 1.235 . . . . 0.0 113.211 -172.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.78 -164.47 54.14 Favored Glycine 0 CA--C 1.54 1.615 0 C-N-CA 124.151 0.882 . . . . 0.0 114.094 179.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -67.72 -16.82 47.14 Favored 'Trans proline' 0 CA--C 1.542 0.925 0 C-N-CA 123.254 2.636 . . . . 0.0 113.674 -177.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.1 mt -92.49 4.42 53.55 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.784 1.234 . . . . 0.0 113.877 175.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.01 122.9 11.93 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 120.922 1.692 . . . . 0.0 112.088 -177.342 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.23 4.45 89.65 Favored Glycine 0 CA--C 1.54 1.612 0 C-N-CA 125.418 1.485 . . . . 0.0 115.384 -174.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 21.5 mt -103.85 160.05 27.33 Favored Pre-proline 0 CA--C 1.555 1.141 0 C-N-CA 126.204 1.802 . . . . 0.0 111.174 179.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -80.23 156.69 22.8 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 124.12 3.213 . . . . 0.0 113.664 -163.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 24.1 t -95.52 -36.32 6.59 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -177.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 22.2 p -123.52 174.24 7.52 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 124.965 1.306 . . . . 0.0 114.413 -178.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -64.12 -39.52 94.22 Favored 'General case' 0 N--CA 1.483 1.184 0 O-C-N 121.176 -0.953 . . . . 0.0 110.83 176.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 35.1 m -61.42 -45.1 95.74 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.196 0.998 . . . . 0.0 111.283 171.306 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -61.35 -46.92 88.22 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 118.842 0.746 . . . . 0.0 111.16 175.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.16 -38.69 89.99 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.467 -0.77 . . . . 0.0 112.313 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 69.4 ttt180 -67.3 -41.56 85.18 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 119.202 0.91 . . . . 0.0 112.622 173.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 59.7 t -61.12 -49.98 82.43 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 CA-C-N 118.713 0.688 . . . . 0.0 110.972 173.689 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -62.61 -40.75 97.93 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 118.319 -0.848 . . . . 0.0 112.464 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 48.8 mt -56.36 -50.72 70.6 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 CA-C-N 119.17 0.895 . . . . 0.0 110.31 170.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -64.29 -45.44 87.98 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -178.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 55.4 t30 -68.39 -46.58 69.63 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.918 0.887 . . . . 0.0 111.948 -177.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 55.6 mm-40 -60.19 -51.75 68.26 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 118.488 -0.767 . . . . 0.0 110.55 172.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.44 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 60.4 t90 -56.26 -47.17 79.06 Favored 'General case' 0 C--O 1.222 -0.358 0 CA-C-N 119.526 1.057 . . . . 0.0 111.929 177.673 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -58.39 -45.5 88.22 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 120.46 1.482 . . . . 0.0 113.027 178.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -69.46 -49.72 52.26 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-N 120.001 1.273 . . . . 0.0 112.747 178.126 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 32.6 mmt180 -59.0 -41.05 86.76 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.93 0.892 . . . . 0.0 109.839 178.066 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 21.5 ttpt -69.7 -31.86 70.13 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.088 1.355 . . . . 0.0 113.447 174.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -59.52 -33.22 71.1 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 120.022 1.283 . . . . 0.0 110.777 167.672 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 53.1 m -81.02 -24.32 37.99 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 115.453 1.649 . . . . 0.0 115.453 165.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -140.02 78.89 23.47 Favored Pre-proline 0 CA--C 1.552 1.024 0 C-N-CA 127.004 2.122 . . . . 0.0 112.251 -168.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -61.66 -5.81 6.34 Favored 'Trans proline' 0 CA--C 1.549 1.231 0 C-N-CA 123.859 3.039 . . . . 0.0 116.653 -168.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 41.4 p90 -90.89 -6.37 54.26 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.795 2.038 . . . . 0.0 114.887 175.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.3 tp -62.77 135.5 57.38 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 119.702 1.137 . . . . 0.0 113.776 -168.089 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 54.3 mmt-85 -86.06 157.36 20.08 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.61 1.164 . . . . 0.0 112.761 179.199 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.44 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -136.72 131.82 34.01 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 126.714 2.005 . . . . 0.0 110.04 -172.612 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 54.9 t0 -142.89 131.09 21.98 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.186 0.994 . . . . 0.0 111.12 176.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 64.7 mtt -127.71 6.75 6.18 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.359 1.464 . . . . 0.0 113.56 -177.277 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 71.3 m -63.21 147.48 50.81 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 118.884 0.766 . . . . 0.0 110.39 169.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -61.27 -28.33 69.11 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -163.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -57.11 -34.34 68.26 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.459 1.104 . . . . 0.0 113.41 172.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.7 -40.21 96.42 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 119.075 0.852 . . . . 0.0 111.704 173.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.63 -45.71 65.85 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 C-N-CA 124.406 1.083 . . . . 0.0 109.212 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 8.4 m-30 -56.92 -46.43 82.0 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 118.716 0.689 . . . . 0.0 112.279 175.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.72 -38.49 62.3 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.68 1.192 . . . . 0.0 112.57 -173.03 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 75.1 mtp85 -72.37 -38.85 68.42 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 172.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 27.3 m-85 -130.23 83.37 63.19 Favored Pre-proline 0 CA--C 1.548 0.866 0 C-N-CA 125.256 1.423 . . . . 0.0 110.902 -168.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -66.99 -16.79 50.5 Favored 'Trans proline' 0 CA--C 1.541 0.832 0 C-N-CA 123.04 2.493 . . . . 0.0 114.252 -171.478 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 12.4 p-80 -74.86 -23.45 58.42 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.153 0.981 . . . . 0.0 113.257 173.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -82.65 -24.36 33.81 Favored 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 125.719 1.608 . . . . 0.0 112.723 -171.708 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 8.3 tmm_? . . . . . 0 C--O 1.254 1.292 0 C-N-CA 125.162 1.385 . . . . 0.0 111.918 178.445 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.9 mtt . . . . . 0 N--CA 1.498 1.951 0 CA-C-O 119.826 -0.13 . . . . 0.0 111.185 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -142.2 148.89 38.93 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 126.12 1.768 . . . . 0.0 110.232 166.014 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 163.86 41.93 0.02 OUTLIER Glycine 0 N--CA 1.475 1.272 0 N-CA-C 114.761 0.664 . . . . 0.0 114.761 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 40.4 m -66.31 124.89 23.93 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.123 0.969 . . . . 0.0 112.856 -172.077 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 5.0 t-80 -138.27 14.53 2.81 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.975 1.31 . . . . 0.0 113.279 -178.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 11.5 p80 -80.64 -7.07 59.17 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 114.983 1.475 . . . . 0.0 114.983 -171.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 77.3 t60 -67.69 -22.91 65.25 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.434 1.094 . . . . 0.0 113.86 -177.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 86.2 m-70 -80.94 44.6 0.76 Allowed 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.704 1.602 . . . . 0.0 113.894 -171.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 78.6 t60 -68.39 144.06 54.88 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.756 1.222 . . . . 0.0 112.54 177.574 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 56.0 t-80 -153.79 148.61 26.52 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.763 1.625 . . . . 0.0 111.196 178.187 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -150.28 7.48 0.73 Allowed Glycine 0 CA--C 1.537 1.434 0 N-CA-C 116.533 1.373 . . . . 0.0 116.533 -178.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 21.7 m -78.66 141.6 37.84 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 119.36 1.58 . . . . 0.0 112.382 -178.203 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 11.5 p -150.65 152.76 11.14 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 125.197 1.399 . . . . 0.0 111.359 -179.578 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 33.2 t -140.37 149.62 42.9 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.955 1.302 . . . . 0.0 112.039 176.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 22.4 t80 -134.98 28.94 3.47 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.887 1.675 . . . . 0.0 111.319 175.431 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 74.79 -156.98 50.04 Favored Glycine 0 CA--C 1.536 1.403 0 C-N-CA 124.282 0.944 . . . . 0.0 112.78 -168.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -130.77 63.15 69.02 Favored Pre-proline 0 CA--C 1.554 1.121 0 C-N-CA 124.837 1.255 . . . . 0.0 112.517 -178.539 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_endo -67.52 151.87 79.23 Favored 'Trans proline' 0 CA--C 1.542 0.919 0 C-N-CA 123.318 2.679 . . . . 0.0 112.523 177.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 78.6 p -152.11 155.97 33.66 Favored Pre-proline 0 N--CA 1.476 0.854 0 C-N-CA 125.358 1.463 . . . . 0.0 112.007 179.136 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -74.63 133.66 17.47 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 123.017 2.478 . . . . 0.0 112.009 177.295 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.3 mp -122.06 151.97 40.31 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.869 1.668 . . . . 0.0 111.018 175.298 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 78.1 p -147.62 149.02 31.74 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.24 1.416 . . . . 0.0 111.764 172.129 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.5 m -135.77 9.35 3.34 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 114.41 1.263 . . . . 0.0 114.41 -170.039 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -146.78 140.18 25.64 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.788 1.235 . . . . 0.0 111.937 -175.495 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 15.4 t -154.09 152.31 30.3 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.339 1.456 . . . . 0.0 111.196 174.223 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 52.91 40.93 31.77 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 125.493 1.517 . . . . 0.0 113.953 177.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -74.23 82.69 1.84 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.505 1.122 . . . . 0.0 111.549 179.511 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 56.28 31.33 18.32 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 125.861 1.664 . . . . 0.0 113.701 -171.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 55.5 mt -88.52 104.58 14.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 C-N-CA 124.222 1.009 . . . . 0.0 109.394 178.175 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -152.96 156.15 38.33 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.152 1.381 . . . . 0.0 111.865 174.13 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 98.2 m-85 -137.61 152.08 49.0 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.482 1.513 . . . . 0.0 111.351 179.661 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 98.0 mtp -78.24 -31.25 49.14 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.469 0.915 . . . . 0.0 113.469 -174.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 24.8 p -144.46 153.54 55.52 Favored Pre-proline 0 N--CA 1.478 0.971 0 C-N-CA 125.552 1.541 . . . . 0.0 112.255 -175.605 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -71.02 159.09 53.52 Favored 'Trans proline' 0 CA--C 1.549 1.268 0 C-N-CA 123.216 2.611 . . . . 0.0 112.103 171.471 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -66.99 147.03 79.39 Favored 'Trans proline' 0 CA--C 1.539 0.755 0 C-N-CA 123.31 2.673 . . . . 0.0 112.57 177.228 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -94.12 -14.79 25.33 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.261 1.424 . . . . 0.0 113.761 178.119 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -134.93 129.06 33.72 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 126.098 1.759 . . . . 0.0 110.321 176.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -132.55 10.02 4.35 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.662 1.185 . . . . 0.0 113.37 -175.432 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -134.66 72.0 1.45 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.22 1.408 . . . . 0.0 111.861 -170.779 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -145.49 66.78 12.45 Favored Pre-proline 0 CA--C 1.548 0.877 0 C-N-CA 125.008 1.323 . . . . 0.0 109.218 172.53 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -72.46 152.88 55.08 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 123.232 2.621 . . . . 0.0 112.85 -167.541 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 75.23 -45.95 1.81 Allowed Glycine 0 CA--C 1.539 1.582 0 C-N-CA 125.588 1.566 . . . . 0.0 114.295 -175.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . 52.77 71.47 0.48 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 127.059 2.143 . . . . 0.0 114.356 179.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -101.0 151.62 21.56 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.0 1.72 . . . . 0.0 111.55 176.383 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -135.98 146.39 47.18 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.627 1.571 . . . . 0.0 112.425 176.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -87.62 158.79 18.78 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.756 1.223 . . . . 0.0 111.562 167.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 95.8 mt -135.83 157.03 47.86 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 125.34 1.456 . . . . 0.0 111.812 -177.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -82.2 139.97 33.99 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.535 0.734 . . . . 0.0 109.463 162.487 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -101.28 -19.07 15.82 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -173.359 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -140.1 164.12 30.9 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 125.323 1.449 . . . . 0.0 112.145 -173.129 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 72.37 -161.37 54.33 Favored Glycine 0 CA--C 1.542 1.727 0 C-N-CA 124.105 0.86 . . . . 0.0 113.992 179.269 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -67.9 -16.8 46.23 Favored 'Trans proline' 0 CA--C 1.541 0.872 0 C-N-CA 123.325 2.684 . . . . 0.0 113.895 -174.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 89.5 mt -95.24 6.78 48.09 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.81 1.244 . . . . 0.0 113.829 175.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.2 113.52 1.97 Allowed 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 121.067 1.758 . . . . 0.0 112.018 -178.638 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.63 7.68 64.62 Favored Glycine 0 CA--C 1.542 1.779 0 C-N-CA 125.418 1.485 . . . . 0.0 115.672 -173.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 5.7 mp -108.61 155.73 40.02 Favored Pre-proline 0 CA--C 1.556 1.211 0 C-N-CA 126.666 1.986 . . . . 0.0 111.877 179.491 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -64.82 163.35 28.32 Favored 'Trans proline' 0 C--N 1.354 0.817 0 C-N-CA 125.207 3.938 . . . . 0.0 114.235 -172.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 9.1 t -106.96 -30.29 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 123.719 0.808 . . . . 0.0 112.041 174.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 24.2 p -126.88 169.52 13.18 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 125.161 1.385 . . . . 0.0 114.004 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 41.0 ptt180 -61.97 -36.07 80.35 Favored 'General case' 0 N--CA 1.482 1.138 0 O-C-N 121.306 -0.871 . . . . 0.0 111.789 173.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 22.3 m -63.86 -43.3 96.53 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.361 1.065 . . . . 0.0 110.845 172.754 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -60.81 -49.75 76.23 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 118.688 0.676 . . . . 0.0 111.2 174.494 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.41 -42.97 93.03 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-N 118.721 0.691 . . . . 0.0 112.308 -179.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.94 -49.04 76.34 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.261 1.024 . . . . 0.0 111.895 175.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 51.7 t -60.2 -47.59 91.51 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 123.638 0.775 . . . . 0.0 111.234 177.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 88.0 mt -61.6 -42.87 99.48 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 118.277 -0.868 . . . . 0.0 111.968 179.222 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 55.7 mt -56.79 -52.7 51.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 CA-C-N 119.147 0.885 . . . . 0.0 110.156 172.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -64.44 -45.97 85.15 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 -176.361 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 46.2 m-20 -67.2 -49.11 65.82 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.337 1.055 . . . . 0.0 111.811 -178.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -65.33 -43.22 91.63 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 118.927 -0.558 . . . . 0.0 110.972 179.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.42 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 58.2 t90 -57.48 -47.66 81.28 Favored 'General case' 0 C--O 1.217 -0.612 0 CA-C-O 117.217 -1.373 . . . . 0.0 111.315 170.693 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -61.13 -40.79 95.12 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 121.124 1.784 . . . . 0.0 113.519 -178.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -65.92 -51.58 57.37 Favored 'General case' 0 N--CA 1.478 0.965 0 CA-C-N 120.212 1.369 . . . . 0.0 111.896 175.253 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -55.28 -48.25 74.33 Favored 'General case' 0 C--O 1.215 -0.715 0 C-N-CA 122.921 0.488 . . . . 0.0 110.491 176.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.24 -33.19 75.19 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 126.772 2.029 . . . . 0.0 113.648 179.125 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 44.6 mttp -61.37 -31.46 71.35 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 120.163 1.347 . . . . 0.0 111.579 166.401 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 5.6 t -81.76 -24.86 35.78 Favored 'General case' 0 N--CA 1.484 1.262 0 N-CA-C 115.04 1.496 . . . . 0.0 115.04 165.281 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -137.8 72.69 48.23 Favored Pre-proline 0 CA--C 1.552 1.031 0 C-N-CA 127.708 2.403 . . . . 0.0 111.754 -165.42 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -61.52 -9.05 12.21 Favored 'Trans proline' 0 CA--C 1.547 1.13 0 C-N-CA 123.667 2.911 . . . . 0.0 116.296 -166.553 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 41.3 p90 -82.89 -15.15 52.58 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 126.267 1.827 . . . . 0.0 114.812 174.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 20.6 tp -60.54 134.82 57.45 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 114.514 1.301 . . . . 0.0 114.514 -162.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 6.7 mmp_? -74.92 155.0 37.91 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.753 1.221 . . . . 0.0 112.619 177.222 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.42 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -136.16 126.84 27.19 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 126.374 1.87 . . . . 0.0 109.989 -177.244 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 55.1 t0 -147.47 122.99 10.42 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.726 0.81 . . . . 0.0 110.738 171.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 3.4 ptt? -137.79 31.83 2.49 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.955 1.702 . . . . 0.0 111.707 173.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 27.1 t -62.12 152.62 32.41 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 121.582 -0.699 . . . . 0.0 110.143 161.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -53.82 -37.32 63.45 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 121.027 -1.046 . . . . 0.0 113.525 -169.831 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -61.32 -33.4 73.53 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.007 0.923 . . . . 0.0 112.729 176.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.4 -39.01 93.03 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 123.505 0.722 . . . . 0.0 111.777 173.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.98 -45.36 64.2 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 123.482 0.713 . . . . 0.0 109.301 179.246 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 10.8 m-30 -55.09 -46.46 75.49 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.032 0.533 . . . . 0.0 112.17 175.025 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.55 -31.02 41.96 Favored 'General case' 0 C--N 1.343 0.306 0 C-N-CA 124.712 1.205 . . . . 0.0 113.771 -172.683 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 86.0 mtt180 -82.78 -32.54 27.71 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.818 0.847 . . . . 0.0 112.854 173.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -126.86 73.93 75.95 Favored Pre-proline 0 CA--C 1.543 0.702 0 C-N-CA 125.723 1.609 . . . . 0.0 110.874 -173.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -66.71 -12.7 36.99 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 123.2 2.6 . . . . 0.0 113.874 -176.413 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 15.0 p-80 -73.65 -23.87 59.91 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.041 0.936 . . . . 0.0 113.258 170.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -85.79 -34.06 21.22 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.814 1.646 . . . . 0.0 112.102 -168.395 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 2.9 tmm_? . . . . . 0 C--O 1.256 1.397 0 C-N-CA 125.71 1.604 . . . . 0.0 111.117 176.681 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.9 ttt . . . . . 0 N--CA 1.495 1.82 0 CA-C-O 120.521 0.201 . . . . 0.0 110.762 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 80.2 mtp180 -142.19 160.99 39.13 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 125.995 1.718 . . . . 0.0 111.961 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 74.68 78.81 0.59 Allowed Glycine 0 CA--C 1.534 1.224 0 C-N-CA 124.992 1.282 . . . . 0.0 114.982 166.448 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.4 t -148.03 130.26 15.56 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.49 1.116 . . . . 0.0 111.541 170.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 52.9 t-80 -154.69 133.97 12.52 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.587 1.555 . . . . 0.0 110.798 176.206 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 87.7 m-70 -143.11 107.73 4.84 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.466 1.106 . . . . 0.0 111.134 -176.2 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 86.0 t60 -155.61 146.03 21.89 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.722 1.209 . . . . 0.0 112.244 173.177 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 78.2 t60 -154.2 143.68 21.5 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.149 1.38 . . . . 0.0 111.543 166.579 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 44.4 p-80 -150.15 152.33 34.54 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.145 1.378 . . . . 0.0 111.302 166.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 54.6 t-80 -154.36 143.63 21.29 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.241 1.016 . . . . 0.0 112.381 177.457 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 77.96 155.92 8.17 Favored Glycine 0 CA--C 1.539 1.536 0 C-N-CA 125.155 1.36 . . . . 0.0 115.605 173.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.3 t -159.13 148.94 18.95 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.961 1.704 . . . . 0.0 110.881 174.121 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.6 p -151.85 141.16 15.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 124.651 1.18 . . . . 0.0 111.877 176.611 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 68.5 m -141.99 140.5 32.7 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.779 1.632 . . . . 0.0 110.82 175.777 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 55.4 p90 -153.47 163.52 39.8 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.67 1.188 . . . . 0.0 112.758 -179.494 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 85.5 134.3 3.27 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 125.502 1.525 . . . . 0.0 114.156 178.041 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -150.85 65.98 7.16 Favored Pre-proline 0 CA--C 1.554 1.1 0 C-N-CA 125.443 1.497 . . . . 0.0 111.208 178.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -68.23 143.97 60.87 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 123.508 2.805 . . . . 0.0 113.062 -174.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 59.3 p -148.98 47.68 0.52 Allowed Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 125.088 1.355 . . . . 0.0 113.83 178.555 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -64.24 139.92 68.41 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 123.118 2.545 . . . . 0.0 112.838 -176.562 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.8 tt -152.15 118.85 5.72 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.171 1.388 . . . . 0.0 110.01 179.432 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 23.2 t -152.02 146.4 25.54 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.477 1.111 . . . . 0.0 111.776 170.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 79.2 p -145.16 12.64 1.4 Allowed 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.476 1.51 . . . . 0.0 113.797 -178.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -111.86 157.77 20.23 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.028 1.331 . . . . 0.0 113.355 -170.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 8.6 t -146.75 165.82 28.49 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.576 1.55 . . . . 0.0 111.436 176.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 61.15 -8.01 0.08 Allowed 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 127.732 2.413 . . . . 0.0 116.998 -179.64 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -68.07 -13.88 62.54 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.066 1.346 . . . . 0.0 114.249 -177.689 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -111.43 1.31 16.92 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.811 1.644 . . . . 0.0 113.107 173.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 27.1 mt -106.39 89.13 1.27 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 124.519 1.128 . . . . 0.0 110.548 -169.686 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -148.98 152.83 37.0 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.178 1.391 . . . . 0.0 110.512 169.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -71.94 162.43 29.47 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.526 0.73 . . . . 0.0 112.161 171.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 26.7 ttt -149.79 144.93 26.33 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.038 1.335 . . . . 0.0 110.55 172.219 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 16.9 p -71.46 151.94 93.98 Favored Pre-proline 0 N--CA 1.477 0.919 0 C-N-CA 124.238 1.015 . . . . 0.0 112.478 176.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -67.94 153.99 73.94 Favored 'Trans proline' 0 CA--C 1.546 1.1 0 C-N-CA 122.912 2.408 . . . . 0.0 112.447 178.064 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -70.6 157.06 59.84 Favored 'Trans proline' 0 CA--C 1.541 0.828 0 C-N-CA 123.422 2.748 . . . . 0.0 112.743 179.16 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 77.9 mm-40 -133.74 152.84 51.98 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.619 1.568 . . . . 0.0 111.498 176.226 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -76.1 139.55 41.4 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.615 0.766 . . . . 0.0 111.765 179.383 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -130.56 17.05 5.35 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 114.178 1.177 . . . . 0.0 114.178 178.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 52.35 51.37 16.37 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 126.554 1.942 . . . . 0.0 113.417 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -144.89 69.96 14.75 Favored Pre-proline 0 CA--C 1.55 0.966 0 C-N-CA 124.924 1.29 . . . . 0.0 110.478 -171.632 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -84.99 174.81 7.06 Favored 'Trans proline' 0 CA--C 1.545 1.031 0 C-N-CA 123.823 3.015 . . . . 0.0 113.632 -168.341 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 95.85 167.78 34.87 Favored Glycine 0 CA--C 1.538 1.531 0 C-N-CA 125.438 1.494 . . . . 0.0 114.818 177.432 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -128.07 16.79 6.72 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.226 1.41 . . . . 0.0 114.42 -172.259 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.4 mp -95.82 156.91 16.13 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.841 1.656 . . . . 0.0 110.739 174.629 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -135.19 131.49 36.79 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.112 0.965 . . . . 0.0 112.431 174.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -87.43 158.55 18.96 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.156 1.382 . . . . 0.0 111.227 167.204 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 96.6 mt -133.7 156.81 47.27 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.927 1.291 . . . . 0.0 112.379 -175.27 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 -79.41 137.48 37.28 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.438 0.695 . . . . 0.0 110.125 163.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -95.66 -15.11 22.93 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 -174.46 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -150.04 169.3 21.55 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.888 1.275 . . . . 0.0 112.944 -173.01 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.16 -164.5 54.91 Favored Glycine 0 CA--C 1.54 1.641 0 C-N-CA 124.107 0.861 . . . . 0.0 114.054 179.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -67.71 -17.42 47.66 Favored 'Trans proline' 0 CA--C 1.541 0.83 0 C-N-CA 123.312 2.675 . . . . 0.0 113.827 -176.091 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 98.0 mt -94.31 6.85 47.4 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.553 1.141 . . . . 0.0 113.878 175.225 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -54.67 122.06 9.83 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 120.829 1.649 . . . . 0.0 112.037 -178.262 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 82.3 8.32 86.49 Favored Glycine 0 CA--C 1.541 1.702 0 C-N-CA 125.138 1.351 . . . . 0.0 115.453 -175.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.453 ' HB3' ' HD2' ' A' ' 73' ' ' PRO . 25.4 mt -106.44 160.62 25.61 Favored Pre-proline 0 CA--C 1.558 1.256 0 C-N-CA 126.557 1.943 . . . . 0.0 111.189 178.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.453 ' HD2' ' HB3' ' A' ' 72' ' ' LEU . 50.1 Cg_endo -69.55 163.77 36.84 Favored 'Trans proline' 0 C--N 1.354 0.866 0 C-N-CA 124.386 3.391 . . . . 0.0 113.591 -169.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 11.3 t -105.83 -30.24 2.68 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 O-C-N 121.454 -0.779 . . . . 0.0 112.177 174.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 23.2 p -126.65 171.54 11.05 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 125.184 1.394 . . . . 0.0 114.099 -178.212 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 39.0 ttm180 -61.64 -37.98 86.0 Favored 'General case' 0 N--CA 1.48 1.054 0 O-C-N 121.487 -0.758 . . . . 0.0 110.947 171.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 10.1 t -59.47 -48.74 80.49 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 123.613 0.765 . . . . 0.0 110.331 172.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -60.44 -47.35 86.48 Favored 'General case' 0 CA--C 1.537 0.47 0 O-C-N 122.137 -0.352 . . . . 0.0 111.1 177.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.89 -44.32 97.03 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 118.733 0.697 . . . . 0.0 112.778 -179.592 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 57.8 ttm-85 -62.41 -46.98 86.1 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 119.112 0.869 . . . . 0.0 111.513 176.43 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 54.0 t -63.42 -46.23 95.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.055 0.942 . . . . 0.0 111.489 178.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 52.0 mt -60.66 -45.69 93.16 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 118.194 -0.908 . . . . 0.0 112.003 176.566 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 61.4 mt -54.58 -51.54 49.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 CA-C-N 119.263 0.938 . . . . 0.0 109.975 173.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.44 ' HB2' ' HE1' ' A' ' 101' ' ' MET . 17.5 t80 -62.91 -47.04 84.97 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -178.268 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 57.6 m-20 -69.7 -46.27 66.39 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.947 0.899 . . . . 0.0 112.051 -176.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -63.25 -44.62 94.66 Favored 'General case' 0 N--CA 1.465 0.303 0 O-C-N 121.993 -0.442 . . . . 0.0 111.551 176.343 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.444 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 66.7 t90 -61.11 -47.73 84.9 Favored 'General case' 0 C--O 1.219 -0.517 0 CA-C-O 117.622 -1.18 . . . . 0.0 111.226 172.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -54.48 -44.5 72.66 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 120.907 1.685 . . . . 0.0 112.883 178.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -67.44 -53.87 25.27 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 119.492 1.042 . . . . 0.0 112.632 176.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 77.2 mtm-85 -64.47 -35.0 79.52 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 121.275 -0.89 . . . . 0.0 111.885 -177.546 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.8 tmtt? -74.09 -30.13 62.2 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.359 1.464 . . . . 0.0 113.594 174.543 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -61.75 -35.27 77.63 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 120.051 1.296 . . . . 0.0 110.929 165.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 8.2 t -74.46 -34.27 63.1 Favored 'General case' 0 CA--C 1.553 1.086 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 167.425 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -133.78 80.65 55.0 Favored Pre-proline 0 CA--C 1.549 0.905 0 C-N-CA 127.029 2.132 . . . . 0.0 111.749 -168.212 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -61.8 -6.31 7.34 Favored 'Trans proline' 0 CA--C 1.546 1.091 0 C-N-CA 123.604 2.869 . . . . 0.0 116.345 -168.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 44.1 p90 -88.9 -3.93 58.6 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.694 1.998 . . . . 0.0 114.828 174.534 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.6 tp -66.57 133.38 50.2 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 120.09 1.313 . . . . 0.0 113.255 -173.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 50.9 ttp180 -85.11 152.27 23.52 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.233 1.413 . . . . 0.0 112.723 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.444 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -132.28 130.92 41.49 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.985 2.114 . . . . 0.0 109.826 -174.504 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -143.87 136.04 26.65 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.151 0.98 . . . . 0.0 110.754 176.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.44 ' HE1' ' HB2' ' A' ' 84' ' ' PHE . 66.4 mtt -132.63 15.71 4.4 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.769 1.228 . . . . 0.0 113.567 -177.193 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 74.7 m -69.37 154.18 42.43 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.457 -0.777 . . . . 0.0 110.925 172.533 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -56.94 -34.54 68.12 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 121.018 -1.051 . . . . 0.0 113.709 -168.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -61.64 -32.77 72.94 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 176.235 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.8 -39.72 92.74 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 119.182 0.901 . . . . 0.0 111.665 174.287 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -74.11 -46.57 44.83 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 C-N-CA 124.536 1.134 . . . . 0.0 109.478 179.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 13.8 m-30 -54.94 -45.21 74.83 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 119.064 0.847 . . . . 0.0 112.416 175.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -76.6 -38.3 55.02 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.909 1.284 . . . . 0.0 112.227 -173.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 72.6 mtt85 -70.14 -39.14 75.56 Favored 'General case' 0 N--CA 1.483 1.213 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 171.342 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 29.7 m-85 -130.59 82.81 63.91 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 125.435 1.494 . . . . 0.0 110.988 -165.61 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -69.05 -5.74 16.51 Favored 'Trans proline' 0 CA--C 1.54 0.788 0 C-N-CA 123.728 2.952 . . . . 0.0 114.726 -172.262 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 7.6 p-80 -86.92 -20.51 27.27 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.144 1.378 . . . . 0.0 113.801 170.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -92.39 -14.1 29.14 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 125.881 1.673 . . . . 0.0 113.679 -171.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 14.0 ptt180 . . . . . 0 C--O 1.253 1.261 0 C-N-CA 125.251 1.42 . . . . 0.0 113.515 173.297 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.9 mtp . . . . . 0 N--CA 1.498 1.964 0 N-CA-C 111.094 0.035 . . . . 0.0 111.094 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 54.2 ttp85 51.02 46.65 26.13 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 126.3 1.84 . . . . 0.0 114.191 175.31 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -73.33 95.36 0.76 Allowed Glycine 0 CA--C 1.534 1.238 0 C-N-CA 124.26 0.933 . . . . 0.0 111.773 176.474 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 39.8 m 59.39 171.4 0.07 Allowed 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 126.472 1.909 . . . . 0.0 114.708 -171.39 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 32.8 p80 -77.14 163.19 26.82 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.912 0.885 . . . . 0.0 111.992 171.177 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 50.5 m80 -100.28 -85.45 0.41 Allowed 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.174 0.99 . . . . 0.0 111.873 -174.168 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 95.5 m-70 -144.2 -59.52 0.38 Allowed 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.321 1.449 . . . . 0.0 111.031 175.734 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 52.7 t-80 -155.24 148.87 25.28 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.885 1.674 . . . . 0.0 111.001 176.326 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -136.7 148.31 47.27 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.306 1.442 . . . . 0.0 111.506 175.22 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 56.4 t-80 -145.3 151.87 39.02 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.905 1.282 . . . . 0.0 112.376 -177.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -175.03 153.4 15.54 Favored Glycine 0 CA--C 1.536 1.386 0 C-N-CA 125.213 1.387 . . . . 0.0 112.493 173.305 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 66.1 m -138.92 146.99 41.73 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.115 1.366 . . . . 0.0 112.09 -176.75 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 23.9 m -138.29 152.95 26.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 125.636 1.574 . . . . 0.0 111.66 176.027 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 21.3 t -151.4 146.82 26.24 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.075 1.35 . . . . 0.0 110.916 175.083 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -138.96 148.57 43.69 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.888 1.275 . . . . 0.0 112.328 -172.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 81.89 129.93 1.2 Allowed Glycine 0 CA--C 1.538 1.492 0 C-N-CA 125.201 1.381 . . . . 0.0 113.26 -175.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -150.39 73.12 9.14 Favored Pre-proline 0 CA--C 1.553 1.06 0 C-N-CA 124.905 1.282 . . . . 0.0 111.336 -178.007 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -66.54 146.65 80.33 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 123.298 2.665 . . . . 0.0 112.481 -179.328 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 33.3 p -146.17 60.54 6.39 Favored Pre-proline 0 N--CA 1.477 0.903 0 C-N-CA 124.782 1.233 . . . . 0.0 113.051 -174.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -62.16 142.85 93.41 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 123.17 2.58 . . . . 0.0 112.138 177.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -136.3 12.77 3.28 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 115.448 1.647 . . . . 0.0 115.448 -168.615 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 37.1 t -146.17 145.25 30.4 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.678 1.191 . . . . 0.0 112.157 178.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.4 t -141.12 19.07 2.27 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.914 1.685 . . . . 0.0 111.601 171.241 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.4 mp0 -105.56 153.21 22.08 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.798 1.639 . . . . 0.0 112.629 -168.218 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 6.7 t -137.07 53.39 1.89 Allowed 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.718 1.607 . . . . 0.0 110.663 179.135 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 58.67 14.18 3.0 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 126.246 1.819 . . . . 0.0 114.882 -174.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -81.01 -14.27 58.07 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.994 1.718 . . . . 0.0 114.959 -173.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -130.98 1.96 4.32 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 125.58 1.552 . . . . 0.0 113.03 176.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 17.4 mm -91.48 60.23 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 124.815 1.246 . . . . 0.0 110.225 -171.121 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 50.1 t-20 -144.07 107.96 4.7 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.509 1.524 . . . . 0.0 110.092 179.061 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 51.0 p90 -153.85 168.02 27.75 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.336 1.454 . . . . 0.0 112.058 -174.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 38.5 ttm 57.51 48.77 13.88 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.383 1.473 . . . . 0.0 113.119 -177.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 18.7 p -126.56 55.21 13.38 Favored Pre-proline 0 N--CA 1.48 1.058 0 C-N-CA 125.953 1.701 . . . . 0.0 113.112 -178.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -67.42 155.18 71.42 Favored 'Trans proline' 0 CA--C 1.549 1.229 0 C-N-CA 123.118 2.545 . . . . 0.0 112.689 178.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -72.37 151.72 54.23 Favored 'Trans proline' 0 CA--C 1.54 0.824 0 C-N-CA 123.416 2.744 . . . . 0.0 112.718 177.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -96.37 -20.01 18.79 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 179.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -149.79 37.17 0.72 Allowed 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.91 1.284 . . . . 0.0 112.098 -175.559 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -145.13 179.53 7.3 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 125.476 1.51 . . . . 0.0 111.151 -178.364 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 57.38 33.54 23.42 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 125.949 1.699 . . . . 0.0 114.58 -179.423 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -147.14 74.7 11.83 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 125.488 1.515 . . . . 0.0 109.385 176.374 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -82.81 60.9 7.34 Favored 'Trans proline' 0 CA--C 1.546 1.085 0 C-N-CA 124.151 3.234 . . . . 0.0 111.953 -170.098 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 77.9 173.1 40.29 Favored Glycine 0 CA--C 1.538 1.521 0 C-N-CA 125.089 1.328 . . . . 0.0 113.553 -169.532 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -148.81 133.22 17.57 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.389 1.076 . . . . 0.0 112.271 -179.674 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -127.32 153.91 45.6 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.301 1.84 . . . . 0.0 110.39 175.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -141.72 144.63 34.15 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.455 1.102 . . . . 0.0 113.073 173.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -91.33 155.78 18.26 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.152 1.381 . . . . 0.0 111.466 166.811 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 88.0 mt -132.5 158.03 43.14 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 125.05 1.34 . . . . 0.0 112.31 -174.201 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 -85.3 142.28 29.46 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.901 0.88 . . . . 0.0 110.042 163.001 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -102.48 -11.47 18.54 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 -171.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -149.19 167.12 26.83 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.658 1.183 . . . . 0.0 113.166 -172.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.02 -161.01 53.21 Favored Glycine 0 CA--C 1.541 1.709 0 C-N-CA 124.062 0.839 . . . . 0.0 113.854 179.645 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -67.63 -16.41 46.69 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 123.163 2.575 . . . . 0.0 113.563 -177.851 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 97.7 mt -93.3 5.22 52.27 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.657 1.183 . . . . 0.0 113.95 176.015 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.61 120.84 8.44 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-N 121.114 1.779 . . . . 0.0 112.025 -178.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 82.55 7.23 87.76 Favored Glycine 0 CA--C 1.54 1.652 0 C-N-CA 125.402 1.477 . . . . 0.0 115.45 -174.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.455 ' HB3' ' HD2' ' A' ' 73' ' ' PRO . 16.3 mt -104.68 159.86 27.92 Favored Pre-proline 0 CA--C 1.558 1.287 0 C-N-CA 126.371 1.868 . . . . 0.0 111.445 -178.66 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.455 ' HD2' ' HB3' ' A' ' 72' ' ' LEU . 68.5 Cg_endo -71.9 163.92 37.3 Favored 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 124.63 3.554 . . . . 0.0 114.163 -168.029 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 10.5 t -108.88 -26.55 3.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 123.902 0.881 . . . . 0.0 112.52 176.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 22.3 p -127.05 172.0 10.87 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 125.508 1.523 . . . . 0.0 113.924 178.292 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -64.83 -36.8 85.51 Favored 'General case' 0 N--CA 1.484 1.264 0 O-C-N 121.183 -0.948 . . . . 0.0 111.251 173.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 32.5 m -61.59 -46.82 88.24 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.948 0.899 . . . . 0.0 111.017 171.095 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -59.36 -46.55 88.33 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 118.776 0.716 . . . . 0.0 111.014 175.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.47 -41.55 98.85 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.692 0.797 . . . . 0.0 112.698 -178.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 60.6 mtp85 -67.81 -39.15 84.01 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.517 0.727 . . . . 0.0 112.396 175.401 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 73.4 t -64.15 -46.56 93.24 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.112 0 CA-C-N 118.847 0.748 . . . . 0.0 111.312 174.255 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.7 mp -60.29 -45.3 93.83 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 118.417 -0.802 . . . . 0.0 112.506 175.439 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 51.1 mt -54.4 -49.86 61.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 CA-C-N 118.969 0.804 . . . . 0.0 110.187 172.303 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 13.8 t80 -63.39 -51.25 66.62 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -177.305 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -67.11 -43.88 81.33 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 119.103 0.865 . . . . 0.0 112.455 -177.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -56.44 -52.69 63.72 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.237 0.615 . . . . 0.0 110.127 174.551 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.4 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 62.9 t90 -59.01 -47.76 84.03 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-O 117.09 -1.433 . . . . 0.0 111.631 176.59 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -56.62 -47.58 79.34 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 121.262 1.846 . . . . 0.0 113.249 -179.76 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -68.26 -47.7 67.03 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 119.516 1.053 . . . . 0.0 111.938 179.264 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 15.8 mmp_? -61.47 -44.57 96.86 Favored 'General case' 0 C--O 1.216 -0.702 0 O-C-N 121.642 -0.661 . . . . 0.0 110.596 178.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -61.75 -35.64 78.69 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 126.102 1.761 . . . . 0.0 113.147 174.335 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 63.0 tttm -62.34 -34.64 77.04 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 119.225 0.92 . . . . 0.0 111.263 170.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 7.9 t -77.72 -29.69 51.35 Favored 'General case' 0 CA--C 1.555 1.168 0 N-CA-C 114.762 1.393 . . . . 0.0 114.762 166.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -133.39 81.21 55.87 Favored Pre-proline 0 N--CA 1.476 0.86 0 C-N-CA 127.511 2.324 . . . . 0.0 111.94 -165.643 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -63.94 7.37 0.21 Allowed 'Trans proline' 0 CA--C 1.551 1.337 0 C-N-CA 124.456 3.437 . . . . 0.0 117.009 -169.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 39.5 p90 -105.24 -6.01 20.12 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 127.199 2.2 . . . . 0.0 114.785 176.33 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 12.9 tp -66.61 139.46 57.89 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.65 1.352 . . . . 0.0 114.65 -168.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 18.2 mmt85 -97.98 158.17 15.69 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 125.342 1.457 . . . . 0.0 112.908 -178.154 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.4 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -139.16 129.81 25.98 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 126.333 1.853 . . . . 0.0 110.297 -167.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -147.3 134.33 20.35 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.208 1.003 . . . . 0.0 111.19 177.475 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 64.4 mtt -131.14 3.65 4.36 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -172.183 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 70.4 m -63.84 153.25 37.28 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.541 0.736 . . . . 0.0 110.904 172.068 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -55.34 -33.25 63.19 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 -166.554 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 57.6 mtmt -59.4 -35.46 74.01 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.851 0.86 . . . . 0.0 113.285 174.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.52 -39.59 94.05 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.209 0.913 . . . . 0.0 111.723 173.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.77 -46.48 61.18 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 C-N-CA 124.212 1.005 . . . . 0.0 109.276 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 13.2 m-30 -56.66 -45.55 81.58 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 118.737 0.699 . . . . 0.0 112.511 174.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.4 tmt_? -75.74 -37.18 59.57 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.482 1.113 . . . . 0.0 112.255 -172.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 37.3 mtp85 -70.99 -38.83 72.7 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 118.587 0.63 . . . . 0.0 112.665 169.397 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -131.27 83.57 59.36 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 125.23 1.412 . . . . 0.0 111.263 -167.638 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -66.88 -18.52 52.59 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 122.846 2.364 . . . . 0.0 113.977 -172.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 8.8 p-80 -72.29 -24.56 61.35 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.901 0.88 . . . . 0.0 113.187 173.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.14 -14.01 48.37 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 126.004 1.722 . . . . 0.0 113.296 -175.837 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.326 0 C-N-CA 124.821 1.249 . . . . 0.0 112.723 178.578 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.6 ttp . . . . . 0 N--CA 1.495 1.811 0 CA-C-O 119.398 -0.334 . . . . 0.0 110.85 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 64.29 158.17 0.09 Allowed 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 127.268 2.227 . . . . 0.0 114.455 -177.344 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 81.24 151.24 8.05 Favored Glycine 0 CA--C 1.538 1.507 0 C-N-CA 125.281 1.42 . . . . 0.0 114.297 -178.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 21.4 t -157.76 150.94 23.29 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.43 1.492 . . . . 0.0 111.301 177.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 19.4 p80 -151.05 156.1 40.39 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.107 1.363 . . . . 0.0 112.223 174.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 23.0 p80 -154.47 159.83 41.25 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.344 1.458 . . . . 0.0 111.558 174.229 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 20.5 p80 -153.07 155.61 37.17 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.646 1.179 . . . . 0.0 112.267 172.462 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 75.6 t60 -154.65 145.47 22.48 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.258 1.423 . . . . 0.0 111.145 171.667 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 18.1 p80 -154.45 152.94 30.73 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.781 1.233 . . . . 0.0 112.255 173.137 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 77.6 t60 -153.89 155.85 36.46 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.501 1.52 . . . . 0.0 111.004 170.471 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -172.21 33.17 0.13 Allowed Glycine 0 CA--C 1.535 1.292 0 N-CA-C 116.508 1.363 . . . . 0.0 116.508 -177.246 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 85.0 p -141.89 154.53 45.19 Favored 'General case' 0 N--CA 1.478 0.975 0 CA-C-N 118.969 1.385 . . . . 0.0 113.949 -178.191 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 12.7 p -156.71 -42.61 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.197 0 C-N-CA 124.54 1.136 . . . . 0.0 112.492 171.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 39.3 m 61.85 149.28 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 127.423 2.289 . . . . 0.0 115.377 -174.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -141.82 -15.66 0.8 Allowed 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 115.046 1.498 . . . . 0.0 115.046 -175.676 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -66.84 132.53 31.57 Favored Glycine 0 CA--C 1.536 1.377 0 O-C-N 121.108 -0.995 . . . . 0.0 113.5 -177.363 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -147.85 68.61 10.74 Favored Pre-proline 0 CA--C 1.553 1.074 0 C-N-CA 125.098 1.359 . . . . 0.0 111.479 -179.255 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -69.64 153.1 69.89 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 123.47 2.78 . . . . 0.0 112.775 -179.411 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 70.4 m -135.32 67.31 67.58 Favored Pre-proline 0 N--CA 1.475 0.812 0 C-N-CA 125.054 1.342 . . . . 0.0 111.926 -177.193 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -65.66 141.74 67.66 Favored 'Trans proline' 0 CA--C 1.542 0.904 0 C-N-CA 123.2 2.6 . . . . 0.0 111.939 177.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 27.0 tp -135.25 -10.69 2.21 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 114.336 1.235 . . . . 0.0 114.336 -171.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 32.1 p -79.15 141.54 37.16 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.362 1.065 . . . . 0.0 113.082 -178.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 47.4 m -139.27 19.42 2.58 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.841 1.256 . . . . 0.0 113.697 -174.301 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 54.76 30.94 14.48 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 125.241 1.417 . . . . 0.0 113.527 -173.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 29.9 p -87.95 154.77 20.25 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.123 1.769 . . . . 0.0 112.932 -179.589 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 59.41 15.44 4.42 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 115.734 1.753 . . . . 0.0 115.734 179.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -77.29 96.47 4.6 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 121.15 -0.969 . . . . 0.0 110.127 169.06 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 57.5 20.0 5.75 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 126.546 1.938 . . . . 0.0 115.91 177.434 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 40.9 pt -61.8 -17.4 17.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 O-C-N 120.248 -1.533 . . . . 0.0 114.969 -170.586 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -74.07 -16.61 61.03 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.085 0.954 . . . . 0.0 113.394 175.65 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 34.4 t80 -136.83 -19.91 1.32 Allowed 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 114.597 1.332 . . . . 0.0 114.597 -177.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 24.1 ttt -78.02 55.28 1.43 Allowed 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.5 1.52 . . . . 0.0 111.981 178.239 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 18.8 p -134.78 60.49 41.92 Favored Pre-proline 0 N--CA 1.477 0.898 0 C-N-CA 127.0 2.12 . . . . 0.0 111.193 -174.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -67.88 160.69 47.29 Favored 'Trans proline' 0 CA--C 1.549 1.245 0 C-N-CA 123.567 2.845 . . . . 0.0 113.326 -175.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -78.77 56.41 5.94 Favored 'Trans proline' 0 CA--C 1.545 1.062 0 C-N-CA 124.791 3.661 . . . . 0.0 112.11 178.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -125.64 152.25 45.45 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 127.138 2.175 . . . . 0.0 111.302 -174.121 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -130.49 -36.04 1.47 Allowed 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 114.416 1.265 . . . . 0.0 114.416 -177.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -149.99 145.66 26.57 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.993 1.317 . . . . 0.0 112.258 177.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -151.49 45.65 0.79 Allowed 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.072 1.349 . . . . 0.0 111.993 -174.361 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 16.7 pt20 -143.74 59.37 7.18 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 124.371 1.068 . . . . 0.0 112.574 -171.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -77.44 -21.72 11.41 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 122.931 2.421 . . . . 0.0 114.122 -168.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 68.76 19.8 73.6 Favored Glycine 0 CA--C 1.538 1.527 0 N-CA-C 115.959 1.144 . . . . 0.0 115.959 170.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -144.74 152.15 39.95 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.913 1.285 . . . . 0.0 112.633 -175.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -112.0 167.76 10.13 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.965 2.106 . . . . 0.0 112.175 175.626 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -117.49 128.13 54.68 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.352 1.061 . . . . 0.0 112.611 177.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -87.01 146.33 26.16 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.725 1.21 . . . . 0.0 110.922 166.11 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.9 mt -128.13 157.54 40.48 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.449 1.1 . . . . 0.0 112.707 -169.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -77.82 138.11 38.78 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.901 0.88 . . . . 0.0 110.428 166.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -95.25 -15.13 23.44 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 114.478 1.288 . . . . 0.0 114.478 -175.21 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -150.19 169.72 20.65 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.876 1.27 . . . . 0.0 113.088 -172.54 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.2 -164.75 54.91 Favored Glycine 0 CA--C 1.54 1.605 0 C-N-CA 124.184 0.897 . . . . 0.0 114.138 179.385 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -67.69 -17.13 47.69 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 123.325 2.683 . . . . 0.0 113.788 -176.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 95.8 mt -94.58 6.61 48.34 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.785 1.234 . . . . 0.0 113.815 175.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -54.57 123.33 12.81 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 120.952 1.705 . . . . 0.0 112.256 -177.228 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 82.41 3.13 90.65 Favored Glycine 0 CA--C 1.541 1.678 0 C-N-CA 125.501 1.524 . . . . 0.0 115.378 -174.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.419 ' HB3' ' HD2' ' A' ' 73' ' ' PRO . 20.9 mt -102.01 163.54 17.56 Favored Pre-proline 0 CA--C 1.555 1.156 0 C-N-CA 126.265 1.826 . . . . 0.0 110.888 179.411 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.419 ' HD2' ' HB3' ' A' ' 72' ' ' LEU . 73.7 Cg_endo -76.33 157.33 37.21 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 124.186 3.257 . . . . 0.0 113.383 -164.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 35.3 t -92.99 -35.88 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 O-C-N 121.533 -0.729 . . . . 0.0 112.502 174.511 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 19.6 p -123.29 172.67 8.47 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 114.716 1.376 . . . . 0.0 114.716 -177.501 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 15.0 ptp180 -61.73 -36.66 81.61 Favored 'General case' 0 N--CA 1.482 1.162 0 O-C-N 121.448 -0.783 . . . . 0.0 111.934 173.148 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 25.3 m -66.07 -44.31 84.88 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.895 0.878 . . . . 0.0 110.705 173.16 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -61.23 -42.21 98.22 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 121.714 -0.616 . . . . 0.0 111.401 175.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.09 -44.48 92.23 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.105 0.962 . . . . 0.0 112.831 177.639 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 81.1 mtp180 -66.12 -40.7 90.9 Favored 'General case' 0 N--CA 1.478 0.974 0 O-C-N 121.415 -0.803 . . . . 0.0 112.262 176.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 78.4 t -63.79 -45.85 96.06 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 123.356 0.663 . . . . 0.0 111.071 174.159 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 15.8 mt -57.26 -48.88 77.75 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 118.466 -0.778 . . . . 0.0 112.035 174.11 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 52.8 mt -54.48 -49.42 65.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 CA-C-N 118.736 0.698 . . . . 0.0 110.294 176.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.405 ' HB2' ' HE1' ' A' ' 101' ' ' MET . 13.6 t80 -64.79 -51.62 61.23 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -179.32 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.9 t30 -66.36 -43.8 84.96 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 118.639 0.654 . . . . 0.0 112.544 -176.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -60.62 -51.27 70.11 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 118.845 -0.598 . . . . 0.0 110.025 174.044 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.405 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 62.5 t90 -56.26 -46.26 79.71 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-O 118.001 -0.999 . . . . 0.0 112.5 176.216 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -56.38 -51.31 68.78 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 120.053 1.297 . . . . 0.0 112.491 177.288 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -70.09 -45.58 66.66 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 119.75 1.159 . . . . 0.0 112.488 -178.112 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 58.1 mmt-85 -55.91 -44.01 77.88 Favored 'General case' 0 N--CA 1.475 0.789 0 O-C-N 121.839 -0.538 . . . . 0.0 109.642 174.327 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 78.8 tttt -69.24 -33.24 72.97 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 178.388 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -59.32 -32.5 70.12 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 119.941 1.246 . . . . 0.0 111.137 167.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 67.1 m -81.6 -24.26 36.57 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 115.374 1.62 . . . . 0.0 115.374 166.334 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -145.77 78.93 11.46 Favored Pre-proline 0 CA--C 1.552 1.029 0 C-N-CA 126.758 2.023 . . . . 0.0 111.974 -164.787 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_endo -60.87 -7.51 7.81 Favored 'Trans proline' 0 CA--C 1.548 1.209 0 C-N-CA 123.605 2.87 . . . . 0.0 116.682 -167.56 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 42.2 p90 -86.46 -2.8 58.76 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 126.996 2.118 . . . . 0.0 115.25 176.036 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.35 133.28 52.74 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 124.714 1.206 . . . . 0.0 114.153 -173.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -88.77 152.18 21.94 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 125.278 1.431 . . . . 0.0 113.0 176.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.405 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.3 tm? -133.36 129.22 37.15 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.63 1.572 . . . . 0.0 110.494 -174.06 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -145.99 134.98 22.61 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.319 1.048 . . . . 0.0 110.843 174.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.405 ' HE1' ' HB2' ' A' ' 84' ' ' PHE . 66.8 mtt -129.81 12.48 5.77 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.739 1.216 . . . . 0.0 113.818 -176.284 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 75.3 m -66.99 153.62 43.19 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 121.345 -0.847 . . . . 0.0 111.11 174.247 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -55.17 -36.08 65.47 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -169.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 59.2 mtmt -61.41 -33.19 73.27 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.052 0.941 . . . . 0.0 113.323 176.068 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.01 -40.43 97.73 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 119.194 0.906 . . . . 0.0 111.632 173.206 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.86 -46.14 61.93 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 C-N-CA 123.833 0.853 . . . . 0.0 109.541 -179.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 16.5 m-30 -55.58 -47.01 77.14 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.364 0.666 . . . . 0.0 112.641 174.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.4 tmt_? -77.51 -36.77 52.24 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 124.292 1.037 . . . . 0.0 112.254 -172.254 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 51.1 ttt85 -75.73 -34.56 60.35 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.831 0.852 . . . . 0.0 112.629 174.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 35.6 m-85 -130.74 88.64 45.75 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 125.588 1.555 . . . . 0.0 110.871 -175.316 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -67.51 -19.77 48.35 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 123.057 2.504 . . . . 0.0 114.6 -168.201 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 7.9 p-80 -73.78 -22.48 59.82 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.783 0.833 . . . . 0.0 113.07 173.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.5 4.96 37.61 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 126.571 1.948 . . . . 0.0 113.636 -177.773 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.256 1.402 0 C-N-CA 125.412 1.485 . . . . 0.0 111.433 172.255 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.8 ttt . . . . . 0 N--CA 1.495 1.817 0 CA-C-O 119.877 -0.106 . . . . 0.0 110.774 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 73.4 ttp85 -133.89 139.28 46.08 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 125.349 1.46 . . . . 0.0 111.601 179.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 80.4 136.31 1.64 Allowed Glycine 0 CA--C 1.539 1.56 0 C-N-CA 125.598 1.57 . . . . 0.0 114.042 179.607 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.4 t -150.68 33.13 0.62 Allowed 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.991 1.316 . . . . 0.0 111.9 178.345 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -91.04 135.88 33.45 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.426 1.09 . . . . 0.0 112.724 -167.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 13.4 p80 -153.8 142.96 21.37 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.177 1.391 . . . . 0.0 111.683 172.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -146.28 139.26 25.63 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.577 1.551 . . . . 0.0 110.792 177.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 15.8 p-80 -156.11 119.78 4.37 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.361 1.064 . . . . 0.0 111.87 177.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 65.4 m80 -145.72 115.39 7.26 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.629 1.572 . . . . 0.0 109.546 177.739 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 39.8 t-80 -155.84 151.74 27.53 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.813 0.845 . . . . 0.0 113.086 -177.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 82.77 148.77 7.73 Favored Glycine 0 CA--C 1.538 1.492 0 C-N-CA 125.361 1.458 . . . . 0.0 115.391 172.378 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 79.6 p -158.08 158.32 34.53 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 126.154 1.782 . . . . 0.0 111.617 175.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.3 p -151.54 140.94 15.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 124.492 1.117 . . . . 0.0 111.595 175.644 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.6 p -156.02 153.66 29.83 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.448 1.499 . . . . 0.0 111.797 174.074 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -153.69 156.09 37.19 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.028 1.331 . . . . 0.0 112.295 177.041 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 78.46 148.52 3.93 Favored Glycine 0 CA--C 1.54 1.614 0 C-N-CA 125.1 1.333 . . . . 0.0 114.228 -178.219 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -150.36 64.45 6.67 Favored Pre-proline 0 CA--C 1.555 1.142 0 C-N-CA 124.996 1.318 . . . . 0.0 111.941 179.133 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -68.68 131.09 21.99 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 123.19 2.594 . . . . 0.0 112.082 -179.29 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 73.2 m -140.58 68.97 31.55 Favored Pre-proline 0 N--CA 1.477 0.898 0 C-N-CA 125.162 1.385 . . . . 0.0 111.101 -178.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_endo -67.69 154.73 72.51 Favored 'Trans proline' 0 CA--C 1.543 0.96 0 C-N-CA 123.362 2.708 . . . . 0.0 112.492 179.581 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.1 mp -77.38 -21.38 53.31 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.893 0.877 . . . . 0.0 113.23 -176.499 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 14.0 t -151.97 159.6 43.72 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.636 1.575 . . . . 0.0 111.493 175.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.6 t -150.14 -42.51 0.13 Allowed 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.364 1.066 . . . . 0.0 112.458 178.566 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.6 mp0 -70.84 119.38 14.89 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.521 1.128 . . . . 0.0 112.274 -177.013 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 3.4 t -149.41 36.32 0.73 Allowed 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.627 1.171 . . . . 0.0 112.234 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -136.76 4.59 2.81 Favored 'General case' 0 N--CA 1.478 0.925 0 N-CA-C 114.989 1.477 . . . . 0.0 114.989 -169.491 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -72.86 -24.67 60.9 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 -173.103 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -139.76 14.86 2.5 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.935 1.694 . . . . 0.0 113.786 179.035 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 46.5 mt -130.25 125.33 59.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 125.1 1.36 . . . . 0.0 110.468 -170.635 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -152.91 159.8 43.01 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.595 1.558 . . . . 0.0 111.499 171.258 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -81.82 159.88 23.65 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.773 0.829 . . . . 0.0 111.698 169.548 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 64.7 mtt -126.78 -36.21 2.24 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.749 1.22 . . . . 0.0 112.538 171.563 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 19.6 p -132.09 60.37 50.75 Favored Pre-proline 0 N--CA 1.48 1.049 0 C-N-CA 125.941 1.696 . . . . 0.0 111.538 178.11 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_endo -65.82 155.4 69.48 Favored 'Trans proline' 0 CA--C 1.548 1.221 0 C-N-CA 123.21 2.607 . . . . 0.0 112.63 -178.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -73.59 112.95 3.66 Favored 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 123.456 2.771 . . . . 0.0 112.174 -177.437 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -142.91 8.51 1.68 Allowed 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.567 1.321 . . . . 0.0 114.567 179.198 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 -138.41 49.45 1.91 Allowed 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 124.68 1.192 . . . . 0.0 111.965 -168.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -125.28 126.13 44.63 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.139 1.376 . . . . 0.0 111.108 177.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -145.36 21.42 1.53 Allowed 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 124.519 1.128 . . . . 0.0 113.885 -174.137 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 57.1 tp60 -150.85 79.58 7.01 Favored Pre-proline 0 CA--C 1.544 0.748 0 C-N-CA 124.838 1.255 . . . . 0.0 109.213 -176.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -82.5 68.96 7.55 Favored 'Trans proline' 0 CA--C 1.543 0.957 0 C-N-CA 123.869 3.046 . . . . 0.0 111.276 -170.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 81.76 171.99 46.51 Favored Glycine 0 CA--C 1.537 1.413 0 C-N-CA 125.278 1.418 . . . . 0.0 113.178 -166.074 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -152.58 137.24 16.93 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.824 1.25 . . . . 0.0 111.718 176.713 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -126.94 151.12 48.92 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.779 1.631 . . . . 0.0 110.888 178.485 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -132.61 126.62 33.13 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.559 1.144 . . . . 0.0 111.932 171.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -87.2 143.44 27.29 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.426 1.091 . . . . 0.0 110.938 169.722 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 59.9 mt -127.9 157.51 40.33 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.517 1.127 . . . . 0.0 112.482 -170.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 93.5 m-70 -79.1 139.15 38.15 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.939 0.896 . . . . 0.0 110.242 167.483 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -94.19 -23.68 17.81 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -174.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -141.14 166.44 24.76 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.192 1.397 . . . . 0.0 112.61 -170.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 74.18 -163.86 54.6 Favored Glycine 0 CA--C 1.539 1.574 0 C-N-CA 124.277 0.942 . . . . 0.0 114.166 178.056 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -67.41 -17.21 49.1 Favored 'Trans proline' 0 CA--C 1.541 0.86 0 C-N-CA 123.281 2.654 . . . . 0.0 113.778 -175.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.9 mt -93.49 5.11 52.7 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.656 1.182 . . . . 0.0 113.81 175.377 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.26 123.61 14.33 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 120.954 1.707 . . . . 0.0 112.318 -176.783 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 81.98 2.9 90.69 Favored Glycine 0 CA--C 1.541 1.681 0 C-N-CA 125.71 1.624 . . . . 0.0 115.339 -174.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 17.0 mt -101.63 162.49 20.27 Favored Pre-proline 0 CA--C 1.557 1.224 0 C-N-CA 126.07 1.748 . . . . 0.0 110.951 -179.107 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -77.69 155.29 31.14 Favored 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 124.113 3.209 . . . . 0.0 113.751 -164.107 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 45.1 t -91.53 -36.44 7.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 CA-C-O 118.514 -0.755 . . . . 0.0 112.574 175.271 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 16.9 p -124.68 172.77 9.01 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 115.038 1.496 . . . . 0.0 115.038 -177.425 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 56.5 ttt180 -59.26 -41.36 88.63 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 125.253 1.421 . . . . 0.0 111.192 174.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.3 t -62.71 -47.32 84.09 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 123.612 0.765 . . . . 0.0 110.832 171.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 69.0 m-20 -60.08 -42.21 94.12 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.418 -0.801 . . . . 0.0 111.862 178.341 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.04 -43.52 92.06 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.63 0.772 . . . . 0.0 112.696 177.486 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 92.5 mtt180 -66.63 -38.33 86.69 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 121.163 -0.961 . . . . 0.0 113.005 175.55 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 77.6 t -66.31 -43.49 91.48 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 CA-C-N 118.835 0.743 . . . . 0.0 111.321 174.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 16.5 mt -56.82 -48.39 78.1 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 118.595 0.634 . . . . 0.0 112.173 172.542 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 59.9 mt -54.83 -51.26 54.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 122.943 0.497 . . . . 0.0 110.082 175.364 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.466 ' HB2' ' HE1' ' A' ' 101' ' ' MET . 15.0 t80 -65.09 -48.0 75.25 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -177.001 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 20.1 t30 -69.64 -45.04 69.36 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.502 0.721 . . . . 0.0 112.246 -176.43 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 48.0 tt0 -66.04 -44.96 83.13 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 118.113 -0.946 . . . . 0.0 110.849 175.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.428 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 66.1 t90 -58.35 -46.0 87.11 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 119.987 1.267 . . . . 0.0 111.588 173.4 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -55.3 -46.15 76.23 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 120.71 1.595 . . . . 0.0 112.768 177.415 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -68.54 -52.24 34.18 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 119.533 1.061 . . . . 0.0 112.766 177.237 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 38.6 mmt180 -57.01 -45.34 83.12 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.447 0.699 . . . . 0.0 110.281 179.243 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.8 tmtt? -70.8 -29.49 65.68 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.785 1.634 . . . . 0.0 113.477 178.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 65.4 tttm -60.71 -35.34 76.07 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 120.237 1.381 . . . . 0.0 110.933 165.714 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 61.1 m -80.04 -23.47 41.39 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 115.226 1.565 . . . . 0.0 115.226 167.265 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -140.0 75.39 29.71 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 126.883 2.073 . . . . 0.0 111.8 -167.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -61.35 -6.23 6.49 Favored 'Trans proline' 0 CA--C 1.547 1.147 0 C-N-CA 123.947 3.098 . . . . 0.0 116.59 -167.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 41.3 p90 -87.44 -8.3 56.66 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 126.648 1.979 . . . . 0.0 114.938 174.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 16.2 tp -65.24 136.55 56.75 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 119.857 1.208 . . . . 0.0 114.048 -168.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 82.3 mtt85 -83.44 155.97 23.15 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.894 1.277 . . . . 0.0 113.084 179.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.428 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.4 tm? -138.8 128.29 24.54 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 126.606 1.962 . . . . 0.0 109.841 -174.672 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -146.5 137.48 24.23 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.111 0.964 . . . . 0.0 110.849 174.407 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.466 ' HE1' ' HB2' ' A' ' 84' ' ' PHE . 65.6 mtt -126.03 12.34 7.76 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.776 1.23 . . . . 0.0 113.713 -175.284 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 32.9 t -61.24 143.87 54.82 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.488 -0.758 . . . . 0.0 110.405 172.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 32.7 m-20 -60.51 -24.95 65.74 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 121.011 -1.056 . . . . 0.0 113.517 -172.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -56.25 -38.45 71.13 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.038 0.935 . . . . 0.0 112.609 169.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.42 -38.65 91.78 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.745 0.818 . . . . 0.0 112.035 173.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -70.38 -46.28 71.66 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 123.806 0.842 . . . . 0.0 109.396 -179.277 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 10.2 m-30 -58.83 -45.91 88.89 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 118.545 0.612 . . . . 0.0 112.284 174.448 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.09 -29.24 60.57 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 124.276 1.031 . . . . 0.0 113.267 -173.654 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -78.85 -38.91 36.76 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.085 0.954 . . . . 0.0 112.374 169.385 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -130.9 83.06 62.34 Favored Pre-proline 0 CA--C 1.546 0.814 0 C-N-CA 125.635 1.574 . . . . 0.0 110.84 -168.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.69 -15.46 44.53 Favored 'Trans proline' 0 CA--C 1.539 0.767 0 C-N-CA 123.067 2.511 . . . . 0.0 114.212 -170.706 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 12.5 p-80 -74.2 -22.71 59.26 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.083 0.953 . . . . 0.0 113.219 173.418 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -81.02 -25.63 37.03 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.389 1.475 . . . . 0.0 112.622 -171.435 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 69.9 ttp85 . . . . . 0 C--O 1.254 1.319 0 C-N-CA 124.585 1.154 . . . . 0.0 112.506 177.711 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.0 ttt . . . . . 0 N--CA 1.495 1.812 0 CA-C-O 120.485 0.183 . . . . 0.0 110.726 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 80.9 mtt85 -139.23 164.92 28.54 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 126.058 1.743 . . . . 0.0 111.802 177.403 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 82.75 176.57 51.53 Favored Glycine 0 CA--C 1.537 1.431 0 C-N-CA 124.997 1.284 . . . . 0.0 114.667 178.013 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 87.8 p -148.69 168.92 21.58 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 125.938 1.695 . . . . 0.0 112.364 -176.258 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 23.3 p80 -141.28 164.57 29.9 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.056 1.342 . . . . 0.0 112.487 178.729 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 55.7 t-80 -147.21 144.31 28.81 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.061 1.344 . . . . 0.0 111.571 174.109 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 22.2 p80 -151.12 158.94 44.66 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.229 1.412 . . . . 0.0 111.577 172.095 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 85.1 t60 -151.49 144.18 24.34 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.694 1.198 . . . . 0.0 112.081 176.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 18.6 p80 -152.99 151.66 30.53 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.556 1.542 . . . . 0.0 111.357 167.525 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 47.6 p-80 -155.84 173.31 16.94 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.072 1.349 . . . . 0.0 112.62 -179.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 91.25 84.48 1.44 Allowed Glycine 0 CA--C 1.533 1.217 0 C-N-CA 124.642 1.115 . . . . 0.0 114.542 168.346 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 70.9 p -147.9 140.02 24.2 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.317 1.447 . . . . 0.0 111.479 168.402 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 9.5 p -158.69 155.59 4.36 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 C-N-CA 125.091 1.357 . . . . 0.0 111.296 -178.183 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.2 p -143.14 149.39 38.01 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.923 1.289 . . . . 0.0 112.491 173.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -144.23 169.21 18.31 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 126.023 1.729 . . . . 0.0 111.815 -177.61 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 89.01 82.97 1.29 Allowed Glycine 0 CA--C 1.532 1.141 0 C-N-CA 124.712 1.149 . . . . 0.0 113.441 174.15 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -139.16 63.19 28.83 Favored Pre-proline 0 CA--C 1.554 1.119 0 C-N-CA 125.329 1.452 . . . . 0.0 111.434 175.093 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -68.38 150.26 75.79 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 123.606 2.87 . . . . 0.0 113.136 -175.625 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 54.1 p -146.51 50.78 1.05 Allowed Pre-proline 0 CA--C 1.552 1.023 0 C-N-CA 125.037 1.335 . . . . 0.0 113.841 -179.459 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -63.49 140.81 77.79 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 123.151 2.568 . . . . 0.0 112.447 -179.54 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -139.8 6.18 2.21 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 115.547 1.684 . . . . 0.0 115.547 -174.523 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.2 t -76.48 130.18 37.59 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 121.366 -0.834 . . . . 0.0 111.79 -178.235 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 16.4 t -158.09 150.22 21.98 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.33 1.452 . . . . 0.0 111.354 178.195 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -149.81 151.36 33.42 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.108 1.363 . . . . 0.0 112.236 175.118 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 12.3 t -152.58 99.68 2.49 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.763 1.225 . . . . 0.0 109.804 176.235 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -149.81 30.48 0.73 Allowed 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.28 1.032 . . . . 0.0 113.623 -168.652 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -75.51 61.11 1.26 Allowed 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.931 1.693 . . . . 0.0 112.268 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 54.08 43.7 30.32 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 126.413 1.885 . . . . 0.0 112.425 -170.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 75.4 mt -91.4 97.06 6.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 C-N-CA 125.308 1.443 . . . . 0.0 108.655 -176.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 52.1 t30 -146.78 37.69 0.99 Allowed 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 123.895 0.878 . . . . 0.0 113.31 -173.413 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 66.6 t80 -143.29 136.64 28.18 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 175.529 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 58.5 ttm -158.78 150.48 20.92 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.827 2.051 . . . . 0.0 109.049 165.15 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.8 t -133.17 117.7 14.81 Favored Pre-proline 0 N--CA 1.478 0.938 0 C-N-CA 123.233 0.613 . . . . 0.0 111.507 169.234 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -95.62 154.5 1.55 Allowed 'Trans proline' 0 CA--C 1.548 1.208 0 C-N-CA 124.005 3.136 . . . . 0.0 113.007 176.438 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -73.34 170.32 20.18 Favored 'Trans proline' 0 CA--C 1.544 1.021 0 C-N-CA 123.203 2.602 . . . . 0.0 111.393 165.408 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -69.24 -21.99 63.88 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 176.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -151.32 129.32 11.78 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.304 1.842 . . . . 0.0 109.72 171.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -89.21 -45.02 9.86 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -179.413 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 54.05 12.87 0.5 Allowed 'General case' 0 CA--C 1.555 1.163 0 N-CA-C 116.712 2.116 . . . . 0.0 116.712 179.758 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -152.67 70.42 7.29 Favored Pre-proline 0 CA--C 1.551 0.996 0 C-N-CA 125.887 1.675 . . . . 0.0 109.234 -178.77 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -81.04 176.42 8.91 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 124.177 3.251 . . . . 0.0 114.137 -165.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 98.15 -4.45 60.66 Favored Glycine 0 CA--C 1.538 1.469 0 C-N-CA 125.393 1.473 . . . . 0.0 115.691 172.206 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . 57.91 18.42 5.01 Favored 'General case' 0 CA--C 1.551 0.986 0 N-CA-C 116.662 2.097 . . . . 0.0 116.662 175.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -79.41 162.27 25.62 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.764 1.226 . . . . 0.0 110.598 163.696 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -132.02 140.44 48.92 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.438 1.095 . . . . 0.0 112.936 174.049 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -86.58 155.06 20.61 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.523 1.129 . . . . 0.0 110.837 164.394 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 91.3 mt -132.99 157.32 45.49 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.803 1.241 . . . . 0.0 112.105 -175.129 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -81.81 137.53 35.28 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 123.352 0.661 . . . . 0.0 109.615 162.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -96.48 -21.59 17.63 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 114.426 1.269 . . . . 0.0 114.426 -173.422 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -140.8 165.53 27.27 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.202 1.401 . . . . 0.0 112.373 -171.535 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.17 -162.72 54.79 Favored Glycine 0 CA--C 1.54 1.629 0 C-N-CA 124.162 0.887 . . . . 0.0 114.124 178.296 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -67.85 -17.36 46.92 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 123.251 2.634 . . . . 0.0 113.809 -175.168 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 97.8 mt -94.13 6.26 49.15 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.557 1.143 . . . . 0.0 113.901 175.273 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.45 122.01 10.28 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 120.798 1.636 . . . . 0.0 112.123 -178.04 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 83.15 6.28 88.23 Favored Glycine 0 CA--C 1.541 1.693 0 C-N-CA 125.447 1.499 . . . . 0.0 115.432 -175.18 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.457 ' HB3' ' HD2' ' A' ' 73' ' ' PRO . 18.2 mt -103.99 160.77 25.0 Favored Pre-proline 0 CA--C 1.559 1.293 0 C-N-CA 126.137 1.775 . . . . 0.0 111.33 -179.208 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.457 ' HD2' ' HB3' ' A' ' 72' ' ' LEU . 67.9 Cg_endo -72.24 164.73 34.75 Favored 'Trans proline' 0 C--N 1.354 0.832 0 C-N-CA 124.307 3.338 . . . . 0.0 113.553 -168.497 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 10.6 t -110.12 -27.38 2.89 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 O-C-N 121.288 -0.883 . . . . 0.0 112.458 176.583 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 17.7 p -125.87 172.65 9.71 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 125.385 1.474 . . . . 0.0 114.203 179.726 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 10.1 mmt180 -60.19 -40.96 91.9 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 121.378 -0.826 . . . . 0.0 111.442 170.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 8.6 t -63.15 -44.28 95.98 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 122.617 0.367 . . . . 0.0 110.761 174.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -60.01 -45.14 93.74 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.717 -0.614 . . . . 0.0 111.417 175.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.72 -41.82 95.7 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.595 0.758 . . . . 0.0 112.67 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 34.0 mtp-105 -61.42 -45.8 92.8 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 118.803 0.729 . . . . 0.0 111.773 173.051 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 55.4 t -60.96 -49.78 83.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 124.046 0.938 . . . . 0.0 111.199 177.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.6 mp -60.13 -49.83 76.08 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 118.6 -0.714 . . . . 0.0 112.562 177.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 60.8 mt -54.47 -52.61 38.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-N 118.859 0.754 . . . . 0.0 110.199 175.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -65.44 -47.41 76.26 Favored 'General case' 0 C--O 1.224 -0.267 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -176.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -67.61 -45.95 73.99 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 119.47 1.032 . . . . 0.0 112.528 -178.071 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -64.86 -44.44 89.7 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 118.957 -0.544 . . . . 0.0 110.722 178.606 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.436 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 71.3 t90 -60.29 -46.0 91.4 Favored 'General case' 0 C--O 1.219 -0.545 0 CA-C-O 117.787 -1.102 . . . . 0.0 111.897 171.298 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -55.72 -49.2 73.67 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 121.042 1.747 . . . . 0.0 112.637 179.576 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -65.53 -53.71 38.42 Favored 'General case' 0 C--O 1.245 0.835 0 O-C-N 121.067 -1.02 . . . . 0.0 111.931 178.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 9.8 mmm180 -58.32 -47.12 84.72 Favored 'General case' 0 C--O 1.215 -0.739 0 C-N-CA 122.435 0.294 . . . . 0.0 111.039 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 13.7 tmtt? -67.37 -30.96 70.89 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.32 1.048 . . . . 0.0 113.192 178.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 8.9 mtpm? -66.64 -26.56 67.12 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 120.194 1.361 . . . . 0.0 112.531 168.565 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 79.8 p -91.06 -9.18 46.71 Favored 'General case' 0 N--CA 1.486 1.34 0 N-CA-C 116.185 1.92 . . . . 0.0 116.185 163.104 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -144.64 72.55 15.48 Favored Pre-proline 0 CA--C 1.552 1.02 0 C-N-CA 127.353 2.261 . . . . 0.0 111.4 -172.103 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -61.1 -7.78 8.72 Favored 'Trans proline' 0 CA--C 1.546 1.114 0 C-N-CA 123.835 3.024 . . . . 0.0 116.577 -166.277 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 41.0 p90 -84.31 -10.49 57.58 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 126.502 1.921 . . . . 0.0 115.037 174.506 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.4 tp -64.84 137.08 57.55 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.674 1.124 . . . . 0.0 113.747 -169.589 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 23.3 mmt85 -90.06 156.46 18.37 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.593 1.157 . . . . 0.0 112.78 -179.107 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.436 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.4 tm? -137.69 131.81 31.96 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 126.996 2.119 . . . . 0.0 109.266 -171.772 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 52.5 t0 -141.85 130.65 22.92 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.68 0.792 . . . . 0.0 111.041 175.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 65.0 mtt -122.8 9.23 9.45 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.836 1.654 . . . . 0.0 112.841 -179.732 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 28.9 t -64.52 153.73 38.14 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.026 0.93 . . . . 0.0 111.507 172.516 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -51.4 -38.28 52.64 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.238 1.015 . . . . 0.0 112.79 -179.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -58.78 -39.1 80.04 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.531 1.133 . . . . 0.0 112.914 176.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.24 -42.38 99.26 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 123.25 0.62 . . . . 0.0 111.551 175.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.02 -46.92 64.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.297 0 C-N-CA 123.651 0.781 . . . . 0.0 109.902 -179.036 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 18.8 m-30 -55.35 -46.48 76.4 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 118.869 0.759 . . . . 0.0 112.599 175.394 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 1.5 ttp85 -78.2 -35.18 48.87 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.906 0.882 . . . . 0.0 112.93 -172.053 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 61.7 ttm-85 -80.71 -37.24 30.98 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 124.433 1.093 . . . . 0.0 112.847 175.495 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -129.71 76.96 77.77 Favored Pre-proline 0 CA--C 1.547 0.846 0 C-N-CA 126.54 1.936 . . . . 0.0 110.893 -173.32 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -65.41 -17.67 58.26 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 123.109 2.54 . . . . 0.0 114.281 -172.598 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 7.6 p-80 -74.15 -23.98 59.34 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.078 0.951 . . . . 0.0 113.32 172.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -85.53 -4.79 59.26 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 126.278 1.831 . . . . 0.0 113.496 -178.795 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 57.5 ttp180 . . . . . 0 C--O 1.254 1.302 0 C-N-CA 125.405 1.482 . . . . 0.0 111.843 173.777 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.5 mtt . . . . . 0 N--CA 1.499 1.978 0 N-CA-C 110.364 -0.235 . . . . 0.0 110.364 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 80.3 mtm180 -140.37 167.89 21.1 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 125.964 1.706 . . . . 0.0 111.828 179.359 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 84.27 17.04 65.47 Favored Glycine 0 CA--C 1.535 1.337 0 N-CA-C 115.963 1.145 . . . . 0.0 115.963 169.289 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 56.4 p -69.18 150.11 47.85 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 118.68 1.24 . . . . 0.0 112.47 173.602 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 41.6 p-80 -80.91 -37.08 30.27 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 -174.274 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . 0.464 ' CG ' ' H ' ' A' ' 7' ' ' HIS . 33.2 t60 56.15 172.68 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 126.869 2.068 . . . . 0.0 115.131 -173.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . 0.464 ' H ' ' CG ' ' A' ' 6' ' ' HIS . 94.7 m-70 -80.41 39.31 0.46 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.228 1.811 . . . . 0.0 113.658 -176.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 34.0 m80 -72.24 158.92 34.96 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.573 1.149 . . . . 0.0 112.182 172.003 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 23.3 m80 60.07 22.31 11.5 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 125.726 1.61 . . . . 0.0 115.248 178.431 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 58.8 m170 -100.38 152.37 20.42 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.371 1.468 . . . . 0.0 111.758 173.5 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 74.47 178.88 40.57 Favored Glycine 0 CA--C 1.54 1.631 0 C-N-CA 124.389 0.995 . . . . 0.0 114.631 -178.376 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 8.8 t -154.36 168.58 26.14 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 125.586 1.554 . . . . 0.0 111.662 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.9 p -140.86 139.27 34.36 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 125.381 1.472 . . . . 0.0 111.354 175.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 80.2 p -154.01 162.14 41.42 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.726 1.611 . . . . 0.0 111.618 179.535 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 84.1 m-85 -133.43 132.43 41.11 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.632 1.173 . . . . 0.0 111.363 -177.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 72.5 165.08 8.05 Favored Glycine 0 CA--C 1.54 1.619 0 C-N-CA 124.605 1.097 . . . . 0.0 114.235 -172.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -146.95 55.31 2.39 Favored Pre-proline 0 CA--C 1.555 1.14 0 C-N-CA 124.617 1.167 . . . . 0.0 112.984 178.037 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -66.83 141.48 59.32 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.097 2.532 . . . . 0.0 112.378 -179.806 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 9.6 t -152.08 80.88 5.84 Favored Pre-proline 0 CA--C 1.545 0.773 0 C-N-CA 124.479 1.112 . . . . 0.0 110.88 176.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -78.13 95.72 1.08 Allowed 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 123.659 2.906 . . . . 0.0 111.562 -176.498 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 97.9 mt -115.69 -3.26 12.29 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.963 1.305 . . . . 0.0 114.397 -175.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 21.1 t -81.52 134.61 35.54 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.751 0.82 . . . . 0.0 112.054 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 81.4 p -158.42 163.15 37.48 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.525 1.53 . . . . 0.0 112.353 179.44 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -131.05 144.55 51.52 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.217 1.407 . . . . 0.0 111.181 173.244 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 59.8 m -142.44 151.47 41.8 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.745 1.218 . . . . 0.0 112.85 -172.477 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 57.01 25.64 10.94 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.983 1.713 . . . . 0.0 115.467 172.266 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -70.95 -22.42 62.22 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 114.29 1.218 . . . . 0.0 114.29 -174.339 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 -127.78 7.07 6.16 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 125.906 1.682 . . . . 0.0 113.014 -179.239 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 46.3 mm -97.81 125.89 50.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 O-C-N 120.925 -1.109 . . . . 0.0 111.334 -170.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 66.3 m-20 48.53 42.73 19.3 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 126.394 1.878 . . . . 0.0 114.135 171.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 26.1 t80 -81.66 59.17 4.06 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.833 1.253 . . . . 0.0 113.055 -170.708 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 55.5 mtt 60.49 171.18 0.09 Allowed 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 127.881 2.472 . . . . 0.0 115.476 -179.197 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 26.3 p -137.34 154.21 75.27 Favored Pre-proline 0 N--CA 1.479 0.997 0 C-N-CA 126.531 1.932 . . . . 0.0 111.311 -179.342 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -68.09 152.0 76.86 Favored 'Trans proline' 0 CA--C 1.548 1.18 0 C-N-CA 122.884 2.39 . . . . 0.0 112.334 177.123 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -69.8 141.51 45.25 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 123.446 2.764 . . . . 0.0 112.547 -178.674 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -74.16 131.01 40.87 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.011 1.324 . . . . 0.0 112.214 -178.299 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.6 pm0 -78.02 -21.72 50.36 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 115.067 1.506 . . . . 0.0 115.067 -176.159 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -139.81 2.5 1.97 Allowed 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 115.669 1.729 . . . . 0.0 115.669 -168.68 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -83.98 61.88 6.69 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.04 1.336 . . . . 0.0 112.062 -177.366 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 33.0 tp60 -149.25 83.49 6.56 Favored Pre-proline 0 CA--C 1.541 0.611 0 C-N-CA 125.041 1.336 . . . . 0.0 109.087 179.22 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -87.31 -169.61 0.51 Allowed 'Trans proline' 0 CA--C 1.546 1.082 0 C-N-CA 123.522 2.815 . . . . 0.0 110.994 179.347 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 82.06 -129.58 9.15 Favored Glycine 0 CA--C 1.536 1.354 0 C-N-CA 124.093 0.854 . . . . 0.0 113.296 177.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . 58.8 52.73 6.35 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.98 1.712 . . . . 0.0 114.624 -175.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -85.81 168.08 14.61 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.019 1.727 . . . . 0.0 111.418 171.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -135.91 148.96 48.78 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.028 1.331 . . . . 0.0 113.032 176.272 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -92.93 154.54 18.13 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.128 1.371 . . . . 0.0 111.639 168.152 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 81.4 mt -129.25 157.12 42.75 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.145 1.378 . . . . 0.0 112.051 -176.284 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 79.3 m-70 -82.94 143.34 30.76 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.716 0.806 . . . . 0.0 109.584 162.347 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -107.13 -9.56 16.12 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 114.898 1.444 . . . . 0.0 114.898 -170.225 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -148.53 165.72 30.38 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.745 1.218 . . . . 0.0 112.957 -174.299 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 68.52 -158.9 52.32 Favored Glycine 0 CA--C 1.541 1.658 0 C-N-CA 123.931 0.777 . . . . 0.0 113.83 -179.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_endo -68.05 -15.45 43.26 Favored 'Trans proline' 0 CA--C 1.541 0.865 0 C-N-CA 123.268 2.645 . . . . 0.0 113.746 -177.441 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.0 mt -94.46 5.5 51.62 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.765 1.226 . . . . 0.0 113.949 176.301 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.93 114.12 2.41 Favored 'General case' 0 CA--C 1.549 0.907 0 CA-C-N 121.276 1.853 . . . . 0.0 111.995 -179.28 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.17 1.81 71.95 Favored Glycine 0 CA--C 1.542 1.763 0 C-N-CA 125.682 1.611 . . . . 0.0 115.694 -174.209 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 6.7 mp -98.61 157.17 34.74 Favored Pre-proline 0 CA--C 1.556 1.198 0 C-N-CA 126.792 2.037 . . . . 0.0 111.563 179.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -68.06 160.13 49.98 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 124.748 3.632 . . . . 0.0 113.664 -172.003 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 15.2 t -103.95 -30.77 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 O-C-N 121.445 -0.784 . . . . 0.0 112.2 175.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 22.3 p -124.96 170.31 11.24 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 125.143 1.377 . . . . 0.0 114.144 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 43.0 ttt-85 -59.97 -40.1 87.94 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.033 0.933 . . . . 0.0 111.119 173.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 37.4 m -62.77 -43.9 97.59 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.019 0.927 . . . . 0.0 111.291 172.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -60.59 -46.46 90.17 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 118.866 0.757 . . . . 0.0 111.274 175.069 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.19 -42.22 98.2 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 118.623 0.647 . . . . 0.0 112.55 179.587 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 74.5 mtp180 -64.45 -43.16 95.13 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 121.525 -0.735 . . . . 0.0 112.376 175.449 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 53.4 t -62.91 -48.33 88.55 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 C-N-CA 123.79 0.836 . . . . 0.0 111.142 176.195 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 7.7 mp -59.67 -45.15 92.91 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 118.45 -0.786 . . . . 0.0 112.602 176.542 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 49.7 mt -54.76 -51.49 51.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 CA-C-N 118.884 0.765 . . . . 0.0 110.157 173.346 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -65.44 -48.46 72.65 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 113.318 0.859 . . . . 0.0 113.318 -176.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 23.7 t30 -69.43 -42.78 74.56 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 118.627 0.648 . . . . 0.0 112.49 -176.704 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -65.01 -45.96 83.37 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 118.772 -0.633 . . . . 0.0 110.778 175.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.455 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 64.7 t90 -58.99 -47.34 85.53 Favored 'General case' 0 C--O 1.22 -0.454 0 CA-C-O 117.919 -1.039 . . . . 0.0 111.658 173.05 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -57.93 -45.22 86.9 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 120.645 1.566 . . . . 0.0 112.927 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -66.86 -52.76 39.77 Favored 'General case' 0 C--O 1.245 0.824 0 CA-C-N 119.599 1.09 . . . . 0.0 112.435 177.234 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -55.84 -48.51 75.36 Favored 'General case' 0 C--O 1.218 -0.595 0 O-C-N 121.776 -0.578 . . . . 0.0 110.16 177.513 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 18.5 ttpt -63.04 -34.02 76.67 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.214 1.405 . . . . 0.0 113.397 177.197 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -59.64 -33.66 71.81 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 119.998 1.272 . . . . 0.0 111.001 169.171 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 63.0 m -84.37 -17.66 38.69 Favored 'General case' 0 N--CA 1.484 1.234 0 N-CA-C 116.106 1.891 . . . . 0.0 116.106 165.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -143.09 72.89 18.29 Favored Pre-proline 0 CA--C 1.553 1.073 0 C-N-CA 127.266 2.226 . . . . 0.0 111.738 -165.278 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -61.84 -5.23 5.7 Favored 'Trans proline' 0 CA--C 1.547 1.166 0 C-N-CA 123.934 3.089 . . . . 0.0 116.649 -167.301 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 38.9 p90 -88.12 -9.11 54.27 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 126.921 2.088 . . . . 0.0 114.965 175.721 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.3 tp -65.43 137.5 57.51 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 114.725 1.38 . . . . 0.0 114.725 -164.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 34.4 mmt180 -84.21 155.01 22.71 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 125.139 1.376 . . . . 0.0 113.128 178.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.455 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -138.77 131.98 29.94 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.898 2.079 . . . . 0.0 109.681 -174.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 53.5 t0 -143.86 132.44 22.33 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.894 0.877 . . . . 0.0 111.152 174.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 66.7 mtt -125.9 2.21 7.35 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.313 1.445 . . . . 0.0 113.729 -176.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 73.4 m -62.73 144.7 56.14 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 118.96 0.8 . . . . 0.0 110.216 169.797 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -61.26 -25.04 66.82 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 -165.038 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -56.32 -34.48 66.58 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.86 0.864 . . . . 0.0 112.966 171.492 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.31 -40.04 95.0 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.508 0.723 . . . . 0.0 111.922 173.141 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.6 mp -73.28 -45.42 53.07 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 C-N-CA 124.204 1.001 . . . . 0.0 109.261 -179.621 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 11.7 m-30 -55.59 -46.15 77.29 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 118.618 0.644 . . . . 0.0 112.235 175.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.4 tmt_? -77.66 -39.92 43.45 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.65 1.18 . . . . 0.0 112.523 -173.524 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 62.2 ttm-85 -76.89 -35.69 57.24 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.144 0.978 . . . . 0.0 112.994 177.123 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 45.1 m-85 -127.19 72.68 76.96 Favored Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 125.991 1.717 . . . . 0.0 111.115 -174.534 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -66.68 -11.08 30.42 Favored 'Trans proline' 0 CA--C 1.542 0.898 0 C-N-CA 123.348 2.699 . . . . 0.0 114.171 -175.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 16.1 p-80 -74.83 -23.48 58.46 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.003 0.921 . . . . 0.0 113.343 171.296 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -81.04 -45.66 16.2 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.82 1.248 . . . . 0.0 111.892 -164.462 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 20.8 mmt85 . . . . . 0 C--O 1.253 1.268 0 C-N-CA 127.054 2.142 . . . . 0.0 111.121 172.794 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.7 mmt . . . . . 0 N--CA 1.498 1.934 0 CA-C-O 120.079 -0.01 . . . . 0.0 111.012 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 82.2 mtp180 -135.23 165.73 24.73 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 125.739 1.616 . . . . 0.0 112.405 -178.07 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 104.6 117.28 4.33 Favored Glycine 0 CA--C 1.536 1.35 0 C-N-CA 125.711 1.624 . . . . 0.0 113.974 171.079 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 79.1 p -157.9 156.92 32.2 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.593 1.957 . . . . 0.0 111.162 173.146 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 56.5 t-80 -151.92 133.51 14.7 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.196 0.998 . . . . 0.0 112.331 178.222 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 95.3 m-70 -145.77 96.36 2.8 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 125.474 1.51 . . . . 0.0 110.564 175.347 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 57.8 t-80 -152.53 135.16 15.31 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.971 0.908 . . . . 0.0 112.194 173.36 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 64.7 m80 -146.94 151.57 37.23 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.956 1.702 . . . . 0.0 111.267 178.038 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 55.9 t-80 -149.32 137.0 20.31 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 124.407 1.083 . . . . 0.0 111.936 171.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 46.6 p-80 -162.25 176.22 10.83 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.859 1.664 . . . . 0.0 112.016 -175.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 88.38 18.25 55.62 Favored Glycine 0 CA--C 1.537 1.441 0 N-CA-C 116.181 1.232 . . . . 0.0 116.181 168.076 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 70.4 p -79.23 -10.82 59.91 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 114.972 1.471 . . . . 0.0 114.972 -179.266 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.0 m -84.92 -1.38 6.64 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 N-CA-C 115.294 1.59 . . . . 0.0 115.294 -169.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 30.2 m -73.4 -13.42 61.08 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 115.71 1.745 . . . . 0.0 115.71 -168.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -79.24 149.36 31.9 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -176.708 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 86.59 134.51 3.86 Favored Glycine 0 CA--C 1.538 1.476 0 C-N-CA 125.693 1.616 . . . . 0.0 114.341 175.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -151.78 67.26 7.15 Favored Pre-proline 0 CA--C 1.556 1.177 0 C-N-CA 125.099 1.36 . . . . 0.0 112.152 -179.824 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -70.32 146.65 57.35 Favored 'Trans proline' 0 CA--C 1.543 0.948 0 C-N-CA 123.369 2.712 . . . . 0.0 112.725 179.56 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 67.3 m -139.47 62.43 24.01 Favored Pre-proline 0 N--CA 1.479 1.014 0 C-N-CA 124.933 1.293 . . . . 0.0 112.637 -177.618 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -67.77 132.15 26.03 Favored 'Trans proline' 0 CA--C 1.542 0.923 0 C-N-CA 123.169 2.579 . . . . 0.0 112.095 179.629 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.3 tt -153.92 115.56 4.2 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.901 1.28 . . . . 0.0 110.341 179.067 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 76.2 p -155.41 148.48 24.61 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.787 1.235 . . . . 0.0 112.304 172.028 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.9 t -159.69 128.72 5.17 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.682 1.193 . . . . 0.0 111.269 172.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -155.97 124.59 5.93 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.981 1.312 . . . . 0.0 110.353 172.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 11.0 t -160.44 151.77 19.36 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.425 1.09 . . . . 0.0 112.426 177.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 47.54 63.05 2.15 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.634 1.974 . . . . 0.0 114.364 170.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -76.54 43.02 0.3 Allowed 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 124.914 1.285 . . . . 0.0 112.27 172.218 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 54.47 42.73 31.18 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 126.918 2.087 . . . . 0.0 113.575 -168.307 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 16.9 mm -88.77 51.14 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 126.012 1.725 . . . . 0.0 109.366 179.329 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -146.88 137.03 23.48 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.727 1.611 . . . . 0.0 111.03 -177.067 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 32.3 p90 -163.26 151.93 14.19 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.295 1.438 . . . . 0.0 111.854 -179.345 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 14.6 ttt -155.98 141.48 17.72 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.92 1.288 . . . . 0.0 110.646 169.259 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 17.9 p -135.48 64.38 58.42 Favored Pre-proline 0 N--CA 1.484 1.23 0 C-N-CA 125.021 1.328 . . . . 0.0 112.012 -176.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -71.18 149.67 58.29 Favored 'Trans proline' 0 CA--C 1.548 1.221 0 C-N-CA 123.013 2.475 . . . . 0.0 112.58 -176.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -74.39 149.95 40.56 Favored 'Trans proline' 0 CA--C 1.539 0.769 0 C-N-CA 123.467 2.778 . . . . 0.0 112.329 176.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -90.34 -21.73 21.87 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 177.193 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.0 tt0 49.37 47.49 22.3 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 126.554 1.941 . . . . 0.0 113.723 175.516 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -65.15 -29.86 70.73 Favored 'General case' 0 N--CA 1.477 0.925 0 O-C-N 120.989 -1.069 . . . . 0.0 113.143 -174.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -81.71 67.55 7.72 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.605 1.562 . . . . 0.0 111.641 178.451 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -136.1 38.59 0.39 Allowed Pre-proline 0 CA--C 1.555 1.156 0 C-N-CA 125.229 1.412 . . . . 0.0 114.347 178.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -70.95 146.97 54.21 Favored 'Trans proline' 0 CA--C 1.544 1.011 0 C-N-CA 122.646 2.231 . . . . 0.0 112.966 -170.793 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 68.81 -173.47 34.43 Favored Glycine 0 CA--C 1.539 1.562 0 C-N-CA 124.422 1.01 . . . . 0.0 114.566 -176.488 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -144.52 102.0 3.76 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.665 1.186 . . . . 0.0 111.084 177.087 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -123.21 143.84 49.77 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.584 1.554 . . . . 0.0 110.947 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -150.73 155.97 40.37 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.685 1.594 . . . . 0.0 112.549 178.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -92.41 150.96 20.49 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.612 1.165 . . . . 0.0 111.681 168.844 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 99.5 mt -131.34 157.49 43.21 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.678 1.591 . . . . 0.0 111.28 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -79.23 143.37 35.38 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.809 0.843 . . . . 0.0 109.91 166.552 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -106.83 -9.01 16.51 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 114.739 1.385 . . . . 0.0 114.739 -172.002 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -148.39 165.7 30.31 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.85 1.26 . . . . 0.0 112.924 -174.802 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 69.53 -161.16 52.68 Favored Glycine 0 CA--C 1.541 1.701 0 C-N-CA 123.942 0.782 . . . . 0.0 113.9 -179.33 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -68.07 -16.03 44.17 Favored 'Trans proline' 0 CA--C 1.541 0.851 0 C-N-CA 123.191 2.594 . . . . 0.0 113.72 -177.059 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.1 mt -92.91 4.28 54.2 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 124.813 1.245 . . . . 0.0 113.971 175.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.39 113.94 2.2 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-N 121.107 1.776 . . . . 0.0 112.088 -178.099 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 92.55 4.27 66.0 Favored Glycine 0 CA--C 1.544 1.864 0 C-N-CA 125.642 1.591 . . . . 0.0 115.704 -173.631 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 5.9 mp -105.45 154.77 38.83 Favored Pre-proline 0 CA--C 1.555 1.173 0 C-N-CA 126.831 2.052 . . . . 0.0 111.435 179.848 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -71.56 162.55 41.84 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 124.98 3.786 . . . . 0.0 113.859 -167.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 14.7 t -105.27 -32.88 2.79 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 O-C-N 121.441 -0.787 . . . . 0.0 113.09 -179.122 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 25.1 p -123.93 172.75 8.69 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 124.914 1.285 . . . . 0.0 113.988 179.364 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 41.5 mtp-105 -61.68 -40.5 95.21 Favored 'General case' 0 N--CA 1.482 1.156 0 O-C-N 121.378 -0.827 . . . . 0.0 110.562 175.054 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 31.3 m -61.67 -44.61 96.63 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 124.353 1.061 . . . . 0.0 111.237 173.321 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -61.16 -47.29 86.88 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 118.885 0.766 . . . . 0.0 111.233 175.116 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.21 -39.58 90.75 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.616 -0.677 . . . . 0.0 112.216 179.698 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 75.3 ttt180 -65.21 -42.07 93.86 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 121.422 -0.798 . . . . 0.0 112.354 174.14 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 68.1 t -63.07 -48.54 87.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 CA-C-N 118.786 0.721 . . . . 0.0 111.223 175.021 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -60.63 -45.11 95.29 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 118.628 -0.701 . . . . 0.0 111.952 178.178 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 52.9 mt -53.59 -51.69 40.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-N 118.736 0.698 . . . . 0.0 110.33 170.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.449 ' HB2' ' HE1' ' A' ' 101' ' ' MET . 20.8 t80 -64.15 -46.5 83.79 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 -176.298 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -70.71 -44.99 65.78 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.033 0.933 . . . . 0.0 112.353 -176.517 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -65.71 -44.01 87.37 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 118.766 -0.635 . . . . 0.0 111.091 176.091 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.437 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 68.3 t90 -60.02 -45.48 92.64 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-O 117.572 -1.204 . . . . 0.0 111.59 171.589 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -54.93 -48.68 72.81 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 120.836 1.653 . . . . 0.0 112.492 178.667 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -65.29 -51.5 60.3 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 119.68 1.127 . . . . 0.0 112.232 177.207 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 38.2 mmt180 -58.54 -46.25 87.22 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 122.99 0.516 . . . . 0.0 110.845 -178.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 3.5 tmtm? -69.27 -30.32 68.4 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 126.043 1.737 . . . . 0.0 113.509 178.661 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 90.8 mttt -65.83 -28.23 68.83 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 119.993 1.27 . . . . 0.0 111.98 166.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 68.5 m -82.9 -22.65 33.88 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 115.173 1.546 . . . . 0.0 115.173 163.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -140.44 75.83 26.48 Favored Pre-proline 0 N--CA 1.477 0.903 0 C-N-CA 127.105 2.162 . . . . 0.0 111.363 -167.332 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -58.63 -16.84 32.29 Favored 'Trans proline' 0 CA--C 1.542 0.907 0 C-N-CA 123.379 2.719 . . . . 0.0 116.039 -165.393 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 39.1 p90 -79.08 -9.78 59.64 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 126.611 1.964 . . . . 0.0 115.463 177.181 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 18.2 tp -64.05 135.42 56.39 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 120.098 1.317 . . . . 0.0 114.35 -167.069 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 7.5 tpm_? -77.9 146.65 35.46 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.939 1.696 . . . . 0.0 112.721 178.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.437 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.4 tm? -128.36 133.89 48.74 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 126.886 2.074 . . . . 0.0 109.847 179.533 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -149.62 134.3 17.69 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.901 0.881 . . . . 0.0 111.084 176.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.449 ' HE1' ' HB2' ' A' ' 84' ' ' PHE . 63.6 mtt -130.24 1.79 4.67 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.052 1.341 . . . . 0.0 114.288 -171.653 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 69.6 m -63.78 147.34 52.0 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.022 0.828 . . . . 0.0 111.067 173.097 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -58.52 -27.64 64.69 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 114.888 1.44 . . . . 0.0 114.888 -166.396 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -56.85 -37.37 71.2 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 119.035 0.834 . . . . 0.0 112.802 172.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.06 -37.1 86.2 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.661 0.784 . . . . 0.0 112.065 174.162 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.6 mp -73.65 -46.4 47.94 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 C-N-CA 124.104 0.962 . . . . 0.0 109.327 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 13.9 m-30 -56.17 -45.81 79.56 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 119.006 0.821 . . . . 0.0 112.334 174.391 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.46 -38.97 62.8 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 124.277 1.031 . . . . 0.0 112.283 -173.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 39.7 ttm105 -78.99 -34.78 43.79 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.836 0.854 . . . . 0.0 112.948 176.45 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 -128.21 78.16 75.86 Favored Pre-proline 0 CA--C 1.546 0.827 0 C-N-CA 126.396 1.879 . . . . 0.0 110.757 -174.329 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -66.16 -16.04 50.59 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 123.091 2.527 . . . . 0.0 114.231 -173.4 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 12.9 p-80 -73.99 -24.01 59.53 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.138 0.975 . . . . 0.0 113.444 172.48 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -82.18 -27.31 32.71 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 125.858 1.663 . . . . 0.0 112.252 -171.442 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 59.6 ttp180 . . . . . 0 C--O 1.254 1.311 0 C-N-CA 125.169 1.388 . . . . 0.0 112.291 175.994 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.832 0 N-CA-C 111.718 0.266 . . . . 0.0 111.718 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 17.9 tpt180 -152.77 151.85 30.96 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 125.037 1.335 . . . . 0.0 111.448 178.122 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 78.27 -58.84 4.03 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 125.418 1.485 . . . . 0.0 114.596 174.229 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 25.1 m 59.31 179.25 0.08 Allowed 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 126.581 1.953 . . . . 0.0 114.755 -177.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 65.8 m80 -128.9 156.17 44.12 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.434 1.494 . . . . 0.0 112.228 -176.186 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 46.8 t60 -145.44 157.19 44.06 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.312 1.445 . . . . 0.0 112.004 -179.103 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 95.3 m-70 -135.31 149.87 49.87 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.606 1.562 . . . . 0.0 112.295 -176.156 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 25.1 p80 -145.43 166.5 25.45 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 125.138 1.375 . . . . 0.0 112.479 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 56.3 t-80 -146.11 148.86 33.05 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.114 1.365 . . . . 0.0 111.801 176.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 25.3 p80 -149.19 160.03 43.73 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.557 1.543 . . . . 0.0 111.686 175.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 174.33 -158.52 27.02 Favored Glycine 0 CA--C 1.537 1.415 0 C-N-CA 123.879 0.752 . . . . 0.0 114.305 -178.389 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.6 t 64.92 161.06 0.12 Allowed 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 127.19 2.196 . . . . 0.0 115.35 -174.366 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 15.1 m -143.33 152.83 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 126.831 2.053 . . . . 0.0 111.819 -174.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 26.4 m -73.66 -34.44 64.93 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 113.322 0.86 . . . . 0.0 113.322 -179.074 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 7.3 t80 52.09 37.18 20.81 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 126.289 1.836 . . . . 0.0 114.956 172.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -69.84 144.61 40.29 Favored Glycine 0 CA--C 1.537 1.46 0 O-C-N 121.247 -0.908 . . . . 0.0 113.747 -178.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -146.22 66.59 11.42 Favored Pre-proline 0 CA--C 1.554 1.124 0 C-N-CA 125.036 1.334 . . . . 0.0 111.878 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_endo -69.35 150.47 70.74 Favored 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 123.677 2.918 . . . . 0.0 113.094 -177.343 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.9 p -148.31 53.53 1.5 Allowed Pre-proline 0 CA--C 1.553 1.07 0 C-N-CA 125.094 1.357 . . . . 0.0 113.472 -179.458 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -66.02 144.77 77.39 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 123.413 2.742 . . . . 0.0 113.358 -176.176 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.4 mt -140.82 153.7 45.9 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.637 1.975 . . . . 0.0 110.939 176.571 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 81.9 p -152.26 161.46 42.57 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.783 1.233 . . . . 0.0 113.171 -179.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 63.0 m -137.61 148.67 46.02 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.904 1.682 . . . . 0.0 111.393 178.232 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -150.7 138.09 19.54 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.498 1.119 . . . . 0.0 112.121 -177.211 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 69.0 m -142.02 132.69 25.51 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 125.523 1.529 . . . . 0.0 111.132 177.435 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -146.72 -1.56 0.68 Allowed 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 115.396 1.628 . . . . 0.0 115.396 -177.451 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -70.26 -13.48 62.19 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 115.727 1.751 . . . . 0.0 115.727 -165.698 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -127.13 3.01 6.45 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.371 1.469 . . . . 0.0 113.033 173.061 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 19.5 mm -87.32 56.63 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 O-C-N 120.507 -1.371 . . . . 0.0 110.141 -172.155 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -142.78 -6.97 0.86 Allowed 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 125.188 1.395 . . . . 0.0 114.548 -170.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 49.3 m-85 -121.05 56.68 1.01 Allowed 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.391 1.076 . . . . 0.0 112.63 -162.431 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 62.4 mtt -108.51 5.61 25.35 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 125.3 1.44 . . . . 0.0 114.194 -172.061 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 17.1 p -127.98 69.52 77.13 Favored Pre-proline 0 N--CA 1.482 1.154 0 C-N-CA 125.282 1.433 . . . . 0.0 113.081 -167.316 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -67.1 156.42 66.41 Favored 'Trans proline' 0 CA--C 1.55 1.317 0 C-N-CA 123.271 2.647 . . . . 0.0 112.389 174.12 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -72.76 125.37 10.47 Favored 'Trans proline' 0 CA--C 1.542 0.888 0 C-N-CA 123.416 2.744 . . . . 0.0 112.313 -178.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -157.42 170.4 22.53 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.997 1.719 . . . . 0.0 112.018 176.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 62.3 16.18 8.26 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 115.459 1.652 . . . . 0.0 115.459 169.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -98.72 113.84 26.1 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.589 1.555 . . . . 0.0 111.674 177.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -146.63 22.87 1.28 Allowed 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 124.824 1.25 . . . . 0.0 113.449 -176.442 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 23.0 tt0 -150.62 76.79 8.15 Favored Pre-proline 0 CA--C 1.546 0.802 0 C-N-CA 125.026 1.33 . . . . 0.0 109.547 -172.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -82.15 69.34 7.54 Favored 'Trans proline' 0 CA--C 1.544 1.005 0 C-N-CA 123.919 3.079 . . . . 0.0 112.315 -167.302 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 88.77 123.78 2.21 Favored Glycine 0 CA--C 1.535 1.322 0 C-N-CA 126.021 1.772 . . . . 0.0 112.747 -175.207 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -156.52 162.86 39.92 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.896 1.678 . . . . 0.0 111.088 178.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.8 mp -90.11 163.32 14.91 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.185 1.394 . . . . 0.0 111.07 173.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -126.22 140.41 52.57 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.686 1.195 . . . . 0.0 112.895 174.69 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -89.25 159.57 17.36 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.792 1.237 . . . . 0.0 111.275 164.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 96.5 mt -135.52 156.17 49.32 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.047 1.339 . . . . 0.0 112.178 -176.059 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 87.3 m-70 -81.67 141.87 33.24 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.731 0.812 . . . . 0.0 109.479 162.12 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -104.82 -16.76 14.81 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 -172.415 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -139.58 162.67 34.53 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.155 1.382 . . . . 0.0 112.373 -173.061 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.84 -161.23 53.97 Favored Glycine 0 CA--C 1.541 1.671 0 C-N-CA 124.075 0.845 . . . . 0.0 113.99 179.065 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -67.81 -16.38 45.86 Favored 'Trans proline' 0 CA--C 1.542 0.902 0 C-N-CA 123.241 2.628 . . . . 0.0 113.835 -176.162 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 98.9 mt -92.82 4.28 54.13 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.697 1.199 . . . . 0.0 113.865 175.245 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.41 113.74 2.12 Favored 'General case' 0 CA--C 1.548 0.896 0 CA-C-N 121.097 1.771 . . . . 0.0 111.999 -179.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.93 6.16 65.53 Favored Glycine 0 CA--C 1.543 1.787 0 C-N-CA 125.453 1.501 . . . . 0.0 115.737 -173.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 6.0 mp -106.44 157.3 35.32 Favored Pre-proline 0 CA--C 1.558 1.267 0 C-N-CA 126.986 2.114 . . . . 0.0 111.318 178.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -71.36 163.9 37.53 Favored 'Trans proline' 0 C--N 1.355 0.882 0 C-N-CA 124.65 3.567 . . . . 0.0 113.833 -168.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 11.0 t -107.05 -27.88 2.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 123.658 0.783 . . . . 0.0 112.084 176.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 29.1 p -126.89 170.38 12.29 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 125.021 1.328 . . . . 0.0 114.471 -179.902 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 71.8 ttt180 -64.65 -39.36 93.56 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 124.618 1.167 . . . . 0.0 111.116 176.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 11.8 p -65.9 -40.58 91.66 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.275 1.03 . . . . 0.0 111.987 170.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 85.6 m-20 -58.82 -48.86 79.82 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 120.01 1.277 . . . . 0.0 110.846 172.297 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.22 -40.74 91.24 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 121.573 -0.704 . . . . 0.0 112.504 179.5 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 38.4 mmm-85 -61.55 -46.8 88.37 Favored 'General case' 0 N--CA 1.485 1.292 0 O-C-N 121.38 -0.825 . . . . 0.0 112.778 172.3 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 55.4 t -61.67 -46.07 97.33 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 C-N-CA 123.662 0.785 . . . . 0.0 111.058 177.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 56.5 mt -63.11 -43.49 98.28 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 117.839 -1.077 . . . . 0.0 112.107 178.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 54.5 mt -53.98 -52.6 34.82 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 CA-C-N 119.591 1.087 . . . . 0.0 110.146 171.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -63.33 -46.83 84.79 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 -177.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -69.91 -44.8 68.92 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 119.043 0.838 . . . . 0.0 112.233 -177.114 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -54.42 -54.85 35.15 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.951 0.9 . . . . 0.0 109.992 172.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.451 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 66.2 t90 -62.39 -42.76 99.67 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-O 117.771 -1.109 . . . . 0.0 112.436 178.805 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -57.56 -46.59 83.74 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 120.723 1.602 . . . . 0.0 112.513 178.408 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -66.65 -49.31 66.64 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 119.347 0.976 . . . . 0.0 112.036 176.399 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 6.1 mmp_? -53.9 -53.88 46.53 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.56 0.744 . . . . 0.0 110.053 177.487 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 45.7 tptt -64.04 -34.26 77.61 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 126.1 1.76 . . . . 0.0 113.374 -178.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt -59.7 -37.23 78.29 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.324 0.966 . . . . 0.0 111.086 169.453 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 70.7 m -81.71 -21.97 37.67 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 115.414 1.635 . . . . 0.0 115.414 169.116 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -143.52 84.82 9.78 Favored Pre-proline 0 N--CA 1.477 0.909 0 C-N-CA 125.913 1.685 . . . . 0.0 112.132 -161.063 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -60.45 -12.66 21.51 Favored 'Trans proline' 0 CA--C 1.544 1.019 0 C-N-CA 123.009 2.473 . . . . 0.0 115.288 -172.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 40.4 p90 -81.91 -8.07 59.65 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 115.509 1.67 . . . . 0.0 115.509 176.661 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.47 137.74 58.32 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 120.394 1.452 . . . . 0.0 113.444 -176.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 84.2 mtp180 -99.99 153.44 19.19 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 125.951 1.7 . . . . 0.0 112.277 175.021 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.451 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.4 tm? -128.4 130.99 48.48 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.769 1.628 . . . . 0.0 110.029 -174.29 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -142.01 131.08 23.23 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.244 1.018 . . . . 0.0 111.049 176.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 61.1 mtt -128.32 -0.37 5.7 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.737 1.384 . . . . 0.0 114.737 -171.824 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 63.6 m -65.77 150.86 47.84 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 118.769 0.713 . . . . 0.0 110.467 172.635 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 27.4 m-20 -59.86 -24.45 64.24 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 114.652 1.352 . . . . 0.0 114.652 -165.558 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -55.56 -36.76 67.17 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.678 0.791 . . . . 0.0 112.416 171.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.61 -39.31 90.77 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 118.868 0.758 . . . . 0.0 112.101 174.195 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.6 mp -73.14 -47.15 48.51 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 C-N-CA 124.341 1.056 . . . . 0.0 109.071 -179.307 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 11.3 m-30 -57.11 -44.41 83.22 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 118.669 0.668 . . . . 0.0 112.296 176.351 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.3 tmt_? -77.66 -38.29 48.05 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 124.656 1.182 . . . . 0.0 112.595 -173.246 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 46.8 mtt-85 -69.02 -41.92 77.1 Favored 'General case' 0 N--CA 1.483 1.181 0 CA-C-N 118.912 0.778 . . . . 0.0 112.506 169.473 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -130.35 71.15 82.38 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 125.43 1.492 . . . . 0.0 111.544 -164.145 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -66.33 -12.68 36.64 Favored 'Trans proline' 0 CA--C 1.54 0.813 0 C-N-CA 123.171 2.58 . . . . 0.0 113.739 -177.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 15.9 p-80 -72.83 -23.86 60.82 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.308 1.043 . . . . 0.0 113.442 172.413 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -80.79 -45.25 17.26 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.193 0.997 . . . . 0.0 112.528 -161.069 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 3.7 tmt_? . . . . . 0 C--O 1.253 1.278 0 C-N-CA 125.968 1.707 . . . . 0.0 110.752 -178.042 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.495 1.814 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 66.6 ttt180 -149.16 57.07 1.01 Allowed 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 124.747 1.219 . . . . 0.0 112.133 -177.598 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -178.27 131.15 1.69 Allowed Glycine 0 CA--C 1.534 1.23 0 O-C-N 121.669 -0.644 . . . . 0.0 114.146 175.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 82.3 p -153.21 162.03 41.76 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.949 1.699 . . . . 0.0 111.732 177.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 78.6 t60 -147.9 145.4 28.62 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.444 1.097 . . . . 0.0 112.561 179.303 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 -151.43 137.22 18.02 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 125.398 1.479 . . . . 0.0 110.616 169.022 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 40.4 t-80 -155.07 156.36 35.72 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.668 1.187 . . . . 0.0 111.758 177.474 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 19.0 p80 -145.1 154.11 42.13 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 125.205 1.402 . . . . 0.0 111.627 173.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 56.1 p-80 -146.63 155.65 42.61 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.651 1.18 . . . . 0.0 113.208 -173.092 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 55.0 p-80 -157.06 165.31 36.46 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.219 1.808 . . . . 0.0 111.523 178.88 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 173.64 138.94 2.77 Favored Glycine 0 CA--C 1.535 1.338 0 C-N-CA 123.677 0.656 . . . . 0.0 113.89 173.334 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 71.1 m -146.04 150.56 36.22 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.904 1.682 . . . . 0.0 111.529 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 62.0 t -133.58 114.96 21.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 C-N-CA 125.179 1.391 . . . . 0.0 109.371 174.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.0 m -137.89 15.29 2.88 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 -171.389 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 36.2 p90 -112.54 163.04 14.97 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.512 1.525 . . . . 0.0 113.322 -173.517 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 130.86 89.68 0.51 Allowed Glycine 0 CA--C 1.533 1.163 0 C-N-CA 125.693 1.616 . . . . 0.0 112.236 177.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -144.36 64.23 11.97 Favored Pre-proline 0 CA--C 1.556 1.179 0 C-N-CA 124.702 1.201 . . . . 0.0 112.351 -178.475 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -69.52 157.54 60.49 Favored 'Trans proline' 0 CA--C 1.543 0.955 0 C-N-CA 123.65 2.9 . . . . 0.0 112.884 179.388 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 75.4 p -150.3 151.57 31.64 Favored Pre-proline 0 N--CA 1.476 0.844 0 C-N-CA 125.004 1.321 . . . . 0.0 112.732 178.167 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -74.97 156.07 43.11 Favored 'Trans proline' 0 CA--C 1.542 0.919 0 C-N-CA 123.61 2.873 . . . . 0.0 112.721 177.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.1 pp -151.19 165.63 33.33 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.142 1.377 . . . . 0.0 112.871 176.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.3 t 60.41 178.55 0.1 Allowed 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 126.604 1.962 . . . . 0.0 115.678 177.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 61.39 8.4 2.14 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 127.907 2.483 . . . . 0.0 116.566 179.441 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -63.0 -30.97 72.01 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 120.447 -1.408 . . . . 0.0 113.764 -168.565 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 76.7 p -99.22 0.55 43.46 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.368 1.467 . . . . 0.0 114.743 -176.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -136.75 -5.81 1.94 Allowed 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 116.215 1.931 . . . . 0.0 116.215 -169.565 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -58.74 -23.57 60.07 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 115.137 1.532 . . . . 0.0 115.137 -173.083 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -112.12 1.42 16.27 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 126.915 2.086 . . . . 0.0 114.407 177.581 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 44.3 mm -94.92 97.25 6.63 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 C-N-CA 124.588 1.155 . . . . 0.0 110.871 -173.466 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 49.0 t-20 -152.45 122.45 7.05 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.143 1.377 . . . . 0.0 110.647 172.525 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 86.4 t80 -150.24 106.79 3.5 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.444 1.098 . . . . 0.0 110.855 171.494 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 36.8 tpp 59.89 159.45 0.04 OUTLIER 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 127.159 2.184 . . . . 0.0 115.316 -177.689 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 19.3 p -128.84 62.43 61.44 Favored Pre-proline 0 N--CA 1.48 1.027 0 C-N-CA 125.74 1.616 . . . . 0.0 111.607 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -71.79 153.61 58.93 Favored 'Trans proline' 0 CA--C 1.546 1.12 0 C-N-CA 123.068 2.512 . . . . 0.0 112.669 -175.508 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -71.96 115.78 4.44 Favored 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 123.071 2.514 . . . . 0.0 110.477 171.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -135.83 142.82 44.87 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 125.36 1.464 . . . . 0.0 111.33 -176.633 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -146.67 -27.93 0.4 Allowed 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 -177.594 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -137.14 143.54 42.53 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.939 1.296 . . . . 0.0 112.08 -174.185 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -137.44 44.38 2.25 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 126.157 1.783 . . . . 0.0 111.068 177.322 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -143.68 62.71 11.27 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 125.205 1.402 . . . . 0.0 112.135 -170.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -80.08 64.74 8.9 Favored 'Trans proline' 0 CA--C 1.546 1.096 0 C-N-CA 124.274 3.316 . . . . 0.0 112.332 -171.395 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 84.16 154.72 20.17 Favored Glycine 0 CA--C 1.538 1.508 0 C-N-CA 125.671 1.605 . . . . 0.0 113.27 -170.495 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -153.05 152.12 31.0 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.029 1.332 . . . . 0.0 111.927 -178.249 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 11.1 mp -100.77 160.49 14.32 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.566 1.546 . . . . 0.0 111.053 174.459 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -144.9 155.8 43.64 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.156 1.382 . . . . 0.0 113.215 178.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -97.15 154.02 17.62 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.312 1.445 . . . . 0.0 111.987 171.194 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 98.2 mt -130.67 157.36 43.0 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 125.64 1.576 . . . . 0.0 111.186 178.518 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 83.2 m-70 -77.87 141.09 39.32 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.587 0.755 . . . . 0.0 109.82 165.425 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -102.89 -16.75 15.79 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 -174.396 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -139.87 163.0 33.81 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.264 1.425 . . . . 0.0 112.373 -173.093 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.86 -162.71 54.43 Favored Glycine 0 CA--C 1.541 1.686 0 C-N-CA 123.978 0.799 . . . . 0.0 114.159 179.02 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -68.0 -17.02 46.11 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 123.279 2.653 . . . . 0.0 113.887 -175.644 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 81.7 mt -92.25 4.88 52.35 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.741 1.216 . . . . 0.0 113.837 174.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.88 114.96 2.55 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 121.142 1.792 . . . . 0.0 112.061 -178.313 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 92.12 3.55 67.58 Favored Glycine 0 CA--C 1.543 1.792 0 C-N-CA 125.704 1.621 . . . . 0.0 115.592 -173.845 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 5.6 mp -105.09 155.36 37.81 Favored Pre-proline 0 CA--C 1.555 1.147 0 C-N-CA 126.841 2.056 . . . . 0.0 111.26 178.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -68.4 162.22 41.55 Favored 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 124.71 3.606 . . . . 0.0 113.459 -170.423 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 14.9 t -102.15 -33.72 3.49 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 O-C-N 121.428 -0.795 . . . . 0.0 112.706 178.329 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 27.1 p -123.98 173.87 7.96 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 125.053 1.341 . . . . 0.0 114.165 -178.618 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 55.4 ttt85 -61.28 -42.1 98.08 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.128 0.971 . . . . 0.0 110.914 173.054 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 32.9 m -61.16 -45.03 96.29 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.908 0.883 . . . . 0.0 110.941 173.353 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 78.2 m-20 -61.11 -47.02 88.19 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 118.644 0.657 . . . . 0.0 111.273 175.595 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.36 -41.24 88.79 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.458 -0.776 . . . . 0.0 112.708 179.461 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.7 tmt_? -65.38 -45.44 84.06 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 118.661 0.664 . . . . 0.0 111.818 174.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 76.6 t -62.21 -46.01 97.43 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 CA-C-N 118.712 0.687 . . . . 0.0 111.38 177.787 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -63.84 -44.93 91.71 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 118.099 -0.953 . . . . 0.0 112.375 177.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 50.2 mt -53.94 -51.78 42.28 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 CA-C-N 119.684 1.129 . . . . 0.0 109.819 171.319 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.441 ' HB2' ' HE1' ' A' ' 101' ' ' MET . 13.3 t80 -60.65 -52.41 65.27 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.09 0.556 . . . . 0.0 112.196 -176.561 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -78.63 -34.71 46.31 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -171.641 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -63.32 -44.22 95.56 Favored 'General case' 0 N--CA 1.467 0.377 0 O-C-N 121.807 -0.558 . . . . 0.0 110.051 169.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.442 ' CE2' ' HB2' ' A' ' 99' ' ' LEU . 68.2 t90 -59.41 -48.72 80.55 Favored 'General case' 0 C--O 1.216 -0.7 0 CA-C-O 116.834 -1.555 . . . . 0.0 111.753 170.658 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -51.59 -47.94 63.37 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 121.756 2.071 . . . . 0.0 112.606 179.394 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -68.12 -50.14 56.64 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 118.941 0.791 . . . . 0.0 112.432 178.705 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 90.0 mmt-85 -59.23 -45.14 91.93 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 121.471 -0.768 . . . . 0.0 110.474 178.825 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 47.1 tptt -61.31 -36.27 79.67 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 127.108 2.163 . . . . 0.0 113.078 174.833 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -61.33 -35.34 77.12 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.531 1.06 . . . . 0.0 111.145 169.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 60.6 m -80.31 -19.83 45.71 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 115.472 1.656 . . . . 0.0 115.472 167.096 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -142.07 78.71 16.92 Favored Pre-proline 0 N--CA 1.477 0.892 0 C-N-CA 127.004 2.122 . . . . 0.0 111.88 -166.151 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_endo -59.0 -15.81 29.45 Favored 'Trans proline' 0 CA--C 1.545 1.035 0 C-N-CA 123.121 2.547 . . . . 0.0 114.977 -173.487 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 39.4 p90 -78.89 -10.03 59.68 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.932 1.693 . . . . 0.0 115.3 174.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 14.6 tp -67.36 134.24 51.13 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 120.389 1.45 . . . . 0.0 113.849 -169.211 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 80.1 ttt180 -86.45 152.68 22.48 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 126.12 1.768 . . . . 0.0 112.494 178.171 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.442 ' HB2' ' CE2' ' A' ' 87' ' ' TRP . 3.5 tm? -131.4 131.49 43.66 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.824 2.05 . . . . 0.0 109.692 -177.05 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -143.49 135.26 26.48 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.945 0.898 . . . . 0.0 111.006 176.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.441 ' HE1' ' HB2' ' A' ' 84' ' ' PHE . 63.2 mtt -130.37 21.89 5.19 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.08 1.352 . . . . 0.0 112.782 -176.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 32.4 t -63.86 152.53 39.43 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.626 0.771 . . . . 0.0 111.173 173.315 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -52.02 -39.46 59.52 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.964 0.906 . . . . 0.0 112.329 179.349 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -59.32 -37.54 78.01 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.794 1.238 . . . . 0.0 112.78 176.426 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.3 -42.05 99.03 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 118.767 0.712 . . . . 0.0 111.638 176.388 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -71.26 -46.98 62.68 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 C-N-CA 123.384 0.674 . . . . 0.0 109.735 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 16.6 m-30 -56.11 -45.75 79.37 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 176.457 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.99 -38.31 37.11 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 124.417 1.087 . . . . 0.0 112.631 -172.098 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 56.0 ttt85 -75.7 -36.88 59.9 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.117 0.967 . . . . 0.0 112.631 175.265 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 38.4 m-85 -124.04 80.49 57.67 Favored Pre-proline 0 CA--C 1.545 0.773 0 C-N-CA 125.683 1.593 . . . . 0.0 110.929 -175.439 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -67.75 -9.54 25.86 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 123.326 2.684 . . . . 0.0 114.442 -173.684 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 10.7 p-80 -80.62 -18.54 47.85 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.343 1.057 . . . . 0.0 113.619 170.383 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.58 -10.8 26.4 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 126.666 1.986 . . . . 0.0 113.546 -172.512 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 6.5 ppt_? . . . . . 0 C--O 1.253 1.255 0 C-N-CA 124.621 1.168 . . . . 0.0 113.48 174.531 . . . . . . . . 0 0 . 1 stop_ save_