data_2yw5_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 2yw5 _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 ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.896 0 N-CA-C 114.715 0.646 . . . . 0.0 114.715 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 19.7 ptt180 -161.42 166.49 27.22 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 126.901 2.08 . . . . 0.0 110.678 175.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -71.42 117.33 12.82 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.378 1.471 . . . . 0.0 111.882 -177.014 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 69.4 p -126.99 163.21 24.21 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.667 1.187 . . . . 0.0 112.089 -179.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -56.54 -35.41 68.09 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.302 1.441 . . . . 0.0 113.636 174.496 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -67.38 -50.21 60.69 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 122.874 0.47 . . . . 0.0 111.255 177.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 89.3 mt -62.05 -35.77 79.64 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.443 -0.786 . . . . 0.0 112.178 173.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 19.1 tp60 -58.75 -49.17 78.62 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 119.012 -0.518 . . . . 0.0 111.201 173.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 55.4 t80 -58.28 -42.57 86.86 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 119.437 1.017 . . . . 0.0 112.402 177.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 97.0 mmm -55.82 -51.42 67.54 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.128 0.571 . . . . 0.0 112.142 173.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -83.46 -12.68 56.07 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 114.971 1.471 . . . . 0.0 114.971 -175.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 59.0 t30 -107.4 -22.77 12.45 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.545 1.138 . . . . 0.0 112.869 -172.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 13.5 t -129.69 -49.69 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 C-N-CA 123.361 0.664 . . . . 0.0 112.081 -179.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.5 t -69.6 -64.16 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 CA-C-N 118.694 0.679 . . . . 0.0 110.586 -173.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 73.3 t -57.04 -45.08 83.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.675 0 C-N-CA 124.703 1.201 . . . . 0.0 110.259 172.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.3 tppp? -53.15 -47.34 68.84 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.179 0.991 . . . . 0.0 112.066 -179.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 32.6 m -76.68 -40.95 47.3 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -179.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 59.6 mt -63.25 -33.4 75.41 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.264 0.626 . . . . 0.0 112.329 176.328 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 22.3 t-105 -73.2 -31.06 63.96 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.56 1.544 . . . . 0.0 113.274 174.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 54.8 mtmt -77.65 -9.52 59.02 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 174.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 47.0 t-80 -63.29 149.38 45.79 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.746 1.218 . . . . 0.0 113.221 -179.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 17.1 pt20 -61.31 -12.53 14.06 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 115.265 1.58 . . . . 0.0 115.265 176.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 20.2 m-85 -124.22 17.04 9.13 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.96 1.704 . . . . 0.0 113.645 -179.341 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.51 -27.81 65.51 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 114.168 1.173 . . . . 0.0 114.168 176.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 41.5 p-90 -56.62 -37.78 61.37 Favored Pre-proline 0 CA--C 1.547 0.831 0 N-CA-C 118.096 2.628 . . . . 0.0 118.096 -169.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -75.17 -5.81 17.16 Favored 'Trans proline' 0 CA--C 1.544 0.988 0 CA-C-N 123.221 2.186 . . . . 0.0 113.623 174.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -106.49 -5.61 18.74 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.432 1.493 . . . . 0.0 112.877 178.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -61.24 -18.07 56.52 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 114.392 1.256 . . . . 0.0 114.392 178.214 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -143.48 155.98 60.46 Favored Pre-proline 0 CA--C 1.545 0.755 0 C-N-CA 125.868 1.667 . . . . 0.0 110.677 -175.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -65.67 151.32 84.92 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 122.752 2.302 . . . . 0.0 111.912 171.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 60.8 t -66.78 104.67 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 124.051 0.94 . . . . 0.0 110.773 176.3 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 -74.88 85.59 2.23 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.202 1.001 . . . . 0.0 110.089 169.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -51.84 -25.91 8.82 Favored 'General case' 0 CA--C 1.548 0.904 0 N-CA-C 114.053 1.131 . . . . 0.0 114.053 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 81.7 mt -64.17 -49.9 79.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 C-N-CA 125.618 1.567 . . . . 0.0 111.436 171.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -73.88 -40.52 63.15 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 125.239 1.416 . . . . 0.0 112.87 -178.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -74.29 -10.71 59.86 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.928 1.291 . . . . 0.0 113.132 174.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 68.3 m-20 56.11 56.53 5.8 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.48 1.912 . . . . 0.0 112.503 -179.283 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 46.6 mt -115.67 80.51 8.39 Favored Pre-proline 0 CA--C 1.545 0.77 0 C-N-CA 126.318 1.847 . . . . 0.0 110.35 -177.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -68.1 -6.26 16.77 Favored 'Trans proline' 0 CA--C 1.543 0.937 0 C-N-CA 123.977 3.118 . . . . 0.0 114.361 -174.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 29.4 m-20 -122.29 12.44 10.2 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.06 1.744 . . . . 0.0 112.53 178.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 80.0 t80 -48.5 -55.44 11.01 Favored 'General case' 0 N--CA 1.476 0.859 0 O-C-N 120.915 -1.116 . . . . 0.0 113.319 -175.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -73.95 -12.17 60.57 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.825 1.25 . . . . 0.0 114.353 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.61 -34.69 67.54 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 121.123 -0.986 . . . . 0.0 111.807 174.072 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.4 mp -92.28 -47.42 14.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 124.68 1.192 . . . . 0.0 110.906 174.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 38.6 mm -76.99 110.51 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 123.511 0.724 . . . . 0.0 111.335 -177.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -71.31 -35.87 71.41 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.805 1.242 . . . . 0.0 112.836 174.747 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 13.2 p30 -147.69 83.14 7.66 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 125.534 1.534 . . . . 0.0 111.721 -168.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -69.37 131.66 22.27 Favored 'Trans proline' 0 CA--C 1.535 0.566 0 C-N-CA 123.467 2.778 . . . . 0.0 110.919 -177.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 6.4 tpt -156.49 133.73 10.62 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.004 1.322 . . . . 0.0 110.28 -170.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -146.79 151.06 36.53 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.631 1.572 . . . . 0.0 111.22 -176.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.6 ttp -56.23 -36.78 68.86 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.462 1.505 . . . . 0.0 113.284 -170.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -58.94 -25.77 59.86 Favored Glycine 0 CA--C 1.533 1.188 0 C-N-CA 125.014 1.292 . . . . 0.0 114.77 174.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 39.8 m -92.96 -33.63 14.09 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.572 1.149 . . . . 0.0 111.634 175.133 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 44.7 mt -56.78 -50.84 73.32 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 CA-C-N 119.196 0.907 . . . . 0.0 110.497 174.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -62.07 -33.06 73.7 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 177.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.416 ' HA ' ' HE3' ' A' ' 88' ' ' LYS . 0.6 OUTLIER -67.45 -27.73 67.29 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -176.501 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 5.1 ptp180 -84.06 -31.93 25.1 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 113.839 1.051 . . . . 0.0 113.839 169.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 87.4 mt -62.04 -33.71 74.87 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 119.541 1.064 . . . . 0.0 113.311 168.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -67.73 1.92 2.22 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 125.603 1.561 . . . . 0.0 113.805 172.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 57.8 m-80 -137.57 -169.78 2.6 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 128.494 2.718 . . . . 0.0 110.696 -177.285 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 75.1 m-80 -113.73 44.21 1.66 Allowed 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.537 1.535 . . . . 0.0 111.051 -178.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 41.2 t80 -64.4 -35.95 82.56 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.553 0.741 . . . . 0.0 111.92 -175.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -137.6 176.43 8.71 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 127.098 2.159 . . . . 0.0 111.842 -178.303 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 2.5 t-105 -108.89 -25.29 10.84 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.882 1.673 . . . . 0.0 112.283 -178.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 51.9 p -133.05 145.73 51.06 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.25 1.42 . . . . 0.0 113.678 -168.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -69.9 -19.66 63.4 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 115.229 1.566 . . . . 0.0 115.229 -175.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 18.0 m -56.24 -28.81 59.78 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.785 0.834 . . . . 0.0 113.067 174.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -71.98 -44.12 64.03 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.554 0.742 . . . . 0.0 112.299 174.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 42.5 t -61.16 -38.97 88.38 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.713 0.805 . . . . 0.0 111.797 172.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 83.5 mtp -61.42 -43.17 99.33 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 121.44 -0.787 . . . . 0.0 112.387 172.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . 0.253 2.4 pt20 -67.43 -30.4 70.13 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 175.763 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -68.03 -43.62 78.34 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.374 -0.829 . . . . 0.0 111.961 170.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -59.36 -45.44 91.41 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 121.202 -0.936 . . . . 0.0 112.312 172.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 18.6 t30 -56.83 -47.38 80.44 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 122.965 0.506 . . . . 0.0 111.67 172.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 74.6 m -61.05 -37.91 84.32 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.907 0.883 . . . . 0.0 112.508 178.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 51.9 ttp -59.99 -55.9 28.34 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 119.091 0.86 . . . . 0.0 111.983 173.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -64.74 -42.47 95.18 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 112.207 0.447 . . . . 0.0 112.207 -177.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 98.0 m -64.61 -46.91 80.62 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.444 -0.785 . . . . 0.0 112.355 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -63.56 -32.49 73.97 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 119.909 1.232 . . . . 0.0 112.143 179.317 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 94.8 m -61.97 -43.62 98.46 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.761 0.824 . . . . 0.0 112.927 170.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -67.37 -32.71 73.83 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 178.163 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 89.1 mt -65.12 -56.3 16.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 C-N-CA 123.388 0.675 . . . . 0.0 110.825 177.232 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 31.9 t80 -69.13 -37.25 78.2 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 -172.483 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 64.7 m-80 -100.79 159.3 15.3 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.862 0.865 . . . . 0.0 112.724 -170.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 49.2 mmtm -66.82 146.11 99.03 Favored Pre-proline 0 N--CA 1.476 0.867 0 C-N-CA 123.773 0.829 . . . . 0.0 110.571 172.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -66.24 -7.61 17.9 Favored 'Trans proline' 0 CA--C 1.542 0.919 0 C-N-CA 123.604 2.87 . . . . 0.0 114.656 -175.402 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 50.8 p -113.6 -0.66 14.28 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 126.624 1.969 . . . . 0.0 113.235 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -65.89 147.25 53.67 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.568 -0.708 . . . . 0.0 111.027 173.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -51.85 -48.49 63.96 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.568 0.747 . . . . 0.0 112.405 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 9.9 tp -57.02 -30.9 35.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 N-CA-C 114.073 1.138 . . . . 0.0 114.073 -179.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 51.9 t -72.76 -47.44 49.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 O-C-N 121.55 -0.719 . . . . 0.0 110.394 174.121 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 75.0 mt -61.08 -36.74 80.46 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 118.994 0.816 . . . . 0.0 111.808 176.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 11.2 mtt -59.01 -52.64 64.9 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.892 1.277 . . . . 0.0 112.011 169.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.14 -39.78 87.5 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.254 0.621 . . . . 0.0 112.542 176.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 90.3 mt-30 -62.51 -38.36 89.61 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.909 0.884 . . . . 0.0 112.833 174.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -75.49 -34.7 60.89 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.196 0.998 . . . . 0.0 113.214 178.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 72.0 mt -68.87 -45.51 70.81 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.182 0.593 . . . . 0.0 111.383 170.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -62.54 -39.95 95.24 Favored 'General case' 0 N--CA 1.468 0.467 0 O-C-N 121.281 -0.887 . . . . 0.0 112.98 -175.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 5.2 ptpp? -61.0 -42.36 98.3 Favored 'General case' 0 N--CA 1.474 0.737 0 O-C-N 121.382 -0.824 . . . . 0.0 112.36 176.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 87.8 mt -66.26 -46.24 87.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 C-N-CA 123.828 0.851 . . . . 0.0 110.632 174.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -50.09 -50.22 48.95 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 119.102 0.864 . . . . 0.0 111.188 174.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.2 mt -63.01 -42.17 99.76 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 178.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -62.0 -35.43 78.52 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 119.444 1.02 . . . . 0.0 112.964 174.143 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 34.6 mmtm -72.98 -52.43 14.52 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.862 1.265 . . . . 0.0 111.635 179.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.0 m -67.92 -25.24 31.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 CA-C-N 119.736 1.153 . . . . 0.0 112.447 178.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -61.69 -30.32 70.67 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.58 -0.7 . . . . 0.0 112.604 170.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -90.24 -9.45 47.99 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.758 1.223 . . . . 0.0 112.683 175.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 40.0 ttp -64.77 141.55 98.35 Favored Pre-proline 0 CA--C 1.547 0.859 0 CA-C-N 119.004 0.82 . . . . 0.0 109.86 169.014 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -51.99 151.69 15.66 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 122.945 2.43 . . . . 0.0 113.43 170.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 18.7 mm100 -90.64 -21.05 21.87 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.385 0.674 . . . . 0.0 112.648 172.161 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -93.97 159.39 15.19 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.673 1.589 . . . . 0.0 111.053 173.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -125.3 139.11 53.99 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.07 1.348 . . . . 0.0 111.293 -171.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 9.9 p -146.01 150.73 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 124.315 1.046 . . . . 0.0 111.438 -175.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 24.6 tp10 -69.35 146.69 51.94 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.109 0.964 . . . . 0.0 111.715 171.593 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 88.3 mt . . . . . 0 N--CA 1.473 0.71 0 N-CA-C 113.608 0.966 . . . . 0.0 113.608 173.529 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.888 0 CA-C-O 121.566 0.537 . . . . 0.0 114.33 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 8.6 ptp180 -164.66 167.83 18.71 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 127.461 2.304 . . . . 0.0 110.175 176.223 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 8.3 tppt? -76.11 114.24 14.54 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 166.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 67.2 p -105.84 169.5 8.45 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 125.18 1.392 . . . . 0.0 110.297 174.012 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 24.0 p-10 -50.52 -37.86 41.36 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 174.266 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -71.51 -48.07 51.26 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.519 0.727 . . . . 0.0 111.595 178.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 75.9 mt -65.54 -30.78 71.57 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.472 -0.767 . . . . 0.0 112.753 177.047 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 39.3 tt0 -59.56 -52.62 64.76 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 123.913 0.885 . . . . 0.0 109.681 168.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 64.9 t80 -58.73 -42.35 88.54 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.025 0.93 . . . . 0.0 112.755 179.453 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 96.7 mmm -53.95 -51.71 62.95 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 118.514 0.597 . . . . 0.0 112.008 174.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 4.3 tp60 -75.08 -34.06 61.72 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 121.17 -0.956 . . . . 0.0 113.496 -178.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 52.3 t30 -89.81 -22.67 21.99 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.512 1.125 . . . . 0.0 113.479 -168.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 6.0 t -130.64 -50.13 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 CA-C-N 118.103 0.411 . . . . 0.0 111.195 -175.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 17.0 t -68.19 -62.93 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 122.783 0.433 . . . . 0.0 110.189 -175.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 43.1 t -56.4 -48.47 79.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 C-N-CA 125.368 1.467 . . . . 0.0 110.387 173.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 24.6 ttpt -60.37 -43.01 96.98 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -173.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 53.1 m -71.42 -44.96 63.9 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 119.01 0.823 . . . . 0.0 112.22 173.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 70.0 mt -60.4 -35.09 74.95 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.315 0.961 . . . . 0.0 112.325 178.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 26.0 t-105 -69.77 -30.1 67.59 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.538 1.535 . . . . 0.0 113.494 176.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -84.38 -6.21 59.36 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 124.302 1.041 . . . . 0.0 113.756 177.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 45.7 t-80 -63.15 154.73 30.21 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.74 1.216 . . . . 0.0 113.154 -179.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 60.9 tt0 -56.47 -24.54 46.52 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.598 1.559 . . . . 0.0 113.931 175.084 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 -122.0 19.28 10.86 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.326 1.451 . . . . 0.0 113.841 -173.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.79 -26.74 63.47 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 176.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 61.3 p-90 -59.58 -35.45 30.05 Favored Pre-proline 0 CA--C 1.548 0.893 0 N-CA-C 117.861 2.541 . . . . 0.0 117.861 -169.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -74.93 -3.42 13.89 Favored 'Trans proline' 0 CA--C 1.544 0.986 0 CA-C-N 123.232 2.19 . . . . 0.0 113.558 174.23 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 56.5 m-85 -109.98 -6.48 15.16 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.472 1.509 . . . . 0.0 113.066 178.259 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 20.4 m-30 -62.87 -16.53 59.04 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 178.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -142.02 156.52 65.08 Favored Pre-proline 0 CA--C 1.544 0.739 0 C-N-CA 126.372 1.869 . . . . 0.0 110.239 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -64.65 152.96 79.91 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 122.673 2.249 . . . . 0.0 112.054 173.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 54.6 t -66.38 101.12 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 C-N-CA 124.088 0.955 . . . . 0.0 110.675 176.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 52.7 m-20 -75.5 84.67 2.58 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.512 1.125 . . . . 0.0 110.613 172.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.97 -28.29 36.65 Favored 'General case' 0 CA--C 1.547 0.827 0 N-CA-C 113.987 1.106 . . . . 0.0 113.987 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 81.9 mt -65.37 -50.1 74.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 124.766 1.226 . . . . 0.0 111.097 172.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -66.33 -41.83 89.05 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.217 1.407 . . . . 0.0 112.56 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.6 mp -80.13 -4.76 54.24 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.631 1.173 . . . . 0.0 113.22 177.278 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 60.3 t30 54.8 55.05 8.28 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 126.107 1.763 . . . . 0.0 113.48 -179.239 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 34.8 mt -114.62 83.13 8.57 Favored Pre-proline 0 CA--C 1.543 0.673 0 C-N-CA 126.387 1.875 . . . . 0.0 110.343 -178.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -68.07 -3.44 10.66 Favored 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 123.884 3.056 . . . . 0.0 114.337 -175.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -127.34 9.86 6.71 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 126.174 1.79 . . . . 0.0 112.821 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 65.7 t80 -51.93 -51.86 54.07 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-N 120.284 1.402 . . . . 0.0 112.89 -175.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -76.17 -10.88 59.75 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.16 1.384 . . . . 0.0 113.89 179.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -72.44 -42.95 64.45 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.82 0.848 . . . . 0.0 110.267 175.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.9 mp -79.11 -55.54 9.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 C-N-CA 124.708 1.203 . . . . 0.0 110.262 172.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 47.9 mm -85.01 104.22 12.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 CA-C-O 122.153 0.978 . . . . 0.0 111.387 -175.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -71.24 -29.46 65.15 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.955 1.702 . . . . 0.0 114.058 -179.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -143.75 77.42 15.0 Favored Pre-proline 0 CA--C 1.542 0.639 0 C-N-CA 125.486 1.514 . . . . 0.0 110.712 -172.582 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -67.06 142.84 63.11 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 123.983 3.122 . . . . 0.0 111.648 -179.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 8.0 tpt -157.46 137.87 12.86 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.555 1.542 . . . . 0.0 109.846 -176.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -146.54 150.04 34.77 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.955 1.302 . . . . 0.0 111.401 -176.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 9.7 ttp -56.78 -36.72 70.18 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.992 1.317 . . . . 0.0 113.511 -169.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -61.31 -21.59 59.98 Favored Glycine 0 CA--C 1.536 1.405 0 C-N-CA 124.888 1.233 . . . . 0.0 114.77 173.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 24.3 m -97.08 -34.1 11.28 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.807 1.243 . . . . 0.0 111.523 172.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 76.8 mt -55.42 -50.37 66.24 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 119.467 1.031 . . . . 0.0 110.653 173.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 14.1 ptmm? -61.81 -29.71 70.34 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 113.976 1.102 . . . . 0.0 113.976 176.368 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.5 tpmt? -70.64 -32.9 70.37 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.748 1.219 . . . . 0.0 113.301 -175.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 3.8 ptp180 -77.95 -31.43 50.91 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 169.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 80.8 mt -67.6 -28.47 67.78 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 114.04 1.126 . . . . 0.0 114.04 169.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -65.92 -8.48 22.63 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 125.271 1.428 . . . . 0.0 114.149 174.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 -135.17 163.64 29.49 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.702 1.601 . . . . 0.0 112.819 -171.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 -81.12 105.39 12.29 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 169.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -140.53 -40.71 0.42 Allowed 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.308 1.043 . . . . 0.0 112.675 -172.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -130.81 175.53 8.96 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 126.603 1.961 . . . . 0.0 111.25 172.67 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 3.1 t-105 -115.24 -21.2 10.04 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.602 1.161 . . . . 0.0 112.833 -174.308 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 91.7 p -127.19 149.16 50.1 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.387 1.075 . . . . 0.0 112.783 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -64.32 -20.32 66.02 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 114.212 1.19 . . . . 0.0 114.212 175.227 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 83.1 p -51.13 -38.38 51.66 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.022 0.929 . . . . 0.0 113.255 177.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -67.19 -43.16 82.84 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.357 1.063 . . . . 0.0 111.782 179.241 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 49.6 t -66.92 -36.35 82.06 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.23 1.012 . . . . 0.0 112.742 174.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 88.1 mtp -62.42 -41.66 98.87 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 121.425 -0.797 . . . . 0.0 111.964 176.615 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 61.8 mm-40 -64.68 -33.93 77.11 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 112.767 0.655 . . . . 0.0 112.767 173.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 87.5 m-20 -67.69 -41.86 82.98 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 120.967 -1.083 . . . . 0.0 111.78 174.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -59.38 -47.58 84.91 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.208 0.603 . . . . 0.0 112.308 169.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.75 -42.0 92.22 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 121.776 -0.577 . . . . 0.0 111.297 177.029 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 62.4 m -62.49 -45.47 92.85 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.72 0.808 . . . . 0.0 111.547 178.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 57.5 ttp -55.68 -52.4 63.99 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.157 0.983 . . . . 0.0 112.778 176.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -68.46 -37.28 80.04 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.0 m -59.28 -50.15 75.1 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.226 1.01 . . . . 0.0 111.818 173.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -57.97 -37.46 74.22 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.268 0.627 . . . . 0.0 112.18 -178.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 90.3 m -57.29 -43.16 82.94 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.122 0.969 . . . . 0.0 112.386 173.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -70.18 -29.57 66.47 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.3 1.04 . . . . 0.0 113.632 176.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 82.2 mt -75.67 -57.13 6.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 123.804 0.842 . . . . 0.0 110.894 179.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -69.74 -23.04 63.33 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 114.507 1.299 . . . . 0.0 114.507 -172.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 36.6 m-80 -120.32 165.93 14.21 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.336 1.054 . . . . 0.0 112.724 -170.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -70.19 148.47 95.85 Favored Pre-proline 0 N--CA 1.475 0.813 0 C-N-CA 124.178 0.991 . . . . 0.0 110.477 174.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -65.99 -6.38 14.25 Favored 'Trans proline' 0 CA--C 1.543 0.963 0 C-N-CA 123.634 2.889 . . . . 0.0 114.568 -178.319 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 67.9 p -116.0 1.32 13.26 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 126.641 1.977 . . . . 0.0 113.099 179.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -66.91 147.81 52.75 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 121.478 -0.764 . . . . 0.0 110.833 173.135 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -52.29 -48.55 65.28 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.441 0.696 . . . . 0.0 112.322 178.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.1 tp -58.15 -30.11 38.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 -178.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 39.2 t -71.38 -48.3 54.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 O-C-N 121.538 -0.726 . . . . 0.0 110.383 173.226 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 74.3 mt -61.35 -36.65 80.76 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 118.876 0.762 . . . . 0.0 111.701 177.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 11.7 mtt -59.23 -51.75 68.63 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 124.735 1.214 . . . . 0.0 111.984 169.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -59.97 -40.9 90.68 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 123.191 0.596 . . . . 0.0 112.474 176.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 89.5 mt-30 -61.71 -45.96 91.71 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 119.085 0.857 . . . . 0.0 111.972 174.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -69.0 -28.0 66.2 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.445 1.098 . . . . 0.0 113.862 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 78.7 mt -78.36 -45.09 23.36 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.857 0.863 . . . . 0.0 111.547 169.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -61.04 -40.31 93.12 Favored 'General case' 0 N--CA 1.47 0.569 0 O-C-N 121.124 -0.985 . . . . 0.0 112.777 -175.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 60.6 pttt -59.22 -39.76 83.71 Favored 'General case' 0 N--CA 1.474 0.741 0 O-C-N 121.535 -0.728 . . . . 0.0 112.282 176.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 69.1 mt -72.66 -42.37 62.61 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 C-N-CA 124.457 1.103 . . . . 0.0 111.272 175.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -50.85 -51.58 49.9 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.395 0.998 . . . . 0.0 110.384 171.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 99.1 mt -62.18 -45.03 95.21 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 177.027 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -62.89 -30.61 71.66 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 119.603 1.092 . . . . 0.0 113.402 179.074 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 70.3 mmtt -75.1 -54.92 6.31 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 124.658 1.183 . . . . 0.0 112.262 174.216 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 6.0 m -66.13 -25.03 34.8 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 CA-C-N 120.691 1.587 . . . . 0.0 112.535 -178.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -58.09 -28.47 64.62 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 172.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -97.81 -3.18 39.38 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.235 1.414 . . . . 0.0 112.423 178.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 42.9 ttp -62.64 138.27 96.71 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 123.994 0.917 . . . . 0.0 110.728 173.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.07 125.98 15.62 Favored 'Trans proline' 0 CA--C 1.534 0.516 0 C-N-CA 122.864 2.376 . . . . 0.0 110.365 177.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 80.4 mm-40 -76.2 -22.4 55.34 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 113.472 0.915 . . . . 0.0 113.472 -173.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -75.13 159.02 32.14 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.244 1.417 . . . . 0.0 111.585 169.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -122.59 129.65 52.14 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.574 1.55 . . . . 0.0 111.208 -174.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 78.8 t -141.76 131.5 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 125.545 1.538 . . . . 0.0 110.961 -169.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -69.31 125.03 25.42 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.601 1.56 . . . . 0.0 111.074 169.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 97.7 mt . . . . . 0 CA--C 1.54 0.589 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 178.418 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.96 0 CA-C-O 121.234 0.352 . . . . 0.0 113.299 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 34.8 ptt180 -163.79 157.87 19.46 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 126.235 1.814 . . . . 0.0 110.425 175.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 26.0 ttpt -71.45 135.96 47.42 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.451 0.7 . . . . 0.0 110.315 170.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 70.9 p -140.22 166.79 23.71 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 125.951 1.701 . . . . 0.0 110.181 -175.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 25.1 p-10 -46.63 -37.69 8.59 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 170.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 -70.31 -55.57 8.87 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.573 0.749 . . . . 0.0 111.683 179.205 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 86.2 mt -62.67 -34.55 77.34 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 121.534 -0.729 . . . . 0.0 112.597 178.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -56.24 -54.3 47.01 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.904 0.882 . . . . 0.0 110.842 170.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 75.1 t80 -59.29 -40.54 86.45 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 119.098 0.863 . . . . 0.0 112.925 179.175 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 92.3 mmm -55.48 -50.98 68.47 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 118.754 0.706 . . . . 0.0 111.795 172.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -85.56 -3.39 58.86 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 114.874 1.435 . . . . 0.0 114.874 -175.147 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 38.5 m-80 -118.33 -17.48 9.46 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.027 1.331 . . . . 0.0 114.265 -178.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 37.9 t -136.99 -50.18 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-N 119.211 0.914 . . . . 0.0 111.866 -178.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.4 t -67.75 -62.71 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 CA-C-N 119.378 0.99 . . . . 0.0 110.634 -174.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 84.5 t -60.71 -44.46 97.24 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 C-N-CA 123.736 0.814 . . . . 0.0 110.481 174.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt -56.68 -44.23 81.23 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 118.688 0.676 . . . . 0.0 112.401 -178.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 56.4 m -70.56 -47.14 61.75 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 122.672 0.389 . . . . 0.0 111.815 176.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 63.2 mt -61.48 -33.24 73.44 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 123.323 0.649 . . . . 0.0 112.199 179.09 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . 0.459 ' CZ3' ' HE3' ' A' ' 87' ' ' LYS . 21.3 t-105 -72.48 -29.18 63.42 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 125.655 1.582 . . . . 0.0 113.475 175.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt -82.04 -8.96 59.69 Favored 'General case' 0 N--CA 1.479 0.984 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 176.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 44.2 t-80 -62.17 152.76 32.21 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.638 1.175 . . . . 0.0 113.096 -178.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 22.6 tp60 -57.87 -19.84 32.24 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.487 1.515 . . . . 0.0 114.017 174.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 15.4 m-85 -122.9 16.09 10.08 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.709 1.604 . . . . 0.0 113.995 -173.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.34 -29.64 66.39 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 114.149 1.166 . . . . 0.0 114.149 178.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 39.8 p-90 -56.4 -37.31 56.12 Favored Pre-proline 0 CA--C 1.547 0.841 0 N-CA-C 117.079 2.252 . . . . 0.0 117.079 -171.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -67.95 -6.53 17.27 Favored 'Trans proline' 0 C--N 1.356 0.924 0 CA-C-N 122.997 2.106 . . . . 0.0 114.985 172.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -113.69 -3.08 13.6 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.424 1.489 . . . . 0.0 113.129 179.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.8 m-30 -63.76 -20.61 65.9 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 113.666 0.987 . . . . 0.0 113.666 176.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -140.65 157.32 68.2 Favored Pre-proline 0 CA--C 1.545 0.772 0 C-N-CA 126.683 1.993 . . . . 0.0 110.048 -177.541 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -65.08 153.46 78.18 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 122.608 2.205 . . . . 0.0 112.144 174.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 63.7 t -65.77 102.51 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 C-N-CA 124.179 0.992 . . . . 0.0 110.963 176.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 42.9 m-20 -74.58 86.76 2.11 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.627 1.171 . . . . 0.0 109.855 169.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -52.47 -25.75 11.02 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.408 1.262 . . . . 0.0 114.408 -177.041 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 80.7 mt -64.5 -50.58 75.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 125.207 1.403 . . . . 0.0 111.323 171.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 55.2 mttm -73.48 -40.64 63.95 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 125.277 1.431 . . . . 0.0 112.937 -178.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -74.36 -10.65 59.79 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.19 0.996 . . . . 0.0 113.406 173.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 60.3 t30 58.87 54.58 5.05 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 126.7 2.0 . . . . 0.0 112.865 177.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 48.4 mt -115.21 81.59 8.29 Favored Pre-proline 0 CA--C 1.545 0.788 0 C-N-CA 126.681 1.993 . . . . 0.0 110.147 -175.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -67.68 -5.78 15.11 Favored 'Trans proline' 0 CA--C 1.543 0.956 0 C-N-CA 124.154 3.236 . . . . 0.0 114.925 -171.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -128.92 15.47 6.33 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.895 1.678 . . . . 0.0 112.51 179.357 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 63.4 t80 -47.25 -55.14 9.2 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 113.987 1.106 . . . . 0.0 113.987 -172.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -74.28 -13.23 60.74 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.783 1.233 . . . . 0.0 114.207 -178.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.9 mmpt? -76.41 -33.12 58.83 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.622 1.169 . . . . 0.0 111.981 175.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.3 mp -91.84 -46.42 14.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 124.687 1.195 . . . . 0.0 110.67 172.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 35.7 mm -84.34 99.01 6.25 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 CA-C-O 122.148 0.975 . . . . 0.0 111.276 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.55 -38.44 87.45 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 126.172 1.789 . . . . 0.0 113.85 177.09 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 -142.52 87.25 9.36 Favored Pre-proline 0 CA--C 1.543 0.706 0 C-N-CA 125.055 1.342 . . . . 0.0 110.616 -176.03 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -68.4 141.98 53.05 Favored 'Trans proline' 0 CA--C 1.538 0.691 0 C-N-CA 123.668 2.912 . . . . 0.0 111.666 -176.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.8 tpt -156.25 134.89 11.68 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.498 1.119 . . . . 0.0 110.773 -171.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -147.68 152.87 38.55 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.518 1.527 . . . . 0.0 111.237 -176.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 6.6 ttp -58.01 -36.89 73.33 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.434 1.094 . . . . 0.0 113.62 -170.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -59.49 -29.66 66.94 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 124.497 1.046 . . . . 0.0 114.296 174.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 27.9 m -85.88 -31.31 22.28 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.282 1.033 . . . . 0.0 111.786 176.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 62.4 mt -60.57 -52.48 61.04 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 CA-C-N 118.887 0.767 . . . . 0.0 110.661 174.465 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.459 ' HE3' ' CZ3' ' A' ' 51' ' ' TRP . 17.0 ptpt -57.89 -32.84 68.12 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 178.523 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 2.8 tppp? -59.29 -38.55 80.45 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 178.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 5.6 ptp180 -86.46 -19.06 30.15 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 114.213 1.19 . . . . 0.0 114.213 175.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 52.9 mt -70.68 -48.15 56.28 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 119.061 0.846 . . . . 0.0 111.964 167.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -62.86 -14.27 44.01 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 115.076 1.51 . . . . 0.0 115.076 -171.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 46.2 p30 -124.25 14.04 8.98 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 126.141 1.776 . . . . 0.0 113.133 177.181 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . 0.269 6.3 p30 37.24 65.75 0.49 Allowed 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 127.149 2.18 . . . . 0.0 114.403 -174.043 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 74.1 t80 -59.29 -24.2 63.07 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.013 1.325 . . . . 0.0 114.097 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -132.42 -174.31 3.41 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 129.101 2.96 . . . . 0.0 111.863 -169.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 2.3 t-105 -112.67 -27.47 8.17 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.761 1.224 . . . . 0.0 113.382 -174.353 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 39.9 t -134.15 145.29 49.12 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.627 1.171 . . . . 0.0 111.773 -177.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -57.24 -18.86 18.01 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.837 1.655 . . . . 0.0 114.769 172.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 10.8 m -53.82 -32.89 54.42 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.206 1.002 . . . . 0.0 113.132 177.191 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -73.91 -42.61 60.4 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.214 1.006 . . . . 0.0 112.757 175.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 49.5 t -60.4 -40.75 92.06 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.271 1.028 . . . . 0.0 112.091 171.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 81.7 mtp -61.5 -41.59 97.52 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.099 0.96 . . . . 0.0 112.553 174.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -65.5 -34.04 77.34 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 174.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -67.26 -42.79 83.32 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 121.25 -0.907 . . . . 0.0 111.762 173.019 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -60.75 -45.86 92.67 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.254 -0.904 . . . . 0.0 112.599 172.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 35.5 t30 -55.62 -45.06 77.57 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.218 0.607 . . . . 0.0 111.678 173.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 88.7 m -62.69 -45.18 93.95 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.389 1.076 . . . . 0.0 112.149 179.104 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 12.7 ttm -55.69 -59.56 4.69 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.537 1.135 . . . . 0.0 112.453 177.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 -65.18 -34.98 79.66 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 121.98 -0.45 . . . . 0.0 112.136 -178.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 16.5 m -58.92 -51.77 68.62 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.322 1.049 . . . . 0.0 111.92 173.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -56.43 -40.08 74.16 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.773 0.829 . . . . 0.0 111.763 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 96.6 m -55.8 -50.72 69.73 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.3 0.64 . . . . 0.0 111.955 171.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -62.25 -26.59 68.47 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 114.07 1.137 . . . . 0.0 114.07 178.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 74.4 mt -73.63 -59.17 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 C-N-CA 123.75 0.82 . . . . 0.0 110.615 173.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -74.29 -46.42 41.28 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 -172.2 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -97.58 152.01 19.48 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.769 1.228 . . . . 0.0 111.305 -179.296 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 49.5 mmtm -81.9 155.87 70.17 Favored Pre-proline 0 N--CA 1.475 0.815 0 C-N-CA 125.343 1.457 . . . . 0.0 111.558 -175.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -62.95 -0.7 2.25 Favored 'Trans proline' 0 CA--C 1.543 0.973 0 C-N-CA 124.181 3.254 . . . . 0.0 115.759 -178.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 64.0 p -114.13 -4.23 13.15 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 126.878 2.071 . . . . 0.0 113.097 178.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 74.9 m-20 -76.24 142.74 41.33 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.038 0.836 . . . . 0.0 110.814 172.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -57.62 -46.27 84.31 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 121.49 -0.756 . . . . 0.0 112.299 -176.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.1 tp -53.63 -28.58 16.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 125.823 1.649 . . . . 0.0 114.629 175.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 55.8 t -75.66 -44.54 40.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 O-C-N 121.021 -1.049 . . . . 0.0 110.758 173.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 67.1 mt -61.11 -36.15 78.94 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 119.058 0.844 . . . . 0.0 111.579 174.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 10.4 mtt -58.9 -51.64 69.15 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.582 1.153 . . . . 0.0 111.972 169.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.27 -40.55 94.5 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.432 0.693 . . . . 0.0 112.536 177.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -61.36 -49.17 78.04 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.793 0.837 . . . . 0.0 111.664 174.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.87 -43.43 98.42 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.735 0.814 . . . . 0.0 112.495 179.419 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 87.2 mt -64.66 -45.79 85.22 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.593 0.757 . . . . 0.0 111.893 173.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -64.38 -36.42 84.08 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.056 -1.027 . . . . 0.0 113.352 -176.213 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 69.5 mttt -57.65 -49.23 77.16 Favored 'General case' 0 N--CA 1.478 0.937 0 O-C-N 121.453 -0.779 . . . . 0.0 111.179 173.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 89.9 mt -66.08 -43.37 92.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 123.918 0.887 . . . . 0.0 111.17 178.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -51.4 -53.3 38.1 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.741 0.816 . . . . 0.0 110.783 173.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 95.6 mt -61.69 -42.61 99.16 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.01 0.524 . . . . 0.0 112.392 177.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.61 -34.59 75.92 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-N 119.084 0.857 . . . . 0.0 113.072 178.506 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -74.69 -54.36 7.55 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.507 1.123 . . . . 0.0 112.401 175.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.9 m -64.94 -23.94 34.48 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 CA-C-N 120.306 1.412 . . . . 0.0 112.509 -178.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -59.29 -31.26 68.96 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 170.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 91.5 mt-30 -90.36 -11.75 39.68 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.016 1.326 . . . . 0.0 112.742 176.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 45.3 ttp -64.91 137.32 97.11 Favored Pre-proline 0 CA--C 1.546 0.792 0 CA-C-N 119.066 0.848 . . . . 0.0 110.571 174.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -66.65 130.9 24.52 Favored 'Trans proline' 0 CA--C 1.537 0.636 0 C-N-CA 122.911 2.407 . . . . 0.0 111.665 -179.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -68.52 -30.52 69.34 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.069 1.347 . . . . 0.0 112.45 178.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -76.35 158.83 31.08 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.655 1.582 . . . . 0.0 113.21 173.566 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -112.68 139.58 48.16 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 124.939 1.296 . . . . 0.0 110.499 177.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 10.2 p -143.97 134.62 21.36 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-O 122.245 1.021 . . . . 0.0 110.76 169.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 45.9 tt0 -64.28 128.85 37.6 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.412 1.885 . . . . 0.0 111.219 174.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 88.5 mt . . . . . 0 CA--C 1.54 0.577 0 N-CA-C 113.208 0.818 . . . . 0.0 113.208 -177.252 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.962 0 N-CA-C 112.279 -0.328 . . . . 0.0 112.279 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -172.22 165.55 6.01 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.965 1.706 . . . . 0.0 111.384 -174.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 26.1 pttm -67.11 139.44 57.52 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.013 0.925 . . . . 0.0 112.822 172.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 45.7 p -148.78 164.75 33.48 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 126.257 1.823 . . . . 0.0 110.582 178.152 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 23.7 p-10 -50.89 -39.24 53.68 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 178.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 66.8 mt-30 -72.62 -44.07 62.44 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 121.561 -0.712 . . . . 0.0 111.634 179.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 89.3 mt -64.22 -32.21 73.71 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 118.707 0.685 . . . . 0.0 111.99 174.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -61.18 -52.7 63.72 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-N 118.443 0.565 . . . . 0.0 109.924 168.521 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -55.09 -41.03 71.07 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.27 -0.894 . . . . 0.0 112.635 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 88.7 mmm -57.64 -56.43 22.04 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.878 -0.513 . . . . 0.0 112.042 170.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -77.19 -9.14 58.58 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 114.984 1.476 . . . . 0.0 114.984 -173.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -117.75 -23.63 7.51 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.353 1.461 . . . . 0.0 112.598 -169.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 18.7 t -127.53 -54.65 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 C-N-CA 123.429 0.692 . . . . 0.0 111.295 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.6 t -64.23 -59.95 3.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 CA-C-N 118.446 0.567 . . . . 0.0 110.652 -174.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 72.1 t -59.36 -46.38 92.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 124.457 1.103 . . . . 0.0 110.664 174.319 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 36.0 ttmt -57.39 -49.77 75.13 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.278 0.631 . . . . 0.0 112.357 -174.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 61.5 m -67.1 -43.85 81.45 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 118.599 0.636 . . . . 0.0 112.089 176.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 82.9 mt -62.28 -35.18 78.21 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 119.021 0.828 . . . . 0.0 112.481 178.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 20.7 t-105 -72.17 -27.09 62.36 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.76 1.624 . . . . 0.0 113.385 175.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.1 mtmp? -85.94 -4.47 59.17 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 177.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 39.7 t-80 -63.93 156.44 27.76 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.98 1.312 . . . . 0.0 113.185 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -57.77 -23.28 51.43 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.503 1.521 . . . . 0.0 113.638 173.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 -123.0 18.93 10.08 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.345 1.458 . . . . 0.0 114.137 -171.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.11 -26.34 63.92 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 176.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 58.9 p-90 -59.22 -35.92 36.41 Favored Pre-proline 0 CA--C 1.547 0.836 0 N-CA-C 117.978 2.585 . . . . 0.0 117.978 -169.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -74.52 -3.5 13.96 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 CA-C-N 123.277 2.206 . . . . 0.0 113.691 173.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 55.9 m-85 -110.3 -5.27 15.3 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.428 1.491 . . . . 0.0 113.14 178.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -62.84 -16.16 57.38 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 179.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -142.18 155.59 64.91 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 125.969 1.708 . . . . 0.0 110.389 -177.206 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -64.48 144.0 83.81 Favored 'Trans proline' 0 CA--C 1.538 0.677 0 C-N-CA 122.641 2.227 . . . . 0.0 111.713 173.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 76.5 t -60.6 115.58 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 123.546 0.738 . . . . 0.0 111.261 175.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 57.9 m-20 -92.44 103.89 16.27 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.249 1.02 . . . . 0.0 109.019 169.146 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.55 -30.08 60.12 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 113.418 0.896 . . . . 0.0 113.418 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 81.9 mt -65.03 -49.88 77.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 124.85 1.26 . . . . 0.0 111.155 174.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -63.84 -37.3 86.89 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.819 1.248 . . . . 0.0 113.403 -177.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.4 mp -89.68 -1.76 58.1 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.231 1.413 . . . . 0.0 112.36 178.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 23.0 m120 52.78 52.64 13.57 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 126.162 1.785 . . . . 0.0 113.264 -177.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 29.1 mt -107.71 94.28 11.91 Favored Pre-proline 0 CA--C 1.544 0.713 0 C-N-CA 126.26 1.824 . . . . 0.0 109.767 -179.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -68.72 -13.81 37.85 Favored 'Trans proline' 0 CA--C 1.542 0.877 0 C-N-CA 123.084 2.523 . . . . 0.0 114.55 -170.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 -136.65 21.05 3.1 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.573 1.549 . . . . 0.0 112.921 -173.437 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 64.7 t80 -46.14 -50.49 15.45 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.338 1.055 . . . . 0.0 113.827 -175.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 98.8 m-70 -73.48 -17.81 61.19 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 114.454 1.279 . . . . 0.0 114.454 -177.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 43.7 mttp -68.15 -39.53 82.63 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 119.343 0.974 . . . . 0.0 111.855 174.339 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.2 mp -81.37 -46.11 20.46 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 C-N-CA 124.8 1.24 . . . . 0.0 110.288 175.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 49.4 mm -98.57 98.48 7.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 CA-C-O 122.224 1.011 . . . . 0.0 111.353 -176.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.94 -32.5 74.06 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 126.397 1.879 . . . . 0.0 113.868 177.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -141.2 75.78 22.82 Favored Pre-proline 0 CA--C 1.542 0.664 0 C-N-CA 125.259 1.423 . . . . 0.0 110.559 -171.317 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -67.08 142.35 61.17 Favored 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 124.174 3.249 . . . . 0.0 111.289 -178.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 8.1 tpt -158.09 136.21 10.8 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.61 1.164 . . . . 0.0 110.221 -170.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -145.98 149.94 35.11 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.929 1.292 . . . . 0.0 111.563 -176.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.4 ttp -57.99 -37.01 73.45 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.667 1.187 . . . . 0.0 113.079 -171.052 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -61.7 -26.1 66.4 Favored Glycine 0 CA--C 1.533 1.178 0 C-N-CA 125.02 1.295 . . . . 0.0 114.597 174.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 20.2 m -82.74 -41.73 18.88 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.178 0.991 . . . . 0.0 110.708 170.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 68.4 mt -56.02 -51.9 56.23 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 124.114 0.966 . . . . 0.0 111.39 179.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.9 -35.68 71.38 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 113.291 0.848 . . . . 0.0 113.291 176.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -69.39 -34.34 74.37 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.089 0.956 . . . . 0.0 113.409 -177.301 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 4.9 ptp180 -76.89 -30.59 56.25 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 170.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 74.5 mt -63.9 -37.4 87.27 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 119.643 1.111 . . . . 0.0 113.011 168.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -75.87 8.55 2.99 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.495 1.518 . . . . 0.0 114.087 177.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 37.0 m-80 -137.3 167.07 22.31 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.652 1.981 . . . . 0.0 111.952 -179.564 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 5.4 p30 -80.62 111.49 17.1 Favored 'General case' 0 CA--C 1.545 0.75 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 168.025 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 56.2 t80 -148.25 -38.12 0.18 Allowed 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.864 0.691 . . . . 0.0 112.864 -171.447 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -138.56 173.12 11.92 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.35 1.86 . . . . 0.0 111.365 169.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.4 t-105 -108.86 -20.33 13.09 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 125.293 1.437 . . . . 0.0 112.162 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 40.5 t -130.34 138.48 50.45 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 126.087 1.755 . . . . 0.0 111.623 -171.132 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -65.92 -17.08 64.42 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 114.968 1.47 . . . . 0.0 114.968 178.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 35.6 p -53.18 -26.92 19.02 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.073 1.349 . . . . 0.0 114.019 172.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 53.7 mm-40 -80.54 -41.89 23.37 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.213 1.005 . . . . 0.0 111.999 177.032 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 52.0 t -60.37 -41.8 94.51 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.417 -0.802 . . . . 0.0 111.994 169.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 88.8 mtp -60.07 -43.88 95.13 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 121.305 -0.872 . . . . 0.0 112.827 175.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -72.06 -28.3 63.25 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 179.13 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 -66.32 -44.33 83.68 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.217 -0.927 . . . . 0.0 111.071 169.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -58.5 -47.53 83.78 Favored 'General case' 0 CA--C 1.539 0.519 0 O-C-N 121.273 -0.892 . . . . 0.0 112.422 172.225 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -61.55 -39.3 90.61 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 118.635 0.652 . . . . 0.0 111.724 177.225 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 89.2 m -63.61 -44.71 93.18 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.88 0.872 . . . . 0.0 111.972 176.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 52.0 ttp -56.67 -52.7 63.9 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.011 0.924 . . . . 0.0 112.675 176.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -68.48 -34.42 75.9 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 17.5 m -59.34 -52.05 67.31 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.295 1.038 . . . . 0.0 111.807 173.197 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 -57.48 -37.43 72.91 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.89 0.876 . . . . 0.0 112.193 -178.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 94.6 m -57.11 -44.12 82.97 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.18 0.992 . . . . 0.0 112.188 173.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -69.65 -30.05 67.66 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.393 1.077 . . . . 0.0 113.68 176.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 82.3 mt -74.26 -57.57 6.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 123.476 0.711 . . . . 0.0 110.747 178.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 37.4 t80 -68.11 -30.25 69.36 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 114.068 1.136 . . . . 0.0 114.068 -173.132 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 37.9 m-80 -113.74 162.92 15.69 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.981 0.912 . . . . 0.0 112.803 -169.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -68.6 148.12 98.06 Favored Pre-proline 0 N--CA 1.472 0.633 0 C-N-CA 124.635 1.174 . . . . 0.0 110.321 175.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -65.85 -6.89 15.18 Favored 'Trans proline' 0 CA--C 1.544 1.016 0 C-N-CA 123.718 2.945 . . . . 0.0 114.654 -176.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 53.9 p -114.3 -0.48 13.85 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 126.686 1.994 . . . . 0.0 113.199 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -66.3 147.2 53.66 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 121.528 -0.732 . . . . 0.0 110.967 173.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -52.56 -47.79 66.58 Favored 'General case' 0 CA--C 1.536 0.432 0 O-C-N 121.562 -0.711 . . . . 0.0 112.422 179.154 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.2 tp -58.37 -30.31 40.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -179.224 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 41.0 t -71.56 -47.43 58.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 O-C-N 121.499 -0.751 . . . . 0.0 110.332 173.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 76.1 mt -61.86 -36.73 82.09 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.124 0.875 . . . . 0.0 111.844 177.409 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 13.5 mtt -59.15 -51.53 69.63 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 124.638 1.175 . . . . 0.0 111.936 170.025 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.94 -39.07 90.82 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.265 0.626 . . . . 0.0 112.675 177.257 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 88.4 mt-30 -61.33 -47.76 84.42 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 119.121 0.873 . . . . 0.0 111.826 173.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -61.61 -45.59 93.44 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.73 0.812 . . . . 0.0 112.48 178.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 83.5 mt -65.91 -44.72 84.38 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.761 0.824 . . . . 0.0 112.268 175.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -65.08 -36.19 83.54 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 120.972 -1.08 . . . . 0.0 112.755 -177.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 55.0 mtmt -58.68 -45.5 89.3 Favored 'General case' 0 N--CA 1.474 0.746 0 O-C-N 121.5 -0.75 . . . . 0.0 111.701 172.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 93.2 mt -66.86 -43.51 89.54 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 123.507 0.723 . . . . 0.0 110.927 176.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -51.69 -51.42 56.12 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.757 0.823 . . . . 0.0 111.136 173.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 91.9 mt -61.98 -41.77 98.39 Favored 'General case' 0 CA--C 1.541 0.603 0 O-C-N 121.738 -0.601 . . . . 0.0 112.573 178.015 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 91.2 mm-40 -61.44 -36.47 80.49 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 119.392 0.997 . . . . 0.0 113.173 174.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 66.9 mmtt -72.62 -51.57 19.09 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.973 0.909 . . . . 0.0 112.435 177.311 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 6.0 m -67.98 -24.85 30.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 CA-C-N 120.333 1.424 . . . . 0.0 112.352 179.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -59.14 -27.19 65.39 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.535 -0.728 . . . . 0.0 112.833 171.18 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -99.84 2.22 43.7 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.539 1.536 . . . . 0.0 112.427 178.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 11.2 ttm -55.7 141.05 66.21 Favored Pre-proline 0 CA--C 1.548 0.869 0 C-N-CA 124.671 1.188 . . . . 0.0 111.824 172.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -67.24 122.15 9.38 Favored 'Trans proline' 0 CA--C 1.538 0.68 0 C-N-CA 122.996 2.464 . . . . 0.0 109.566 169.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -70.63 -17.99 62.87 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -171.453 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 9.8 mp0 -94.39 159.58 15.05 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.551 1.54 . . . . 0.0 111.941 179.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -120.96 129.81 53.59 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.113 1.365 . . . . 0.0 110.856 -175.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 9.5 p -152.63 151.41 11.87 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 124.624 1.17 . . . . 0.0 112.338 -179.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -57.24 137.91 55.38 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.55 1.54 . . . . 0.0 112.619 169.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 52.0 mt . . . . . 0 N--CA 1.47 0.54 0 C-N-CA 123.486 0.714 . . . . 0.0 112.444 169.635 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.232 0 N-CA-C 112.056 -0.418 . . . . 0.0 112.056 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 37.7 ptt180 -155.11 156.8 36.45 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.569 1.548 . . . . 0.0 110.74 172.074 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 36.3 mtpt -76.02 143.16 41.61 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 121.285 0.564 . . . . 0.0 110.053 168.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 67.0 p -139.45 165.41 27.31 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 125.134 1.373 . . . . 0.0 109.953 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 27.1 p-10 -52.49 -31.33 34.58 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 171.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.5 mm100 -67.91 -50.43 56.25 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.775 0.83 . . . . 0.0 111.377 176.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.0 mt -65.51 -32.65 74.37 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.736 -0.603 . . . . 0.0 112.519 175.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -61.6 -50.63 71.82 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 118.341 0.518 . . . . 0.0 110.77 169.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 65.4 t80 -57.61 -41.26 80.91 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.624 0.77 . . . . 0.0 112.313 178.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 91.0 mmm -56.91 -50.41 72.65 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 121.886 -0.509 . . . . 0.0 112.115 171.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -83.2 -10.07 58.8 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.704 1.372 . . . . 0.0 114.704 -174.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 61.9 t30 -119.79 -15.87 8.82 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.196 1.399 . . . . 0.0 113.297 -169.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 42.0 t -130.28 -53.56 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 C-N-CA 123.281 0.632 . . . . 0.0 110.96 176.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.6 t -69.83 -65.72 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 123.119 0.568 . . . . 0.0 110.77 -172.033 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 79.4 t -57.19 -46.0 84.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 124.398 1.079 . . . . 0.0 110.368 173.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.8 tttt -59.84 -40.05 87.19 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.386 0.674 . . . . 0.0 112.734 -175.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 62.7 m -73.85 -45.45 50.99 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 118.343 0.52 . . . . 0.0 111.801 174.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 67.9 mt -62.03 -33.46 74.41 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.295 0.638 . . . . 0.0 112.388 179.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 25.0 t-105 -69.46 -31.26 69.44 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.428 1.491 . . . . 0.0 113.188 175.085 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 56.4 mtmt -82.49 -5.34 58.65 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 113.692 0.997 . . . . 0.0 113.692 176.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 39.4 t-80 -64.22 156.38 28.92 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.6 1.16 . . . . 0.0 113.401 -179.023 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 19.2 mm100 -59.69 -23.27 62.98 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.241 1.416 . . . . 0.0 114.104 175.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -124.65 20.22 8.6 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.214 1.406 . . . . 0.0 113.48 -172.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.64 -26.59 64.49 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.102 1.361 . . . . 0.0 113.958 176.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 64.1 p-90 -58.87 -34.16 22.22 Favored Pre-proline 0 CA--C 1.547 0.84 0 N-CA-C 117.875 2.546 . . . . 0.0 117.875 -169.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -77.75 -0.18 10.4 Favored 'Trans proline' 0 CA--C 1.544 0.994 0 CA-C-N 123.213 2.183 . . . . 0.0 113.387 175.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -114.63 -3.67 12.88 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.759 1.624 . . . . 0.0 113.158 178.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 18.4 m-30 -62.68 -7.52 5.0 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 115.276 1.584 . . . . 0.0 115.276 179.443 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 25.1 pt20 -159.66 157.98 26.89 Favored Pre-proline 0 CA--C 1.545 0.773 0 C-N-CA 126.188 1.795 . . . . 0.0 110.009 -169.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -66.08 142.25 67.14 Favored 'Trans proline' 0 CA--C 1.538 0.676 0 C-N-CA 122.702 2.268 . . . . 0.0 111.731 177.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 68.1 t -60.3 139.0 20.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 123.859 0.864 . . . . 0.0 111.322 173.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 50.6 m-20 -114.4 107.09 15.09 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.079 1.352 . . . . 0.0 109.497 169.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.32 -26.89 63.59 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.148 0.979 . . . . 0.0 113.419 177.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 80.3 mt -66.56 -50.17 68.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 124.979 1.311 . . . . 0.0 110.864 173.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -64.56 -40.66 95.98 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.547 1.139 . . . . 0.0 112.695 -178.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 47.7 mt -88.78 -0.76 57.63 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.555 1.142 . . . . 0.0 114.007 179.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 61.0 t30 52.28 58.07 5.8 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.019 1.728 . . . . 0.0 113.68 -179.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 54.2 mt -114.42 83.21 8.32 Favored Pre-proline 0 CA--C 1.547 0.842 0 C-N-CA 126.331 1.852 . . . . 0.0 110.089 -176.074 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -67.79 -7.44 19.53 Favored 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 124.207 3.271 . . . . 0.0 115.456 -169.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -130.38 19.04 5.31 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.774 1.63 . . . . 0.0 112.257 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 70.4 t80 -46.96 -56.44 6.39 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.496 1.118 . . . . 0.0 113.526 -173.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -76.23 -3.07 34.44 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 114.608 1.336 . . . . 0.0 114.608 -179.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -84.1 -42.0 16.53 Favored 'General case' 0 N--CA 1.477 0.879 0 O-C-N 121.127 -0.983 . . . . 0.0 110.855 173.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.2 mp -81.67 -51.04 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 124.103 0.961 . . . . 0.0 110.408 173.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 44.2 mm -71.92 114.47 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 CA-C-O 121.556 0.693 . . . . 0.0 110.142 178.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 70.6 mmtt -83.85 -27.93 28.37 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.619 1.168 . . . . 0.0 113.045 179.595 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 21.4 p30 -153.16 81.63 5.05 Favored Pre-proline 0 CA--C 1.548 0.866 0 C-N-CA 126.09 1.756 . . . . 0.0 111.326 -170.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -69.17 138.11 38.86 Favored 'Trans proline' 0 CA--C 1.54 0.791 0 C-N-CA 123.498 2.799 . . . . 0.0 111.097 -179.126 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.8 tpt -154.59 141.19 18.91 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.236 1.414 . . . . 0.0 110.03 -178.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -144.68 148.14 33.87 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.397 1.479 . . . . 0.0 111.139 -177.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.6 ttp -57.19 -36.2 70.55 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.903 1.281 . . . . 0.0 113.3 -172.216 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.89 -22.82 60.54 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 125.127 1.346 . . . . 0.0 114.603 173.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 24.5 m -97.12 -34.59 11.09 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.846 1.258 . . . . 0.0 111.425 174.229 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 81.4 mt -53.94 -50.93 50.08 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 CA-C-N 119.31 0.959 . . . . 0.0 110.569 173.145 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -61.88 -32.5 72.87 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 178.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.408 ' HA ' ' HE3' ' A' ' 88' ' ' LYS . 1.1 tpmt? -68.78 -31.9 71.26 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -175.238 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 3.8 ptp180 -78.08 -26.45 48.17 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 113.941 1.089 . . . . 0.0 113.941 170.041 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 82.2 mt -70.66 -31.45 68.38 Favored 'General case' 0 N--CA 1.481 1.092 0 CA-C-N 119.648 1.113 . . . . 0.0 113.037 168.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -68.18 3.61 1.58 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.401 1.48 . . . . 0.0 113.476 171.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -130.74 163.18 27.85 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 127.685 2.394 . . . . 0.0 110.484 175.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -83.31 37.5 0.56 Allowed 'General case' 0 CA--C 1.55 0.966 0 O-C-N 120.834 -1.166 . . . . 0.0 111.581 169.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -60.76 -32.14 71.46 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.088 1.355 . . . . 0.0 114.32 -168.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -132.99 175.88 8.98 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 127.602 2.361 . . . . 0.0 111.057 178.199 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 9.7 t-105 -100.95 -25.91 13.92 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.893 1.277 . . . . 0.0 112.886 -178.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 34.7 t -143.77 148.64 35.91 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.287 1.035 . . . . 0.0 112.82 -170.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -65.36 -18.8 65.6 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 115.991 1.848 . . . . 0.0 115.991 -174.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 32.6 t -56.08 -32.48 64.16 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.398 0.999 . . . . 0.0 112.603 178.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -63.53 -45.97 88.13 Favored 'General case' 0 CA--C 1.544 0.727 0 O-C-N 121.272 -0.892 . . . . 0.0 112.264 173.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 48.8 t -65.28 -37.1 86.13 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.869 0.868 . . . . 0.0 112.602 174.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 82.5 mtp -65.65 -40.47 92.51 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.724 0.81 . . . . 0.0 111.881 175.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -62.1 -39.8 93.72 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.369 0.668 . . . . 0.0 112.076 170.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 85.2 m-20 -64.28 -39.58 94.23 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.366 0.985 . . . . 0.0 112.73 175.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -61.01 -46.98 88.54 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.5 -0.75 . . . . 0.0 112.315 170.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 17.5 t30 -56.63 -45.25 81.66 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.084 0.553 . . . . 0.0 111.893 174.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 52.3 m -62.51 -40.36 96.47 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.381 1.072 . . . . 0.0 112.687 175.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 53.1 ttp -59.52 -52.32 66.09 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 119.708 1.14 . . . . 0.0 112.061 177.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -68.45 -39.81 81.32 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 179.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 85.6 m -64.72 -47.55 77.89 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.588 0.755 . . . . 0.0 112.037 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -64.69 -31.94 73.39 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 119.024 0.829 . . . . 0.0 112.121 -179.551 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 81.3 m -61.66 -43.44 98.86 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.816 0.846 . . . . 0.0 112.794 170.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -68.02 -32.2 72.41 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.929 1.085 . . . . 0.0 113.929 178.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 92.3 mt -64.38 -57.63 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 C-N-CA 123.471 0.708 . . . . 0.0 110.994 177.21 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 31.0 t80 -68.79 -35.94 77.65 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 114.375 1.25 . . . . 0.0 114.375 -172.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 64.1 m-80 -103.98 159.84 15.33 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.804 0.841 . . . . 0.0 113.164 -169.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 3.4 mppt? -66.0 148.44 98.34 Favored Pre-proline 0 N--CA 1.472 0.667 0 C-N-CA 124.187 0.995 . . . . 0.0 110.523 172.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -65.37 -7.8 16.96 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 123.563 2.842 . . . . 0.0 114.567 -177.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 69.5 p -115.53 1.79 13.69 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 126.473 1.909 . . . . 0.0 113.108 179.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -65.89 143.73 57.26 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 121.491 -0.756 . . . . 0.0 110.509 173.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -52.59 -45.62 66.59 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.633 -0.667 . . . . 0.0 112.526 -178.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 9.5 tp -56.55 -34.7 42.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 124.637 1.175 . . . . 0.0 113.885 177.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 55.7 t -71.49 -42.52 72.71 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 C-N-CA 123.403 0.681 . . . . 0.0 110.65 175.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 66.5 mt -62.37 -36.24 81.65 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.099 0.863 . . . . 0.0 111.917 175.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -58.11 -53.45 58.11 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 118.298 0.499 . . . . 0.0 110.919 170.597 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -59.39 -41.43 89.35 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 123.745 0.818 . . . . 0.0 112.399 179.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -61.16 -39.9 91.84 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.999 0.92 . . . . 0.0 113.12 175.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -79.13 -31.57 44.17 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 85.1 mt -71.02 -46.4 62.2 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.351 0.66 . . . . 0.0 111.297 170.053 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -63.31 -38.04 89.6 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 121.102 -0.999 . . . . 0.0 113.244 -173.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 4.9 ptpp? -60.14 -39.36 86.06 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 121.456 -0.778 . . . . 0.0 112.543 175.136 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 78.4 mt -73.18 -41.2 58.53 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 C-N-CA 124.193 0.997 . . . . 0.0 111.518 175.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -50.96 -52.14 45.51 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 119.162 0.892 . . . . 0.0 110.438 172.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.3 mt -63.63 -40.1 96.03 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 118.558 -0.734 . . . . 0.0 112.909 177.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -68.43 -30.56 69.48 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 120.373 1.442 . . . . 0.0 112.657 179.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 69.0 mmtt -75.94 -48.19 22.19 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 117.89 -1.052 . . . . 0.0 112.301 176.122 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.9 m -67.84 -25.79 33.33 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 CA-C-N 120.765 1.62 . . . . 0.0 112.04 176.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -62.19 -30.53 71.13 Favored 'General case' 0 CA--C 1.541 0.609 0 O-C-N 121.492 -0.755 . . . . 0.0 112.477 171.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -91.29 -3.26 57.02 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.062 1.345 . . . . 0.0 112.913 176.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 5.9 ttm -57.0 141.2 76.5 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 124.152 0.981 . . . . 0.0 111.271 171.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -63.05 144.23 92.31 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 C-N-CA 122.494 2.129 . . . . 0.0 109.911 168.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -74.87 -23.46 58.4 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 114.239 1.199 . . . . 0.0 114.239 -179.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -100.04 155.25 17.82 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.636 1.574 . . . . 0.0 113.024 -169.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -112.79 137.1 51.62 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.962 1.705 . . . . 0.0 111.229 -174.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 12.7 p -146.62 141.18 20.69 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 C-N-CA 124.657 1.183 . . . . 0.0 110.735 172.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -68.52 134.71 50.47 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.509 1.124 . . . . 0.0 111.074 175.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 96.0 mt . . . . . 0 CA--C 1.539 0.546 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 -175.988 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.038 0 N-CA-C 114.474 0.55 . . . . 0.0 114.474 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 -162.9 163.55 26.3 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 127.65 2.38 . . . . 0.0 109.586 170.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.8 ttmm -73.0 142.57 47.74 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 122.907 0.483 . . . . 0.0 111.634 177.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 82.6 p -138.7 165.16 27.68 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.935 1.694 . . . . 0.0 109.51 -179.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 22.2 t30 -51.36 -31.43 22.11 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 114.168 1.173 . . . . 0.0 114.168 174.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 69.3 mt-30 -74.84 -48.79 23.23 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.166 -0.959 . . . . 0.0 112.791 174.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 89.1 mt -61.95 -31.43 71.77 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 120.331 1.423 . . . . 0.0 112.479 173.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.5 tp60 -60.8 -52.67 64.09 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.107 0.963 . . . . 0.0 110.906 170.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 83.5 t80 -55.83 -41.95 75.02 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.088 0.955 . . . . 0.0 112.446 176.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 87.9 mmm -55.21 -53.99 49.0 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 122.685 0.394 . . . . 0.0 111.267 172.066 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -70.67 -22.93 62.43 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 114.833 1.42 . . . . 0.0 114.833 -178.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 18.8 m-80 -108.04 -17.23 14.09 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 115.074 1.509 . . . . 0.0 115.074 -168.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.6 t -138.83 -41.08 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 CA-C-N 119.078 0.854 . . . . 0.0 112.036 -176.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 11.9 t -71.62 -69.96 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 176.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 69.5 t -58.36 -48.63 84.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 126.138 1.775 . . . . 0.0 111.495 177.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 70.2 tttt -56.54 -43.43 79.86 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.491 0.716 . . . . 0.0 112.884 -171.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 60.4 m -85.28 -34.93 21.81 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.327 0.651 . . . . 0.0 112.455 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 68.6 mt -59.65 -32.85 70.83 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 119.629 1.104 . . . . 0.0 111.712 169.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 29.3 t-105 -73.14 -34.41 66.07 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 126.048 1.739 . . . . 0.0 113.162 175.068 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp -76.03 -11.17 59.9 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.554 1.142 . . . . 0.0 113.982 174.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 55.7 t-80 -61.23 150.83 33.36 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.168 1.387 . . . . 0.0 113.181 -178.188 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -60.37 -20.94 61.41 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.014 1.326 . . . . 0.0 113.727 178.357 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -116.06 16.81 16.01 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.535 1.534 . . . . 0.0 113.643 -178.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.67 -29.85 65.06 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 113.979 1.103 . . . . 0.0 113.979 177.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 68.1 p-90 -57.67 -34.05 22.65 Favored Pre-proline 0 CA--C 1.548 0.9 0 N-CA-C 118.019 2.6 . . . . 0.0 118.019 -170.334 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -75.51 -4.78 15.75 Favored 'Trans proline' 0 CA--C 1.543 0.966 0 CA-C-N 123.598 2.321 . . . . 0.0 113.408 174.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -108.16 -4.52 17.59 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.38 1.472 . . . . 0.0 112.968 178.195 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.7 m-30 -64.47 -17.89 64.27 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 114.011 1.115 . . . . 0.0 114.011 179.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 7.7 mp0 -139.36 155.06 72.31 Favored Pre-proline 0 CA--C 1.544 0.747 0 C-N-CA 125.726 1.611 . . . . 0.0 110.203 -176.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -65.68 141.56 66.77 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 122.252 1.968 . . . . 0.0 111.888 174.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 50.7 t -56.93 145.54 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 124.561 1.144 . . . . 0.0 111.627 172.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -121.64 120.57 35.13 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 124.55 1.14 . . . . 0.0 110.049 169.708 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.55 -31.28 70.39 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 123.2 0.6 . . . . 0.0 112.59 178.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 81.8 mt -67.37 -49.69 69.38 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 C-N-CA 124.525 1.13 . . . . 0.0 110.923 173.552 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm -64.34 -39.35 93.72 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.219 1.408 . . . . 0.0 113.445 -176.296 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.4 mp -90.93 0.57 57.48 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.249 1.02 . . . . 0.0 113.058 177.233 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 65.9 t30 54.18 53.91 10.33 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 126.001 1.721 . . . . 0.0 113.636 -179.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 52.6 mt -111.51 95.31 26.39 Favored Pre-proline 0 CA--C 1.546 0.797 0 C-N-CA 126.415 1.886 . . . . 0.0 110.212 -174.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -68.92 -8.37 23.33 Favored 'Trans proline' 0 CA--C 1.544 1.022 0 C-N-CA 123.455 2.77 . . . . 0.0 114.632 -174.001 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -138.41 21.39 2.75 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 125.569 1.548 . . . . 0.0 112.881 -174.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 47.5 t80 -50.61 -55.13 17.73 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 120.44 -1.413 . . . . 0.0 113.484 -174.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -76.7 -10.56 59.47 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.692 1.197 . . . . 0.0 114.208 -179.154 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.3 mmmm -72.93 -44.33 61.32 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.404 1.082 . . . . 0.0 110.117 176.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.4 mp -81.41 -52.4 13.97 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 123.963 0.905 . . . . 0.0 110.075 172.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 20.5 mm -81.43 104.89 10.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 CA-C-O 122.183 0.992 . . . . 0.0 111.629 -176.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 69.8 mmtt -69.7 -35.09 74.78 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.856 1.662 . . . . 0.0 113.603 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 70.5 m-80 -143.1 94.34 6.35 Favored Pre-proline 0 CA--C 1.545 0.776 0 C-N-CA 125.79 1.636 . . . . 0.0 110.013 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -70.67 149.21 60.71 Favored 'Trans proline' 0 CA--C 1.538 0.721 0 C-N-CA 123.141 2.561 . . . . 0.0 111.103 178.161 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -153.93 136.06 14.77 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.434 1.094 . . . . 0.0 110.182 -174.596 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -143.82 148.98 36.32 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.56 1.944 . . . . 0.0 110.815 177.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.6 ttp -57.94 -34.31 69.76 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.797 1.239 . . . . 0.0 113.043 -171.469 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -56.87 -27.6 56.53 Favored Glycine 0 CA--C 1.532 1.145 0 C-N-CA 125.375 1.464 . . . . 0.0 114.394 173.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 43.7 m -78.38 -45.92 21.23 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 118.032 0.916 . . . . 0.0 110.878 169.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.9 mt -55.82 -53.76 34.01 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 C-N-CA 125.076 1.35 . . . . 0.0 111.754 -175.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 4.8 ptpt -54.15 -38.2 65.26 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 174.069 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.503 ' HE2' ' HA ' ' A' ' 88' ' ' LYS . 0.2 OUTLIER -71.03 -39.31 72.41 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.156 0.982 . . . . 0.0 113.179 -176.996 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 12.4 ptp180 -72.43 -32.34 66.23 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 113.683 0.994 . . . . 0.0 113.683 172.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 53.2 mt -61.19 -43.54 98.71 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.416 0.686 . . . . 0.0 112.821 169.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -59.63 -39.37 84.1 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 -176.138 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -108.55 17.21 22.26 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 -171.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 27.1 m-20 54.79 59.72 3.92 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.467 1.907 . . . . 0.0 114.159 174.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 76.6 t80 -63.55 -20.5 65.69 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.401 1.08 . . . . 0.0 113.588 178.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -145.06 177.48 8.74 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 129.483 3.113 . . . . 0.0 110.768 -173.62 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.7 t-105 -104.47 -27.5 11.88 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.264 1.026 . . . . 0.0 112.843 174.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 20.2 m -126.15 138.62 53.68 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.078 0.951 . . . . 0.0 113.273 -168.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -65.52 -19.74 66.05 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 115.939 1.829 . . . . 0.0 115.939 -175.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 16.8 m -56.55 -28.0 59.05 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.179 0.9 . . . . 0.0 112.826 173.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 56.5 mm-40 -70.35 -43.72 69.61 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.629 0.771 . . . . 0.0 112.03 173.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 42.8 t -62.51 -36.41 82.46 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 121.437 -0.789 . . . . 0.0 112.46 172.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 79.0 mtp -63.64 -40.04 95.87 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 121.392 -0.818 . . . . 0.0 112.36 175.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.06 -32.01 73.28 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.262 0.625 . . . . 0.0 112.144 174.923 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -72.85 -42.45 63.71 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.505 0.722 . . . . 0.0 111.554 178.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 -59.49 -46.28 89.26 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 118.546 0.612 . . . . 0.0 112.148 169.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 24.5 t30 -56.84 -44.51 82.17 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.02 0.528 . . . . 0.0 112.054 174.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 36.8 m -66.54 -36.41 82.6 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.852 0.861 . . . . 0.0 112.265 178.174 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 48.5 ttp -61.62 -55.47 30.25 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.27 -0.894 . . . . 0.0 112.083 174.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -65.72 -38.66 89.79 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 122.039 -0.413 . . . . 0.0 111.845 -179.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 91.8 m -66.0 -46.3 78.47 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 121.572 -0.705 . . . . 0.0 112.46 178.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.1 p30 -63.79 -31.64 72.88 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 120.117 1.326 . . . . 0.0 112.315 178.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 33.4 m -59.78 -47.51 85.39 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 118.917 -0.563 . . . . 0.0 112.047 169.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -68.51 -31.06 70.04 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 114.048 1.129 . . . . 0.0 114.048 179.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 88.2 mt -67.78 -59.3 3.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 123.304 0.642 . . . . 0.0 110.607 175.195 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 32.2 t80 -71.79 -35.15 69.9 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 114.023 1.119 . . . . 0.0 114.023 -171.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -105.8 155.09 19.64 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.334 1.053 . . . . 0.0 111.64 -172.308 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -72.91 154.04 91.0 Favored Pre-proline 0 N--CA 1.471 0.609 0 C-N-CA 124.304 1.041 . . . . 0.0 110.429 178.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -64.78 -0.82 3.45 Favored 'Trans proline' 0 CA--C 1.545 1.05 0 C-N-CA 123.748 2.965 . . . . 0.0 114.883 -179.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 64.5 p -116.31 -2.58 12.08 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 126.999 2.12 . . . . 0.0 113.134 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 62.4 m-20 -71.51 143.21 50.06 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 119.08 0.854 . . . . 0.0 110.449 171.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -56.05 -47.34 78.09 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 121.538 -0.726 . . . . 0.0 112.373 -175.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.5 tp -52.34 -30.91 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 125.201 1.4 . . . . 0.0 114.332 177.029 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 52.4 t -74.05 -47.19 43.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 O-C-N 121.569 -0.707 . . . . 0.0 110.809 174.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 76.1 mt -61.48 -37.35 83.32 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 119.237 0.926 . . . . 0.0 111.66 177.105 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 7.8 mtp -60.13 -50.77 72.36 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.506 1.523 . . . . 0.0 111.999 170.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.91 -39.68 90.27 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.55 0.74 . . . . 0.0 112.824 175.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 88.9 mt-30 -60.83 -48.53 81.4 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 119.413 1.006 . . . . 0.0 111.823 173.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -61.19 -42.64 98.94 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.512 0.725 . . . . 0.0 112.671 178.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 86.7 mt -66.02 -45.84 80.04 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.607 0.763 . . . . 0.0 112.067 173.381 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -64.43 -39.65 94.24 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 121.054 -1.028 . . . . 0.0 112.621 -176.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 5.2 mtpm? -56.3 -36.98 69.27 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 121.529 -0.732 . . . . 0.0 112.041 175.038 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 68.4 mt -75.24 -46.65 38.15 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 123.627 0.771 . . . . 0.0 111.073 173.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 43.9 t80 -49.25 -48.22 45.92 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 119.933 1.242 . . . . 0.0 111.771 174.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.3 mt -65.43 -38.89 91.25 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.32 -0.862 . . . . 0.0 113.046 178.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -67.6 -29.37 68.69 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 119.97 1.259 . . . . 0.0 112.376 176.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 28.7 mmtp -75.53 -49.98 17.05 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.25 1.42 . . . . 0.0 112.577 178.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 7.1 m -69.84 -25.41 28.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 119.289 0.949 . . . . 0.0 111.736 178.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -61.65 -29.81 70.31 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.665 -0.647 . . . . 0.0 112.453 170.157 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -96.96 1.26 50.14 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.595 1.558 . . . . 0.0 112.626 177.268 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 8.4 ttm -54.13 139.67 54.51 Favored Pre-proline 0 CA--C 1.544 0.725 0 C-N-CA 124.271 1.028 . . . . 0.0 111.306 172.226 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -66.51 117.95 5.14 Favored 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 122.463 2.109 . . . . 0.0 108.568 169.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 -65.64 -28.49 69.15 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 -173.044 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -83.75 164.4 19.61 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.135 1.774 . . . . 0.0 111.953 172.138 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -132.24 143.22 49.77 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.111 0.964 . . . . 0.0 111.731 -175.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 55.0 t -130.69 133.29 63.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 125.504 1.521 . . . . 0.0 110.371 -176.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -68.07 117.05 9.41 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.68 1.592 . . . . 0.0 111.221 170.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 80.6 mt . . . . . 0 N--CA 1.472 0.654 0 N-CA-C 113.245 0.831 . . . . 0.0 113.245 -178.32 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.975 0 CA-C-O 121.053 0.252 . . . . 0.0 113.24 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 37.8 ptt180 -159.17 160.47 35.53 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.91 1.684 . . . . 0.0 110.982 175.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 22.5 ptmt -70.87 132.85 45.89 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.584 0.753 . . . . 0.0 110.837 169.408 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 77.4 p -140.62 161.59 37.39 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 125.076 1.35 . . . . 0.0 111.38 -177.087 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 26.5 p-10 -48.99 -38.94 24.71 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 114.066 1.135 . . . . 0.0 114.066 170.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -69.7 -51.22 36.39 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.65 0.78 . . . . 0.0 111.557 178.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.5 mt -65.73 -30.18 70.81 Favored 'General case' 0 CA--C 1.54 0.582 0 O-C-N 121.652 -0.655 . . . . 0.0 112.36 177.423 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 44.7 tt0 -60.8 -52.54 64.66 Favored 'General case' 0 C--O 1.224 -0.268 0 C-N-CA 123.427 0.691 . . . . 0.0 110.237 169.056 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -56.25 -42.18 76.96 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 118.836 0.744 . . . . 0.0 112.15 179.14 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 96.5 mmm -55.98 -50.71 70.06 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 172.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -84.44 -11.5 56.09 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -174.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 66.6 t30 -117.19 -18.86 9.88 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.55 1.54 . . . . 0.0 112.872 -170.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 6.0 t -133.6 -49.67 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 C-N-CA 123.606 0.762 . . . . 0.0 111.869 -177.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 22.3 t -69.28 -64.22 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 CA-C-N 119.095 0.861 . . . . 0.0 110.794 -176.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 45.0 t -53.83 -50.07 54.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 124.864 1.265 . . . . 0.0 109.841 171.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.3 tppt? -60.74 -26.35 67.13 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 -174.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 21.0 m -98.66 -39.65 8.57 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-N 118.948 0.795 . . . . 0.0 112.429 177.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 80.7 mt -59.0 -30.14 67.77 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.485 -0.759 . . . . 0.0 112.121 171.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . 0.429 ' CE3' ' HD3' ' A' ' 87' ' ' LYS . 27.5 t-105 -75.56 -39.22 58.47 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 114.826 1.417 . . . . 0.0 114.826 179.061 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 8.9 ptpp? -76.62 -10.42 59.38 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 177.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 60.3 t-80 -54.74 152.5 7.03 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.073 1.749 . . . . 0.0 113.456 -178.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 58.9 mt-30 -54.37 -25.57 25.11 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.813 1.645 . . . . 0.0 114.437 177.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -125.19 18.62 8.33 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.041 1.337 . . . . 0.0 113.705 -172.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.13 -24.85 63.25 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.391 1.476 . . . . 0.0 114.177 176.17 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 64.6 p-90 -58.14 -33.42 17.74 Favored Pre-proline 0 CA--C 1.547 0.851 0 N-CA-C 117.592 2.441 . . . . 0.0 117.592 -170.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -81.27 2.29 8.68 Favored 'Trans proline' 0 CA--C 1.547 1.133 0 CA-C-N 123.041 2.122 . . . . 0.0 113.237 175.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -113.38 -5.29 13.55 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.493 1.517 . . . . 0.0 113.572 178.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 23.4 m-30 -64.19 -17.99 64.06 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 119.848 1.204 . . . . 0.0 113.952 177.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -144.03 158.31 55.8 Favored Pre-proline 0 CA--C 1.546 0.819 0 C-N-CA 126.55 1.94 . . . . 0.0 110.625 -176.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -67.48 159.5 52.18 Favored 'Trans proline' 0 CA--C 1.537 0.635 0 C-N-CA 123.061 2.507 . . . . 0.0 112.476 172.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 60.1 t -70.86 107.08 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 123.85 0.86 . . . . 0.0 109.458 170.066 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 -72.39 79.95 1.03 Allowed 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.282 1.033 . . . . 0.0 110.517 169.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -51.16 -27.72 9.35 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.917 1.287 . . . . 0.0 114.348 -177.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 85.2 mt -64.0 -48.38 86.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 125.592 1.557 . . . . 0.0 111.566 172.136 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -75.96 -39.83 55.23 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.57 1.548 . . . . 0.0 112.899 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -74.74 -9.65 58.77 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.874 1.67 . . . . 0.0 113.094 176.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 57.75 55.0 5.77 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.426 1.891 . . . . 0.0 112.527 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 55.8 mt -116.1 78.96 8.07 Favored Pre-proline 0 CA--C 1.543 0.706 0 C-N-CA 126.241 1.816 . . . . 0.0 110.703 -178.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -66.87 -16.67 50.56 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 123.302 2.668 . . . . 0.0 112.999 -179.166 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 -100.96 7.54 43.5 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.903 1.681 . . . . 0.0 113.103 175.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 79.0 t80 -52.75 -56.48 15.34 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 120.462 -1.399 . . . . 0.0 112.398 -176.506 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -74.07 -15.08 61.08 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.776 1.23 . . . . 0.0 114.128 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 9.9 mptt -69.92 -31.88 69.88 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.042 0.937 . . . . 0.0 111.592 177.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.4 mp -102.05 -45.2 10.81 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 125.688 1.595 . . . . 0.0 111.27 176.077 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 34.4 mm -76.42 101.68 2.86 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 121.929 0.871 . . . . 0.0 111.151 179.006 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.68 -40.72 95.89 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.747 1.619 . . . . 0.0 112.983 172.026 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -144.22 98.77 5.05 Favored Pre-proline 0 CA--C 1.545 0.766 0 C-N-CA 125.347 1.459 . . . . 0.0 110.575 -176.362 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -74.49 147.31 36.16 Favored 'Trans proline' 0 CA--C 1.539 0.773 0 C-N-CA 123.206 2.604 . . . . 0.0 111.083 175.361 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.3 tpt -155.68 148.26 23.98 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.832 1.253 . . . . 0.0 110.557 178.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -147.46 154.45 40.81 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 125.686 1.595 . . . . 0.0 111.368 179.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.5 ttp -62.03 -36.96 83.14 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 123.856 0.862 . . . . 0.0 112.563 -171.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -56.11 -49.11 69.5 Favored Glycine 0 CA--C 1.532 1.142 0 C-N-CA 124.242 0.925 . . . . 0.0 112.615 177.198 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 85.2 m -69.67 -33.71 72.96 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 117.661 -1.161 . . . . 0.0 112.648 174.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 97.7 mt -56.56 -49.54 77.2 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 CA-C-N 120.663 1.574 . . . . 0.0 110.826 172.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.429 ' HD3' ' CE3' ' A' ' 51' ' ' TRP . 0.4 OUTLIER -60.35 -35.36 75.5 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 118.698 0.681 . . . . 0.0 112.511 174.941 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.424 ' HA ' ' HE3' ' A' ' 88' ' ' LYS . 1.4 tpmt? -65.73 -41.9 91.69 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 -179.874 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 13.3 ptp180 -67.68 -24.08 65.38 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 173.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 74.8 mt -75.66 -39.06 58.24 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 167.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -63.05 -27.26 69.28 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 114.845 1.424 . . . . 0.0 114.845 -176.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -137.04 136.28 38.27 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.907 1.683 . . . . 0.0 110.642 -179.312 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 -51.99 134.4 32.0 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.227 1.411 . . . . 0.0 113.81 -169.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 44.1 t80 -155.54 -34.48 0.09 Allowed 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.588 1.555 . . . . 0.0 112.981 179.109 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -134.86 176.79 8.33 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.234 1.414 . . . . 0.0 112.045 179.127 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 12.0 t-105 -115.16 -21.1 10.13 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.114 1.365 . . . . 0.0 113.31 -169.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 44.3 t -144.63 151.53 39.14 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 125.489 1.516 . . . . 0.0 111.207 -178.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -58.56 -22.55 56.13 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 115.572 1.693 . . . . 0.0 115.572 -177.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 39.5 m -54.8 -31.52 59.11 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 -179.044 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -68.87 -46.07 69.37 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 121.374 -0.829 . . . . 0.0 112.17 173.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 46.4 t -63.75 -36.34 83.54 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.515 1.126 . . . . 0.0 112.354 177.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 81.6 mtp -58.67 -40.56 83.89 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 123.93 0.892 . . . . 0.0 112.535 174.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -66.68 -32.57 73.98 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 174.314 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 -69.36 -39.29 78.17 Favored 'General case' 0 CA--C 1.541 0.634 0 O-C-N 120.98 -1.075 . . . . 0.0 111.759 173.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -60.35 -47.13 87.36 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.446 -0.784 . . . . 0.0 112.145 169.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -60.19 -41.08 92.16 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 121.665 -0.647 . . . . 0.0 111.429 175.4 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 86.0 m -62.31 -40.14 95.35 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.764 0.826 . . . . 0.0 111.756 177.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 48.0 ttp -59.64 -50.75 72.67 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.481 0.713 . . . . 0.0 112.305 175.431 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -71.08 -41.67 70.38 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -179.532 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 41.7 m -64.97 -46.75 80.17 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 121.358 -0.839 . . . . 0.0 112.09 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -63.23 -32.83 74.33 Favored 'General case' 0 CA--C 1.547 0.854 0 CA-C-N 119.585 1.084 . . . . 0.0 112.004 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 67.4 m -61.06 -43.23 99.2 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.904 0.882 . . . . 0.0 113.136 170.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 17.9 m-85 -67.52 -31.91 72.35 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 177.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 87.3 mt -68.18 -56.06 14.11 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.825 0 C-N-CA 123.266 0.626 . . . . 0.0 110.785 177.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 34.5 t80 -69.41 -36.79 77.06 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 114.389 1.255 . . . . 0.0 114.389 -172.296 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 60.1 m-80 -101.01 158.71 15.8 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.245 1.018 . . . . 0.0 111.872 -172.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 3.7 mptp? -70.35 151.07 95.81 Favored Pre-proline 0 N--CA 1.47 0.568 0 C-N-CA 123.822 0.849 . . . . 0.0 109.671 174.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -65.45 -1.03 4.14 Favored 'Trans proline' 0 CA--C 1.546 1.076 0 C-N-CA 123.714 2.943 . . . . 0.0 114.725 -179.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 52.6 p -119.96 -2.19 10.32 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 127.266 2.226 . . . . 0.0 113.207 -179.431 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -67.44 145.54 54.91 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 118.837 0.744 . . . . 0.0 110.545 169.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -58.01 -40.89 81.93 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 121.561 -0.712 . . . . 0.0 112.386 -173.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 9.9 tp -55.59 -35.73 39.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 125.517 1.527 . . . . 0.0 113.877 178.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 46.4 t -67.35 -44.79 86.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 123.216 0.606 . . . . 0.0 110.456 174.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 53.0 mt -62.66 -36.17 82.0 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 118.588 0.631 . . . . 0.0 111.774 177.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 1.1 mmt -58.93 -52.16 66.94 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 122.765 0.426 . . . . 0.0 111.27 170.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -62.06 -38.82 90.21 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.459 0.703 . . . . 0.0 112.307 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -60.17 -47.48 85.75 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 119.227 0.921 . . . . 0.0 112.2 173.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -63.83 -44.56 92.84 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.437 0.695 . . . . 0.0 112.617 178.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 92.5 mt -65.91 -44.86 83.96 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.927 0.891 . . . . 0.0 112.135 176.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -63.26 -39.17 93.84 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 119.374 0.988 . . . . 0.0 112.615 -176.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -58.82 -40.86 85.39 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 121.381 -0.824 . . . . 0.0 112.107 175.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 85.0 mt -72.7 -41.78 62.29 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 123.624 0.77 . . . . 0.0 111.209 175.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -51.96 -51.39 57.42 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.891 0.768 . . . . 0.0 110.68 173.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 99.0 mt -62.58 -40.89 98.3 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.327 0.651 . . . . 0.0 112.665 177.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.73 -35.38 80.87 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 119.634 1.106 . . . . 0.0 112.729 176.498 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 71.0 mmtt -70.47 -52.87 19.0 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.748 1.219 . . . . 0.0 111.885 177.209 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 6.4 m -66.53 -24.12 32.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 CA-C-N 120.09 1.314 . . . . 0.0 112.313 179.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -64.79 -35.11 80.05 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.769 -0.582 . . . . 0.0 112.364 170.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -81.8 -16.72 50.01 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.372 1.069 . . . . 0.0 112.904 173.027 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 49.3 ttp -63.68 137.73 97.18 Favored Pre-proline 0 CA--C 1.546 0.818 0 CA-C-N 119.266 0.939 . . . . 0.0 110.937 174.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -68.48 136.23 35.98 Favored 'Trans proline' 0 CA--C 1.536 0.605 0 C-N-CA 122.786 2.324 . . . . 0.0 111.73 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -74.6 -22.95 58.68 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.216 1.006 . . . . 0.0 112.797 175.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -77.16 156.37 31.65 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.251 1.42 . . . . 0.0 111.783 173.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -126.58 135.78 51.69 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.377 1.471 . . . . 0.0 110.795 -174.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 12.7 p -148.22 140.32 18.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 C-N-CA 124.668 1.187 . . . . 0.0 110.946 174.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -70.15 132.32 45.62 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.5 1.12 . . . . 0.0 111.045 174.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 77.6 mt . . . . . 0 N--CA 1.471 0.599 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 -175.765 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.85 0 CA-C-O 122.252 0.918 . . . . 0.0 115.094 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 8.8 ptp180 -164.33 162.87 22.56 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 128.403 2.681 . . . . 0.0 108.724 173.566 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 50.5 tttt -73.51 124.38 25.75 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 168.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 62.6 p -122.26 165.76 15.7 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 125.043 1.337 . . . . 0.0 110.743 -176.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -50.33 -35.19 26.6 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.424 1.09 . . . . 0.0 113.589 171.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -70.76 -49.38 47.4 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 121.512 -0.743 . . . . 0.0 112.11 176.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.5 mt -64.2 -32.58 74.22 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 121.676 -0.64 . . . . 0.0 112.275 175.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 8.6 tp60 -60.51 -50.83 72.0 Favored 'General case' 0 C--O 1.223 -0.335 0 CA-C-O 118.47 -0.776 . . . . 0.0 110.434 170.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 60.9 t80 -56.83 -43.87 81.49 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.809 1.186 . . . . 0.0 112.269 177.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 93.3 mmm -55.08 -52.2 63.96 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 122.946 0.498 . . . . 0.0 112.083 172.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 -72.48 -30.95 64.99 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 -177.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -91.56 -25.87 19.01 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.429 1.492 . . . . 0.0 113.271 -168.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 34.3 t -128.4 -52.18 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 C-N-CA 123.224 0.61 . . . . 0.0 111.443 -176.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 16.3 t -69.85 -65.87 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 C-N-CA 123.624 0.769 . . . . 0.0 110.468 -171.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 48.8 t -54.21 -49.74 60.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 C-N-CA 125.624 1.57 . . . . 0.0 110.13 173.067 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -53.33 -52.65 58.5 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 118.824 -0.608 . . . . 0.0 111.63 -177.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 25.4 m -70.91 -40.16 72.32 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 118.576 0.625 . . . . 0.0 112.407 -178.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 62.7 mt -59.67 -29.59 68.16 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 118.682 0.674 . . . . 0.0 112.141 172.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . 0.47 ' CZ3' ' HE3' ' A' ' 87' ' ' LYS . 26.8 t-105 -79.83 -33.88 39.89 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.902 1.681 . . . . 0.0 114.234 179.209 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 15.4 ptmt -80.05 -9.51 59.7 Favored 'General case' 0 N--CA 1.483 1.193 0 CA-C-N 119.968 1.258 . . . . 0.0 114.166 174.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 50.1 t-80 -55.42 151.57 9.96 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.771 1.628 . . . . 0.0 113.519 177.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.62 -17.38 21.63 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.765 1.626 . . . . 0.0 114.442 176.76 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -125.85 17.04 8.01 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.48 1.512 . . . . 0.0 114.043 -173.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.32 -29.97 65.65 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 177.263 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 41.5 p-90 -54.84 -36.98 50.77 Favored Pre-proline 0 CA--C 1.549 0.919 0 N-CA-C 117.543 2.423 . . . . 0.0 117.543 -171.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -70.53 -3.03 11.69 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 CA-C-N 123.187 2.174 . . . . 0.0 114.7 173.136 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 -115.78 -3.25 12.24 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.345 1.458 . . . . 0.0 113.363 178.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -63.64 -27.45 69.24 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 119.511 1.051 . . . . 0.0 113.435 178.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -138.16 153.83 73.54 Favored Pre-proline 0 CA--C 1.542 0.652 0 C-N-CA 126.138 1.775 . . . . 0.0 110.003 -173.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -66.3 141.21 61.5 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 C-N-CA 122.416 2.077 . . . . 0.0 113.308 -175.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 54.5 t -57.08 136.23 20.28 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 124.716 1.206 . . . . 0.0 110.432 169.42 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -127.95 101.48 6.34 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 125.304 1.442 . . . . 0.0 109.983 178.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.0 -30.06 61.26 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.499 1.12 . . . . 0.0 113.924 -179.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 83.6 mt -67.77 -48.84 74.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 125.02 1.328 . . . . 0.0 111.109 175.085 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -66.21 -37.54 85.82 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.945 1.298 . . . . 0.0 112.96 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 72.3 mt -95.24 0.55 54.03 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.335 1.854 . . . . 0.0 113.103 -174.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 51.6 57.5 6.5 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.914 1.686 . . . . 0.0 113.036 -179.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 36.8 mt -113.92 78.24 4.06 Favored Pre-proline 0 CA--C 1.546 0.815 0 C-N-CA 126.042 1.737 . . . . 0.0 110.021 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -66.56 -7.34 17.62 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 124.387 3.392 . . . . 0.0 115.292 -169.421 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -130.71 17.79 5.22 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.942 1.697 . . . . 0.0 112.204 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 69.8 t80 -46.55 -54.61 9.03 Favored 'General case' 0 N--CA 1.476 0.849 0 O-C-N 120.997 -1.064 . . . . 0.0 113.486 -174.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -76.24 -8.88 58.03 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.013 1.325 . . . . 0.0 114.477 -179.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.1 mmmp? -77.86 -39.13 44.36 Favored 'General case' 0 N--CA 1.476 0.857 0 O-C-N 121.214 -0.929 . . . . 0.0 110.866 173.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.3 mp -82.61 -50.38 15.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 124.219 1.007 . . . . 0.0 110.565 174.026 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 34.4 mm -76.87 109.08 10.88 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.625 0 C-N-CA 123.642 0.777 . . . . 0.0 111.319 -178.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.22 -40.24 93.24 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.506 1.123 . . . . 0.0 112.464 171.364 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -154.44 106.18 2.39 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 125.98 1.712 . . . . 0.0 110.905 -172.677 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -76.71 163.26 31.81 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 123.6 2.867 . . . . 0.0 111.934 178.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -158.19 153.14 25.24 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.954 0.901 . . . . 0.0 111.981 175.025 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -153.19 132.32 12.65 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 126.906 2.082 . . . . 0.0 110.566 -171.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 7.2 ttp -59.82 -36.2 76.29 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.254 1.022 . . . . 0.0 113.37 -172.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -58.15 -24.85 56.0 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 124.662 1.125 . . . . 0.0 114.503 175.06 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 91.2 m -94.25 -17.44 22.66 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.267 1.427 . . . . 0.0 112.524 178.158 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.454 ' CG2' ' HG ' ' A' ' 101' ' ' CYS . 50.5 mt -72.43 -52.86 21.51 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 O-C-N 120.803 -1.185 . . . . 0.0 110.302 170.577 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.47 ' HE3' ' CZ3' ' A' ' 51' ' ' TRP . 16.6 ptpt -57.8 -29.0 64.54 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -178.56 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 3.0 tppp? -66.8 -45.35 78.65 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.98 1.312 . . . . 0.0 112.697 -177.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 1.4 ptt180 -77.55 -27.7 51.62 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.169 0.987 . . . . 0.0 113.009 178.25 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 64.6 mt -60.98 -34.15 74.33 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 168.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -73.12 -38.85 66.17 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 118.864 0.756 . . . . 0.0 112.362 173.809 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -69.8 178.13 2.76 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 125.261 1.425 . . . . 0.0 112.896 171.071 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 41.5 p-10 -99.12 34.2 2.19 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.832 2.053 . . . . 0.0 111.936 174.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 65.5 t80 -63.87 -36.32 83.54 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.409 1.084 . . . . 0.0 113.696 -169.232 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -136.63 -177.99 4.98 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 128.184 2.594 . . . . 0.0 110.78 177.551 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 7.4 t-105 -115.0 -29.91 6.54 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.984 1.314 . . . . 0.0 112.464 -178.13 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 54.3 m -132.17 141.24 49.02 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.062 0.945 . . . . 0.0 112.665 -168.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -63.45 -16.63 61.15 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 115.943 1.831 . . . . 0.0 115.943 -173.52 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 14.7 m -55.32 -30.85 61.01 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.969 0.907 . . . . 0.0 112.989 175.012 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -65.49 -50.52 65.01 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 121.544 -0.723 . . . . 0.0 111.332 173.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . 0.454 ' HG ' ' CG2' ' A' ' 86' ' ' ILE . 53.2 t -59.96 -37.74 80.44 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.25 1.02 . . . . 0.0 112.567 175.396 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 85.5 mtp -62.01 -42.68 99.42 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 121.184 -0.947 . . . . 0.0 112.393 173.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -64.95 -35.93 82.76 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 112.702 0.63 . . . . 0.0 112.702 173.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 55.8 m-20 -61.37 -48.02 83.17 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.487 1.039 . . . . 0.0 112.084 172.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -60.79 -43.71 97.76 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.622 -0.674 . . . . 0.0 112.767 174.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 18.1 t30 -55.2 -52.11 64.4 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.113 0.565 . . . . 0.0 111.526 173.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 96.5 m -61.01 -35.99 78.31 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.748 0.819 . . . . 0.0 112.737 177.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 27.7 ttp -61.3 -49.9 75.17 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 119.421 1.009 . . . . 0.0 112.554 176.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -70.9 -42.29 70.17 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 179.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 62.5 m -63.86 -46.76 83.54 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.764 0.825 . . . . 0.0 112.664 179.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -64.38 -33.78 76.65 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 119.852 1.206 . . . . 0.0 112.108 -179.296 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 19.2 m -59.15 -41.72 89.01 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.76 0.824 . . . . 0.0 112.989 169.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -68.73 -29.39 67.8 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 177.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 87.5 mt -69.12 -56.69 11.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 123.383 0.673 . . . . 0.0 110.986 176.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -67.9 -31.51 71.34 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 114.577 1.325 . . . . 0.0 114.577 -173.167 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 60.8 m-80 -110.18 160.43 16.5 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.474 1.11 . . . . 0.0 112.053 -170.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 49.0 mmtm -72.18 152.14 92.46 Favored Pre-proline 0 N--CA 1.474 0.752 0 O-C-N 121.499 -0.75 . . . . 0.0 110.343 172.363 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -65.74 -1.24 4.68 Favored 'Trans proline' 0 CA--C 1.545 1.042 0 C-N-CA 123.676 2.917 . . . . 0.0 115.043 -177.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 67.7 p -119.01 -0.59 11.11 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.663 1.985 . . . . 0.0 113.126 -179.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -68.45 146.5 53.12 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 118.794 0.724 . . . . 0.0 110.68 170.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -55.39 -49.53 72.09 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 121.681 -0.637 . . . . 0.0 112.209 -175.562 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.5 tp -51.99 -31.12 13.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 125.232 1.413 . . . . 0.0 114.54 177.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 55.2 t -73.84 -48.96 37.23 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 O-C-N 121.541 -0.725 . . . . 0.0 110.719 174.174 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 77.2 mt -61.33 -37.4 83.14 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 119.124 0.875 . . . . 0.0 111.848 177.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 10.6 mtp -57.91 -52.62 64.72 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.869 1.668 . . . . 0.0 111.918 169.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.43 -39.23 90.02 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 113.04 0.755 . . . . 0.0 113.04 176.164 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . 0.42 ' O ' ' HE2' ' A' ' 131' ' ' LYS . 89.4 mt-30 -61.55 -47.79 83.96 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 119.312 0.96 . . . . 0.0 112.012 174.342 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.34 -40.44 96.38 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.698 -0.626 . . . . 0.0 112.514 177.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 82.6 mt -65.37 -44.73 86.7 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.436 0.694 . . . . 0.0 111.904 172.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -59.34 -48.09 82.95 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.343 0.974 . . . . 0.0 113.173 -175.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . 0.42 ' HE2' ' O ' ' A' ' 127' ' ' GLN . 1.1 mppt? -60.45 -32.83 71.76 Favored 'General case' 0 CA--C 1.533 0.31 0 O-C-N 120.947 -1.096 . . . . 0.0 113.693 176.646 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 73.8 mt -76.18 -40.79 36.93 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 CA-C-N 118.803 0.729 . . . . 0.0 111.362 174.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -51.45 -51.61 53.47 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.383 -0.823 . . . . 0.0 109.965 170.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.3 mt -61.3 -43.18 99.3 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.507 0.723 . . . . 0.0 112.939 177.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -64.92 -31.58 72.88 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 120.056 1.298 . . . . 0.0 112.76 -178.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -76.14 -52.0 11.02 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.774 0.83 . . . . 0.0 112.191 175.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.3 m -65.61 -24.79 35.22 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 CA-C-N 120.338 1.426 . . . . 0.0 112.586 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -60.25 -30.69 69.59 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 112.889 0.699 . . . . 0.0 112.889 171.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 80.0 mt-30 -91.71 -9.17 44.75 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.752 1.221 . . . . 0.0 112.925 175.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 46.2 ttp -64.64 142.07 98.42 Favored Pre-proline 0 CA--C 1.549 0.918 0 O-C-N 121.282 -0.886 . . . . 0.0 110.807 173.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_exo -50.25 162.37 0.86 Allowed 'Trans proline' 0 CA--C 1.542 0.908 0 C-N-CA 123.787 2.991 . . . . 0.0 114.728 169.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 -93.65 -11.55 31.38 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.414 1.086 . . . . 0.0 113.53 172.321 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -124.18 163.2 22.05 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 127.097 2.159 . . . . 0.0 111.07 -175.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -124.93 162.42 24.48 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 114.973 1.471 . . . . 0.0 114.973 -177.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 65.3 t -138.48 135.28 43.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 125.999 1.72 . . . . 0.0 109.889 -176.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -65.38 121.38 14.72 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.338 1.455 . . . . 0.0 111.142 170.206 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 84.4 mt . . . . . 0 CA--C 1.538 0.517 0 CA-C-O 121.615 0.722 . . . . 0.0 112.4 177.324 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.12 0 CA-C-O 121.086 0.27 . . . . 0.0 112.855 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 33.1 ptt180 -154.91 156.84 36.83 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 126.026 1.73 . . . . 0.0 111.038 177.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.8 tttt -73.38 140.04 46.35 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.444 0.698 . . . . 0.0 110.758 170.107 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 70.0 p -142.13 168.3 20.08 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 126.373 1.869 . . . . 0.0 109.695 -177.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 24.9 p-10 -49.87 -32.87 15.42 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 169.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.3 mm-40 -67.59 -57.04 7.15 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.01 0.924 . . . . 0.0 111.351 178.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 89.6 mt -65.37 -33.32 75.67 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.527 -0.733 . . . . 0.0 112.689 178.167 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -58.45 -50.24 74.44 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.98 0.912 . . . . 0.0 111.318 170.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -59.6 -40.09 86.31 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.543 0.737 . . . . 0.0 112.603 177.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 90.4 mmm -56.38 -49.14 75.29 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 121.86 -0.525 . . . . 0.0 112.331 173.459 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -77.9 -18.38 56.22 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 114.772 1.397 . . . . 0.0 114.772 178.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 56.7 m-20 -102.96 -21.3 13.97 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 -171.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 59.0 t -131.84 -48.61 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 123.989 0.916 . . . . 0.0 111.645 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.4 t -72.31 -66.57 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 CA-C-N 118.863 0.756 . . . . 0.0 110.86 -170.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 89.8 t -58.76 -40.8 80.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 124.157 0.983 . . . . 0.0 110.362 172.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.5 tppp? -54.63 -47.64 73.21 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.892 0.877 . . . . 0.0 112.427 178.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 62.4 m -73.06 -44.33 60.78 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 122.923 0.489 . . . . 0.0 111.624 178.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 55.3 mt -62.86 -32.54 73.79 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.471 0.708 . . . . 0.0 112.426 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 18.0 t-105 -75.26 -30.09 60.36 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.319 1.447 . . . . 0.0 113.192 174.164 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 54.2 mtmt -79.03 -9.14 59.45 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.514 0.931 . . . . 0.0 113.514 175.105 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 35.6 t-80 -62.89 154.53 29.88 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.754 1.222 . . . . 0.0 113.494 -178.106 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -58.11 -24.48 58.86 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.475 1.51 . . . . 0.0 113.815 174.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -123.36 22.23 9.34 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.158 1.383 . . . . 0.0 113.657 -172.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.57 -26.08 63.38 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.725 1.21 . . . . 0.0 113.843 173.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 64.6 p-90 -59.14 -33.9 20.02 Favored Pre-proline 0 CA--C 1.546 0.804 0 N-CA-C 117.735 2.494 . . . . 0.0 117.735 -170.155 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -73.84 -2.61 12.48 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 CA-C-N 123.216 2.184 . . . . 0.0 113.781 173.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -115.75 -2.11 12.49 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.547 1.539 . . . . 0.0 113.474 179.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -63.06 -24.99 68.17 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 120.913 -1.117 . . . . 0.0 113.565 177.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -139.69 153.94 70.62 Favored Pre-proline 0 CA--C 1.543 0.681 0 C-N-CA 126.134 1.774 . . . . 0.0 110.377 -174.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -66.28 142.02 64.94 Favored 'Trans proline' 0 CA--C 1.537 0.652 0 C-N-CA 122.774 2.316 . . . . 0.0 112.569 179.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 49.5 t -59.13 142.31 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 124.452 1.101 . . . . 0.0 111.491 171.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -120.52 95.65 4.81 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.482 1.513 . . . . 0.0 109.536 171.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.25 -27.31 45.55 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.653 1.181 . . . . 0.0 113.877 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 77.9 mt -63.44 -53.46 45.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 124.437 1.095 . . . . 0.0 110.59 173.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 4.3 mptp? -66.16 -35.76 81.33 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.401 1.48 . . . . 0.0 112.707 -179.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 47.1 mt -81.08 -3.3 51.5 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 114.039 1.125 . . . . 0.0 114.039 174.318 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 62.7 t30 54.56 52.93 11.44 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.937 1.695 . . . . 0.0 113.677 -178.318 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 45.9 mt -115.47 80.61 8.02 Favored Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 126.644 1.978 . . . . 0.0 110.431 -177.06 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -67.47 -10.42 28.66 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 123.806 3.004 . . . . 0.0 113.917 -175.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -126.05 22.41 7.31 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.153 1.781 . . . . 0.0 112.397 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 71.6 t80 -51.04 -57.81 7.69 Favored 'General case' 0 N--CA 1.474 0.741 0 O-C-N 120.844 -1.16 . . . . 0.0 112.476 177.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -74.02 -12.7 60.7 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.973 1.309 . . . . 0.0 114.499 -178.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -71.61 -32.97 68.57 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.053 0.941 . . . . 0.0 111.645 177.725 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.9 mp -103.01 -43.51 9.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 125.82 1.648 . . . . 0.0 111.667 -178.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 22.6 mm -61.17 114.82 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 124.231 1.013 . . . . 0.0 110.244 173.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -63.41 -46.1 87.96 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.452 1.101 . . . . 0.0 111.756 179.011 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -156.19 127.94 3.85 Favored Pre-proline 0 CA--C 1.545 0.757 0 C-N-CA 125.606 1.562 . . . . 0.0 110.847 169.389 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -76.45 155.48 36.33 Favored 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 123.564 2.842 . . . . 0.0 112.232 -177.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 33.5 tpp -163.12 140.94 7.9 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.629 1.571 . . . . 0.0 110.115 174.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 25.8 m-20 -139.12 134.97 33.59 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 126.574 1.949 . . . . 0.0 108.42 169.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.5 ttp -46.96 -30.86 2.8 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 127.348 2.259 . . . . 0.0 116.24 -168.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.3 -30.41 40.13 Favored Glycine 0 CA--C 1.54 1.631 0 CA-C-N 119.08 0.854 . . . . 0.0 114.141 172.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 2.2 m -70.89 -35.63 72.41 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 125.259 1.424 . . . . 0.0 112.363 175.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 46.6 mt -67.94 -52.25 41.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.552 1.141 . . . . 0.0 110.008 -176.106 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.49 -40.12 77.94 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 174.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 3.2 tppp? -59.83 -39.85 86.48 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.014 0.926 . . . . 0.0 112.797 179.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 1.5 ptm180 -87.24 -28.35 22.4 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 39.6 mt -61.85 -34.88 76.77 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.127 0.971 . . . . 0.0 112.833 167.052 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -74.31 9.59 1.61 Allowed 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 124.962 1.305 . . . . 0.0 113.758 174.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 46.0 m-80 -129.29 161.02 31.19 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 127.36 2.264 . . . . 0.0 110.015 173.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 10.3 p-10 -78.34 36.89 0.25 Allowed 'General case' 0 CA--C 1.551 1.006 0 O-C-N 120.767 -1.208 . . . . 0.0 112.177 169.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -62.6 -34.18 76.47 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.073 1.349 . . . . 0.0 113.235 -169.604 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -134.54 -179.38 5.55 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 127.089 2.156 . . . . 0.0 111.296 174.851 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 4.3 t-105 -110.97 -26.24 9.38 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.217 1.407 . . . . 0.0 112.789 -177.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 62.1 m -134.29 143.74 47.92 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.664 1.186 . . . . 0.0 112.632 -170.091 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -65.3 -16.18 63.3 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 115.232 1.567 . . . . 0.0 115.232 -177.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 11.4 p -51.83 -36.21 47.3 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.497 1.119 . . . . 0.0 113.476 172.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -69.65 -42.0 74.82 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.764 0.825 . . . . 0.0 112.227 176.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 49.4 t -64.81 -35.33 80.75 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.162 0.985 . . . . 0.0 112.459 172.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 89.4 mtp -66.84 -42.32 85.96 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 121.323 -0.861 . . . . 0.0 111.817 173.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -63.73 -29.62 70.81 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 173.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -66.81 -45.95 76.73 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 119.341 0.973 . . . . 0.0 112.301 171.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -63.37 -41.28 98.8 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 121.322 -0.861 . . . . 0.0 112.687 173.091 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 22.7 t30 -57.66 -46.15 84.6 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.831 -0.543 . . . . 0.0 111.578 172.202 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 81.4 m -56.02 -49.82 72.61 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.19 0.996 . . . . 0.0 111.417 175.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 27.3 ttm -56.72 -61.29 2.53 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.224 1.01 . . . . 0.0 112.313 179.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -63.16 -40.79 98.56 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -175.107 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 66.5 m -66.72 -45.79 77.55 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.442 -0.786 . . . . 0.0 112.167 176.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -63.19 -30.84 71.91 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 120.102 1.319 . . . . 0.0 112.586 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 82.7 m -60.58 -45.17 94.92 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.266 1.026 . . . . 0.0 112.217 170.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -69.71 -29.56 66.99 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 179.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 88.6 mt -71.21 -55.83 12.56 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 CA-C-N 118.41 0.55 . . . . 0.0 110.126 178.027 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -71.3 -30.45 66.26 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 114.567 1.321 . . . . 0.0 114.567 -172.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 44.4 m-80 -113.61 158.25 21.06 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.012 0.925 . . . . 0.0 112.654 -171.011 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -66.16 147.89 98.66 Favored Pre-proline 0 N--CA 1.472 0.672 0 C-N-CA 124.61 1.164 . . . . 0.0 110.834 176.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -65.72 -6.94 15.06 Favored 'Trans proline' 0 CA--C 1.543 0.954 0 C-N-CA 123.828 3.019 . . . . 0.0 114.973 -175.161 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 70.7 p -116.46 1.18 12.93 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 126.265 1.826 . . . . 0.0 113.096 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -67.53 146.04 54.33 Favored 'General case' 0 CA--C 1.541 0.633 0 O-C-N 121.451 -0.781 . . . . 0.0 110.941 174.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -51.97 -46.25 64.74 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.7 0.8 . . . . 0.0 112.808 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 9.6 tp -57.43 -34.56 46.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 124.488 1.115 . . . . 0.0 113.747 179.39 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 45.4 t -69.95 -43.55 79.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 123.428 0.691 . . . . 0.0 110.67 174.203 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 69.5 mt -63.25 -35.8 81.53 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 119.003 0.819 . . . . 0.0 111.94 176.416 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -57.79 -53.4 58.62 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 118.26 0.482 . . . . 0.0 110.738 170.381 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.87 -39.99 91.26 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.483 0.713 . . . . 0.0 112.611 179.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -60.72 -50.12 74.77 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.07 0.85 . . . . 0.0 112.036 174.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.87 -41.33 99.36 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.427 0.691 . . . . 0.0 112.41 -179.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 85.4 mt -65.48 -45.74 82.47 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.635 0.774 . . . . 0.0 111.848 173.472 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -60.37 -43.24 96.74 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.566 1.075 . . . . 0.0 113.165 -176.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 66.1 mttt -58.23 -38.24 76.46 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.53 0.732 . . . . 0.0 111.857 178.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 70.1 mt -78.16 -41.62 26.84 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 123.406 0.682 . . . . 0.0 111.729 176.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 29.2 t80 -50.42 -51.57 45.26 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 119.131 0.878 . . . . 0.0 110.413 172.448 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 99.4 mt -62.04 -42.48 99.22 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.891 0.7 . . . . 0.0 112.891 178.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -67.89 -30.65 70.05 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 120.009 1.277 . . . . 0.0 112.755 179.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 69.2 mmtt -75.52 -48.39 22.76 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 117.616 -1.183 . . . . 0.0 112.435 175.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.7 m -68.43 -25.98 32.51 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 CA-C-N 121.094 1.77 . . . . 0.0 112.362 177.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -59.85 -31.12 69.46 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.748 -0.595 . . . . 0.0 112.431 171.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 21.6 mm100 -89.97 -5.85 56.26 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.125 1.37 . . . . 0.0 113.027 176.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 40.8 ttp -63.43 137.26 97.03 Favored Pre-proline 0 CA--C 1.546 0.819 0 C-N-CA 123.802 0.841 . . . . 0.0 110.418 171.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_endo -61.63 148.7 92.42 Favored 'Trans proline' 0 CA--C 1.534 0.514 0 C-N-CA 122.601 2.201 . . . . 0.0 111.023 174.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 -92.09 -13.46 30.77 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -174.487 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 9.5 mp0 -100.01 150.54 22.33 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 126.184 1.794 . . . . 0.0 111.862 176.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -98.84 140.93 32.28 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.04 1.336 . . . . 0.0 110.315 177.237 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 8.5 p -146.29 138.04 19.34 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 CA-C-O 122.299 1.047 . . . . 0.0 111.162 169.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -65.51 131.84 47.39 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.452 1.901 . . . . 0.0 111.64 176.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 98.6 mt . . . . . 0 N--CA 1.471 0.6 0 N-CA-C 114.068 1.136 . . . . 0.0 114.068 -177.095 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.394 0 N-CA-C 111.766 -0.533 . . . . 0.0 111.766 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 34.6 ptt180 -153.02 152.57 31.52 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.471 1.508 . . . . 0.0 110.675 172.169 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 74.0 tttt -71.75 139.24 48.99 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.362 0.665 . . . . 0.0 110.4 169.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 61.9 p -140.41 168.56 19.52 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.864 1.666 . . . . 0.0 110.421 -176.468 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 26.2 p-10 -48.94 -37.36 19.75 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 114.29 1.219 . . . . 0.0 114.29 172.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -72.11 -46.17 57.7 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 121.521 -0.737 . . . . 0.0 111.767 178.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 79.4 mt -65.44 -32.62 74.34 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 121.805 -0.559 . . . . 0.0 112.222 175.097 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 44.3 tt0 -59.6 -52.48 65.36 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 123.292 0.637 . . . . 0.0 109.863 168.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -56.4 -41.38 76.2 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.503 0.721 . . . . 0.0 112.516 179.179 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 89.9 mmm -57.15 -56.03 27.08 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 118.303 0.502 . . . . 0.0 112.017 171.496 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.2 pt20 -77.46 -11.53 59.86 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.952 1.464 . . . . 0.0 114.952 -175.243 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -115.48 -21.14 9.92 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.771 1.228 . . . . 0.0 113.334 -169.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 16.0 t -129.2 -51.4 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 C-N-CA 123.225 0.61 . . . . 0.0 111.229 -179.243 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.5 t -68.04 -63.01 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 123.246 0.618 . . . . 0.0 110.469 -176.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 69.0 t -57.79 -48.36 83.86 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 124.518 1.127 . . . . 0.0 110.523 174.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm -58.22 -44.34 88.16 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 118.482 0.583 . . . . 0.0 112.24 -175.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 40.5 m -71.01 -43.05 68.75 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 177.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 75.7 mt -63.16 -33.83 76.31 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.291 0.636 . . . . 0.0 112.355 176.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . 0.469 ' CZ3' ' HE3' ' A' ' 87' ' ' LYS . 19.3 t-105 -70.75 -28.33 64.61 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.741 1.616 . . . . 0.0 113.353 175.056 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.4 mtmp? -83.92 -4.13 58.47 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.291 1.036 . . . . 0.0 113.533 176.122 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 36.1 t-80 -65.99 158.91 27.01 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.902 1.281 . . . . 0.0 113.301 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -58.84 -24.53 62.15 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.518 1.527 . . . . 0.0 113.88 175.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 -125.4 22.1 7.79 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.802 1.241 . . . . 0.0 114.057 -171.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.72 -28.27 65.68 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 176.211 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . 0.401 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 45.0 p-90 -56.69 -37.6 59.41 Favored Pre-proline 0 CA--C 1.547 0.855 0 N-CA-C 117.324 2.342 . . . . 0.0 117.324 -170.911 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.401 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 64.0 Cg_endo -70.22 -5.53 16.72 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 CA-C-N 123.042 2.122 . . . . 0.0 114.592 172.325 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 80.7 m-85 -113.19 -1.06 14.45 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.345 1.458 . . . . 0.0 113.302 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -64.02 -17.83 63.72 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 113.914 1.079 . . . . 0.0 113.914 175.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 -142.88 157.06 62.01 Favored Pre-proline 0 CA--C 1.546 0.797 0 C-N-CA 125.958 1.703 . . . . 0.0 111.047 -172.311 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -65.42 152.48 81.85 Favored 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 122.998 2.465 . . . . 0.0 112.34 173.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 36.5 t -71.85 144.75 12.92 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 124.485 1.114 . . . . 0.0 110.56 177.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -128.97 97.07 4.52 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.197 1.399 . . . . 0.0 110.604 178.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.0 -28.46 57.35 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.563 1.145 . . . . 0.0 113.858 178.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 82.6 mt -66.72 -49.34 75.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 125.071 1.348 . . . . 0.0 111.021 174.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 9.6 mtpm? -67.75 -37.73 82.54 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.636 1.174 . . . . 0.0 112.745 -179.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 85.0 mt -90.63 -1.2 57.88 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.952 1.701 . . . . 0.0 113.513 -177.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 51.96 57.43 6.51 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 125.754 1.622 . . . . 0.0 113.296 -178.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 53.9 mt -113.6 83.59 7.25 Favored Pre-proline 0 CA--C 1.547 0.854 0 C-N-CA 125.9 1.68 . . . . 0.0 110.655 -177.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -67.66 -11.6 32.68 Favored 'Trans proline' 0 CA--C 1.541 0.858 0 C-N-CA 123.975 3.117 . . . . 0.0 114.61 -170.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.4 ' HA ' ' HE3' ' A' ' 75' ' ' LYS . 40.9 m-20 -125.8 21.53 7.61 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.416 1.486 . . . . 0.0 113.048 177.878 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -48.28 -55.39 10.7 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 121.212 -0.93 . . . . 0.0 113.009 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -77.39 -16.25 58.94 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 114.672 1.36 . . . . 0.0 114.672 -177.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.4 ' HE3' ' HA ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -68.66 -39.64 80.54 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.141 -0.975 . . . . 0.0 111.714 172.656 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.3 mp -88.65 -46.2 15.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 124.35 1.06 . . . . 0.0 111.189 175.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 32.3 mm -80.34 104.51 8.78 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-O 121.685 0.755 . . . . 0.0 111.189 178.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -69.34 -36.65 77.11 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.84 1.256 . . . . 0.0 112.578 174.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -146.35 103.46 4.04 Favored Pre-proline 0 CA--C 1.547 0.83 0 C-N-CA 125.69 1.596 . . . . 0.0 110.686 -178.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -76.32 149.17 31.16 Favored 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 123.403 2.735 . . . . 0.0 111.232 174.191 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 6.8 tpt -157.83 148.66 21.02 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.726 1.211 . . . . 0.0 111.105 177.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -150.56 154.85 38.33 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.771 1.628 . . . . 0.0 111.533 -178.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 4.5 ttp -64.07 -33.23 75.28 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.911 0.885 . . . . 0.0 113.369 -174.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.67 -44.97 97.26 Favored Glycine 0 CA--C 1.532 1.138 0 C-N-CA 124.697 1.141 . . . . 0.0 112.899 173.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 57.7 m -68.56 -39.78 80.91 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 121.789 -0.83 . . . . 0.0 111.827 172.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 95.3 mt -55.56 -53.23 38.82 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 CA-C-N 120.104 1.32 . . . . 0.0 111.22 176.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.469 ' HE3' ' CZ3' ' A' ' 51' ' ' TRP . 16.3 ptpt -59.74 -30.52 68.89 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 177.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm -66.83 -44.9 79.91 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.814 0.846 . . . . 0.0 112.867 177.037 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 6.9 ptp180 -75.17 -19.6 59.77 Favored 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 172.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 46.3 mt -70.76 -51.55 26.41 Favored 'General case' 0 CA--C 1.543 0.673 0 CA-C-N 119.152 0.887 . . . . 0.0 111.328 167.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -71.46 -41.53 69.29 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 113.461 0.912 . . . . 0.0 113.461 -176.315 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -86.34 110.75 19.89 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 169.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 46.2 t30 -48.79 115.63 1.33 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.54 1.136 . . . . 0.0 112.915 -175.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 54.7 t80 -137.0 -26.76 1.02 Allowed 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 114.365 1.246 . . . . 0.0 114.365 -172.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -138.56 170.79 15.38 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.801 1.24 . . . . 0.0 112.708 178.196 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 8.8 t-105 -99.92 -21.45 15.67 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.136 1.375 . . . . 0.0 112.657 -176.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.7 p -141.42 148.29 39.32 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.452 1.501 . . . . 0.0 113.105 -169.53 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -72.19 -17.18 61.95 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 115.221 1.563 . . . . 0.0 115.221 -176.359 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 5.7 p -52.88 -37.03 60.02 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.033 0.933 . . . . 0.0 113.004 174.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -67.45 -43.72 80.4 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.705 -0.622 . . . . 0.0 112.474 178.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 45.4 t -60.17 -40.77 91.1 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.119 0.968 . . . . 0.0 112.617 170.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 83.9 mtp -62.35 -42.61 99.53 Favored 'General case' 0 N--CA 1.473 0.679 0 O-C-N 121.303 -0.873 . . . . 0.0 112.579 176.136 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 58.0 mm-40 -66.45 -32.99 74.7 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 173.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -66.46 -41.27 89.33 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 120.736 -1.227 . . . . 0.0 111.922 171.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -60.67 -45.49 93.95 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.264 -0.898 . . . . 0.0 112.47 170.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.91 -42.62 94.3 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.434 -0.791 . . . . 0.0 110.924 173.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 88.0 m -60.26 -40.23 89.59 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.976 0.91 . . . . 0.0 111.883 178.312 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 17.2 ttm -57.31 -59.61 4.87 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 119.001 0.819 . . . . 0.0 111.534 173.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -64.17 -43.46 95.08 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -176.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 97.5 m -63.71 -47.44 81.13 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.973 0.909 . . . . 0.0 112.054 179.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -64.2 -34.25 77.66 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-N 119.711 1.142 . . . . 0.0 112.224 -179.079 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 24.6 m -58.4 -43.8 88.71 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 113.232 0.827 . . . . 0.0 113.232 170.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 14.9 m-85 -68.45 -29.1 67.67 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.861 1.06 . . . . 0.0 113.861 178.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 86.8 mt -70.08 -56.57 10.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 123.27 0.628 . . . . 0.0 110.647 176.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -69.33 -35.3 75.78 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 114.371 1.248 . . . . 0.0 114.371 -173.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 55.6 m-80 -105.58 154.96 19.68 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.25 1.02 . . . . 0.0 111.535 -172.423 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 53.3 mttm -68.3 151.58 97.12 Favored Pre-proline 0 N--CA 1.471 0.577 0 C-N-CA 123.988 0.915 . . . . 0.0 111.037 175.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -65.24 -1.03 3.97 Favored 'Trans proline' 0 CA--C 1.547 1.168 0 C-N-CA 123.601 2.868 . . . . 0.0 114.763 -179.238 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 52.0 p -117.67 -2.41 11.43 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 127.123 2.169 . . . . 0.0 113.151 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 -69.31 144.38 53.55 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 118.966 0.803 . . . . 0.0 110.648 171.106 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -56.29 -46.27 79.83 Favored 'General case' 0 N--CA 1.471 0.616 0 O-C-N 121.649 -0.657 . . . . 0.0 112.514 -175.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.4 tp -54.42 -30.29 21.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 125.118 1.367 . . . . 0.0 114.209 177.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 45.5 t -72.81 -47.18 50.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 O-C-N 121.422 -0.798 . . . . 0.0 110.555 174.015 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 71.8 mt -61.46 -37.08 82.27 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 118.93 0.786 . . . . 0.0 111.599 176.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 7.7 mtt -59.01 -51.91 68.01 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.921 1.288 . . . . 0.0 111.971 169.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.28 -39.65 87.63 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.353 0.661 . . . . 0.0 112.72 176.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 89.3 mt-30 -62.41 -45.36 93.45 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 119.24 0.927 . . . . 0.0 111.902 174.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -67.41 -29.69 69.26 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.246 1.018 . . . . 0.0 113.615 179.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 81.5 mt -76.14 -48.52 20.3 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.832 0.853 . . . . 0.0 111.49 169.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -62.05 -37.81 86.39 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 113.376 0.88 . . . . 0.0 113.376 -173.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 59.5 pttt -58.9 -44.21 91.15 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 121.593 -0.692 . . . . 0.0 111.679 176.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 65.9 mt -70.99 -39.97 75.71 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 124.413 1.085 . . . . 0.0 110.91 176.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -51.11 -49.5 60.64 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.903 1.229 . . . . 0.0 110.808 171.43 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.7 mt -63.9 -39.68 94.75 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 176.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -57.3 -41.09 79.17 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-N 119.688 1.131 . . . . 0.0 112.652 172.184 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 36.7 mmtm -75.69 -48.83 20.32 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.961 1.304 . . . . 0.0 111.786 -175.309 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.8 m -68.78 -25.96 31.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 CA-C-N 120.121 1.328 . . . . 0.0 112.218 176.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -61.59 -28.3 69.25 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 121.495 -0.753 . . . . 0.0 112.449 171.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -96.51 1.73 51.73 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.399 1.48 . . . . 0.0 112.687 177.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 8.9 ttm -54.28 141.53 51.71 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 124.951 1.3 . . . . 0.0 112.482 174.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -67.6 114.84 3.44 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 123.076 2.517 . . . . 0.0 109.233 168.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -71.44 -20.58 62.08 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 -169.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -84.41 160.24 20.65 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.74 1.616 . . . . 0.0 112.056 177.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -116.43 133.07 56.44 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.116 1.367 . . . . 0.0 110.986 178.04 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 13.0 p -149.28 142.94 18.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 C-N-CA 124.848 1.259 . . . . 0.0 111.286 173.027 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -70.77 137.75 49.86 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.656 1.182 . . . . 0.0 111.636 176.066 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 95.9 mt . . . . . 0 N--CA 1.47 0.553 0 N-CA-C 114.058 1.133 . . . . 0.0 114.058 -175.854 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.207 0 N-CA-C 111.753 -0.539 . . . . 0.0 111.753 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 34.9 ptt180 -162.83 161.2 25.92 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.918 1.687 . . . . 0.0 110.693 179.317 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 46.6 mttp -76.93 141.23 40.57 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 121.398 0.618 . . . . 0.0 110.425 167.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 81.0 p -141.04 164.16 31.02 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 125.585 1.554 . . . . 0.0 110.004 176.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -52.68 -30.97 34.82 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 170.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.4 mm-40 -67.9 -54.74 16.45 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.884 0.874 . . . . 0.0 111.188 177.144 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.3 mt -65.03 -32.88 74.82 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 121.489 -0.757 . . . . 0.0 112.52 176.326 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 53.4 tt0 -57.16 -52.81 63.8 Favored 'General case' 0 C--O 1.224 -0.26 0 C-N-CA 123.977 0.911 . . . . 0.0 110.92 170.065 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -60.21 -41.18 92.49 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.453 0.701 . . . . 0.0 112.596 179.197 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 93.9 mmm -55.85 -48.35 75.67 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 121.747 -0.595 . . . . 0.0 111.794 171.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -86.42 -5.57 59.13 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 115.114 1.524 . . . . 0.0 115.114 -175.739 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 30.6 m-20 -117.0 -18.36 10.12 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 125.157 1.383 . . . . 0.0 113.481 -176.117 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 46.9 t -133.85 -50.66 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 123.934 0.894 . . . . 0.0 111.686 179.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.0 t -71.54 -67.48 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-N 119.407 1.003 . . . . 0.0 110.802 -171.468 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 59.1 t -57.61 -41.85 80.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 123.655 0.782 . . . . 0.0 109.965 171.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.74 -45.02 86.44 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 118.87 0.759 . . . . 0.0 113.005 -177.604 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 62.4 m -71.76 -44.46 64.0 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 122.925 0.49 . . . . 0.0 111.364 176.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 66.6 mt -62.0 -32.49 72.97 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.572 0.749 . . . . 0.0 112.277 178.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 16.9 t-105 -73.17 -29.53 62.92 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.022 1.729 . . . . 0.0 112.955 176.066 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 56.5 mtmt -84.25 -5.28 59.24 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.256 1.022 . . . . 0.0 113.462 176.568 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 37.3 t-80 -65.02 156.18 32.23 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.695 1.198 . . . . 0.0 113.564 -178.439 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 18.4 tp60 -58.74 -20.82 52.62 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.604 1.562 . . . . 0.0 114.057 174.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -125.12 19.97 8.26 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.399 1.479 . . . . 0.0 113.791 -174.44 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.3 -30.01 65.73 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 177.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . 0.415 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 39.4 p-90 -54.57 -37.84 59.34 Favored Pre-proline 0 CA--C 1.547 0.863 0 N-CA-C 117.094 2.257 . . . . 0.0 117.094 -172.517 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.415 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 56.9 Cg_endo -67.99 -7.28 19.29 Favored 'Trans proline' 0 C--N 1.354 0.866 0 CA-C-N 122.959 2.092 . . . . 0.0 115.012 172.785 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 72.7 m-85 -114.5 -1.45 13.43 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.132 1.373 . . . . 0.0 113.284 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 20.1 m-30 -65.18 -22.53 66.92 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 113.458 0.91 . . . . 0.0 113.458 176.212 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -138.4 155.46 73.89 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 126.515 1.926 . . . . 0.0 110.005 -176.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -67.24 147.63 78.95 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 122.571 2.18 . . . . 0.0 112.4 178.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 76.6 t -59.75 142.34 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 123.903 0.881 . . . . 0.0 111.258 170.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -122.97 101.24 7.31 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 125.689 1.596 . . . . 0.0 109.497 171.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.27 -27.23 61.91 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 -179.26 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 84.3 mt -64.81 -49.61 79.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 124.855 1.262 . . . . 0.0 110.846 172.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -68.36 -42.31 79.37 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.97 1.308 . . . . 0.0 112.788 -178.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.4 mp -80.74 -4.32 54.04 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.358 1.063 . . . . 0.0 113.329 176.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 61.7 t30 55.02 56.28 6.76 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 126.266 1.826 . . . . 0.0 113.501 -179.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 51.5 mt -115.28 84.05 11.04 Favored Pre-proline 0 CA--C 1.545 0.77 0 C-N-CA 126.312 1.845 . . . . 0.0 110.741 -175.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -68.3 -3.88 11.71 Favored 'Trans proline' 0 CA--C 1.544 1.009 0 C-N-CA 123.945 3.097 . . . . 0.0 114.633 -174.368 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -131.24 14.78 5.11 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 126.051 1.74 . . . . 0.0 112.528 -178.681 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 40.9 t80 -51.13 -55.05 19.75 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 120.729 -1.232 . . . . 0.0 113.364 -173.212 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -79.44 -9.44 59.6 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.346 1.059 . . . . 0.0 113.854 178.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -70.65 -47.27 60.88 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.006 0.922 . . . . 0.0 110.337 177.325 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.9 mp -77.11 -50.39 20.85 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 C-N-CA 124.137 0.975 . . . . 0.0 109.84 172.096 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 40.9 mm -91.4 103.04 14.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 CA-C-O 122.48 1.134 . . . . 0.0 112.097 -171.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt -68.06 -32.26 72.48 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.936 1.694 . . . . 0.0 113.487 179.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -147.59 91.67 4.94 Favored Pre-proline 0 CA--C 1.545 0.761 0 C-N-CA 125.715 1.606 . . . . 0.0 110.209 -178.044 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -78.76 159.61 27.97 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 123.499 2.799 . . . . 0.0 111.356 174.522 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 40.8 mmm -147.05 160.87 41.88 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.522 1.129 . . . . 0.0 112.751 168.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -146.81 146.79 30.36 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 127.099 2.159 . . . . 0.0 110.228 175.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.2 ttp -61.84 -35.19 77.55 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.163 0.985 . . . . 0.0 113.63 -170.362 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -57.87 -42.4 94.65 Favored Glycine 0 CA--C 1.531 1.075 0 C-N-CA 123.831 0.729 . . . . 0.0 113.219 177.448 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 19.7 m -67.13 -41.58 85.9 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.826 0.85 . . . . 0.0 111.602 176.147 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 95.0 mt -60.02 -52.06 65.58 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 124.257 1.023 . . . . 0.0 110.493 177.444 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 25.2 ttpp -57.75 -37.4 73.56 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 125.417 1.487 . . . . 0.0 112.888 176.391 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 34.0 ttmt -62.69 -41.88 99.34 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 113.458 0.91 . . . . 0.0 113.458 178.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -74.03 -27.09 60.77 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 114.537 1.31 . . . . 0.0 114.537 172.777 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 62.5 mt -61.8 -48.62 79.78 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 118.675 0.67 . . . . 0.0 111.29 168.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -59.29 -42.01 90.28 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.054 0.942 . . . . 0.0 111.977 176.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 -83.51 2.56 36.34 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 125.086 1.354 . . . . 0.0 113.987 179.371 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 34.86 56.72 0.74 Allowed 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 127.579 2.352 . . . . 0.0 115.091 -171.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 71.2 t80 -58.83 -24.37 61.91 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 127.358 2.263 . . . . 0.0 114.948 -176.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -133.22 -175.48 3.81 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 129.043 2.937 . . . . 0.0 111.568 -169.852 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 14.4 t-105 -110.45 -27.45 9.01 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.382 1.073 . . . . 0.0 113.142 -171.511 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 16.9 m -145.95 151.69 38.22 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.724 1.21 . . . . 0.0 112.703 -171.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -66.0 -21.23 66.39 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 116.502 2.038 . . . . 0.0 116.502 -172.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 47.0 t -53.85 -36.7 62.88 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 119.282 0.946 . . . . 0.0 112.552 178.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -65.86 -44.78 84.39 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 121.088 -1.008 . . . . 0.0 112.015 179.087 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 53.1 t -57.92 -41.91 83.68 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.088 0.955 . . . . 0.0 112.37 171.123 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 79.9 mtp -61.86 -40.33 94.99 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.999 0.92 . . . . 0.0 112.975 175.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 65.0 mt-30 -62.57 -37.32 85.72 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.093 0.957 . . . . 0.0 112.682 175.269 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -71.96 -33.91 68.55 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.0 -1.063 . . . . 0.0 113.281 174.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -64.25 -45.0 90.07 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 119.346 0.975 . . . . 0.0 112.212 169.538 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 24.1 t30 -56.27 -42.12 76.95 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.866 -0.521 . . . . 0.0 111.534 171.502 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 60.4 m -64.98 -39.57 93.68 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.128 0.971 . . . . 0.0 112.491 176.357 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 21.1 ttm -58.98 -61.09 2.9 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.941 0.897 . . . . 0.0 111.352 174.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -62.91 -39.79 95.63 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 -176.351 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 90.5 m -65.11 -47.33 77.53 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.195 0.598 . . . . 0.0 112.07 178.424 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -64.71 -32.53 74.25 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 119.615 1.098 . . . . 0.0 112.549 -179.227 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 55.9 m -59.8 -45.15 93.2 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.717 0.807 . . . . 0.0 112.543 169.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 14.3 m-85 -67.84 -32.55 73.15 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 177.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 85.6 mt -69.41 -58.19 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 123.576 0.75 . . . . 0.0 111.05 176.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 43.2 t80 -68.31 -34.61 76.45 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 114.246 1.202 . . . . 0.0 114.246 -170.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 60.5 m-80 -101.03 164.7 11.68 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.51 1.124 . . . . 0.0 111.987 -173.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -72.61 150.84 91.32 Favored Pre-proline 0 N--CA 1.476 0.836 0 O-C-N 121.368 -0.833 . . . . 0.0 109.921 170.25 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -66.08 -1.65 5.62 Favored 'Trans proline' 0 CA--C 1.546 1.108 0 C-N-CA 123.393 2.728 . . . . 0.0 114.68 -178.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 50.7 p -118.24 -1.34 11.35 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.994 2.118 . . . . 0.0 113.113 -179.056 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 54.4 m-20 -67.46 145.9 54.53 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.535 -0.728 . . . . 0.0 110.822 170.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -56.22 -46.69 79.4 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.619 -0.675 . . . . 0.0 112.406 -176.068 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.5 tp -54.73 -29.13 20.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 125.227 1.411 . . . . 0.0 114.442 177.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 38.6 t -73.17 -45.57 53.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 O-C-N 121.281 -0.887 . . . . 0.0 110.517 173.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 73.5 mt -63.31 -36.87 85.12 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 118.977 0.808 . . . . 0.0 111.405 176.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 7.6 mtt -59.17 -52.11 67.12 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.019 1.328 . . . . 0.0 111.648 169.541 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.54 -38.8 85.64 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.483 0.713 . . . . 0.0 112.707 176.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -62.74 -49.41 75.15 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.955 0.798 . . . . 0.0 112.146 174.049 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -61.25 -39.51 90.62 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.493 0.717 . . . . 0.0 112.295 179.595 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 80.5 mt -66.08 -48.42 71.02 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.487 0.715 . . . . 0.0 111.872 170.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -62.27 -39.72 93.85 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 120.78 -1.2 . . . . 0.0 113.53 -175.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 14.2 mttm -60.02 -29.33 68.42 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.672 0.789 . . . . 0.0 112.595 174.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 59.4 mt -86.61 -39.98 13.79 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 C-N-CA 123.615 0.766 . . . . 0.0 112.055 174.134 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 35.6 t80 -50.43 -53.17 31.49 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.366 0.985 . . . . 0.0 110.455 172.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.2 mt -62.97 -40.24 97.1 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 112.951 0.723 . . . . 0.0 112.951 -179.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.5 pt20 -71.33 -29.67 65.28 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 119.694 1.134 . . . . 0.0 112.847 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -75.69 -48.44 21.97 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 117.638 -1.173 . . . . 0.0 112.439 174.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 6.1 m -66.97 -26.28 36.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 CA-C-N 121.031 1.741 . . . . 0.0 112.075 177.033 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -60.64 -29.99 69.6 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 172.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -89.99 -6.25 55.83 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 124.712 1.205 . . . . 0.0 112.838 175.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 39.7 ttp -63.77 139.45 97.63 Favored Pre-proline 0 CA--C 1.547 0.847 0 O-C-N 121.251 -0.906 . . . . 0.0 110.278 170.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -63.75 154.62 68.34 Favored 'Trans proline' 0 CA--C 1.538 0.699 0 C-N-CA 122.758 2.305 . . . . 0.0 111.907 175.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 20.1 mm100 -84.54 -18.07 36.89 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 176.055 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -96.35 155.22 16.86 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.357 1.463 . . . . 0.0 112.934 -179.441 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -122.32 138.25 54.57 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.652 1.181 . . . . 0.0 111.065 -175.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 9.7 p -145.16 140.08 22.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 C-N-CA 125.289 1.436 . . . . 0.0 110.672 176.121 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -70.24 135.78 49.32 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.67 1.188 . . . . 0.0 111.354 176.385 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 84.1 mt . . . . . 0 CA--C 1.54 0.585 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 -173.04 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.191 0 CA-C-O 121.111 0.284 . . . . 0.0 113.367 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.5 ptt180 -158.4 152.46 23.93 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 126.55 1.94 . . . . 0.0 109.858 168.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 26.2 ttpt -82.63 141.64 32.36 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 121.455 0.645 . . . . 0.0 111.127 174.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 59.3 p -135.74 166.63 22.81 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 125.562 1.545 . . . . 0.0 111.143 -169.24 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 27.3 p-10 -47.54 -38.34 13.95 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.288 1.035 . . . . 0.0 113.767 172.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 15.0 tt0 -72.72 -42.12 64.49 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.424 1.09 . . . . 0.0 112.323 -179.344 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 73.3 mt -67.18 -31.65 72.2 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.566 0.746 . . . . 0.0 112.137 171.262 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -60.96 -48.46 81.7 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 118.539 0.609 . . . . 0.0 110.413 169.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -55.76 -41.07 73.44 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.466 0.706 . . . . 0.0 112.415 177.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 90.3 mmm -57.0 -52.87 63.55 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 119.004 -0.522 . . . . 0.0 112.401 172.468 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -77.87 -17.26 57.55 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 114.772 1.397 . . . . 0.0 114.772 -178.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -106.27 -22.35 12.85 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.002 0.921 . . . . 0.0 113.317 -169.122 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 33.7 t -127.96 -51.68 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 C-N-CA 123.234 0.614 . . . . 0.0 111.207 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.7 t -67.72 -62.34 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.206 0.602 . . . . 0.0 110.566 -174.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 55.6 t -57.19 -50.62 76.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 124.375 1.07 . . . . 0.0 110.222 173.138 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm -57.03 -43.49 81.98 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 118.658 0.663 . . . . 0.0 112.407 -174.261 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 56.4 m -69.4 -47.62 63.6 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 117.956 0.344 . . . . 0.0 111.901 176.576 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 70.9 mt -61.43 -33.85 74.41 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.43 0.692 . . . . 0.0 112.313 178.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . 0.449 ' CZ3' ' HE3' ' A' ' 87' ' ' LYS . 22.2 t-105 -70.07 -29.64 66.69 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.828 1.651 . . . . 0.0 113.413 176.218 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.4 mtmp? -82.7 -7.1 59.67 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.012 0.925 . . . . 0.0 113.403 177.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 41.0 t-80 -64.76 152.86 41.53 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.707 1.203 . . . . 0.0 113.018 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 26.8 mp0 -60.85 -19.29 59.73 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.578 1.551 . . . . 0.0 113.948 175.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -119.78 15.24 12.64 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.56 1.544 . . . . 0.0 113.672 -175.162 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.93 -26.21 63.09 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.184 1.394 . . . . 0.0 114.345 178.245 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 68.1 p-90 -57.54 -33.89 21.62 Favored Pre-proline 0 CA--C 1.549 0.938 0 N-CA-C 117.967 2.58 . . . . 0.0 117.967 -170.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -77.24 -1.28 11.44 Favored 'Trans proline' 0 CA--C 1.543 0.972 0 CA-C-N 123.437 2.263 . . . . 0.0 113.281 174.755 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 88.4 m-85 -112.03 -4.87 14.37 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.576 1.55 . . . . 0.0 113.411 179.372 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -65.02 -14.76 61.22 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 176.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 69.8 mt-30 -142.91 157.7 60.68 Favored Pre-proline 0 CA--C 1.547 0.861 0 C-N-CA 126.252 1.821 . . . . 0.0 111.069 -176.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -65.65 157.06 60.58 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 123.336 2.691 . . . . 0.0 113.309 176.082 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 21.8 t -77.09 85.8 0.84 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 125.085 1.354 . . . . 0.0 110.015 178.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -71.31 86.11 0.8 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.025 1.33 . . . . 0.0 111.303 177.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.37 -27.88 26.23 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 124.893 1.277 . . . . 0.0 114.395 -178.492 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 82.0 mt -65.77 -49.96 73.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 124.831 1.252 . . . . 0.0 111.109 173.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 85.5 mttt -67.3 -40.37 86.03 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.932 1.293 . . . . 0.0 112.4 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.9 mp -82.65 -3.59 56.51 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.869 1.667 . . . . 0.0 112.7 -179.44 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 51.76 56.35 7.97 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.977 1.711 . . . . 0.0 113.123 -178.258 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 28.0 mt -112.76 81.87 4.66 Favored Pre-proline 0 CA--C 1.545 0.751 0 C-N-CA 126.179 1.792 . . . . 0.0 109.926 179.221 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -67.38 -7.82 20.25 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 124.026 3.151 . . . . 0.0 114.827 -170.095 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -132.17 17.49 4.54 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.926 1.691 . . . . 0.0 112.515 -179.156 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -48.12 -51.99 22.38 Favored 'General case' 0 N--CA 1.477 0.911 0 O-C-N 120.86 -1.15 . . . . 0.0 112.985 -175.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -76.19 -6.14 49.95 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.633 1.573 . . . . 0.0 114.496 -179.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.4 mmmp? -84.4 -37.04 21.97 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.979 0.912 . . . . 0.0 111.269 174.757 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.3 mp -81.31 -48.1 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 124.087 0.955 . . . . 0.0 110.099 171.624 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 22.0 mm -86.8 111.67 21.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 123.824 0.85 . . . . 0.0 111.596 -176.518 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 29.6 mmmt -63.14 -32.66 74.1 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.488 1.515 . . . . 0.0 112.878 175.262 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 21.7 p-10 -157.3 96.81 2.04 Favored Pre-proline 0 CA--C 1.551 0.992 0 C-N-CA 126.089 1.756 . . . . 0.0 111.904 -169.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -77.32 149.39 27.78 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 123.557 2.838 . . . . 0.0 111.763 176.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 6.7 tpt -158.42 150.33 21.47 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.663 1.185 . . . . 0.0 111.864 179.358 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -150.21 155.21 39.33 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 126.079 1.751 . . . . 0.0 112.172 -178.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.9 ttp -65.24 -33.68 76.57 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 113.45 0.908 . . . . 0.0 113.45 -174.696 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.93 -44.41 98.17 Favored Glycine 0 CA--C 1.531 1.094 0 C-N-CA 124.594 1.093 . . . . 0.0 112.909 175.242 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 65.0 m -67.2 -42.98 83.25 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 118.382 -0.818 . . . . 0.0 111.597 172.093 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 76.2 mt -52.84 -53.85 19.23 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 CA-C-N 119.801 1.182 . . . . 0.0 111.667 178.15 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.449 ' HE3' ' CZ3' ' A' ' 51' ' ' TRP . 16.0 ptpt -59.95 -29.18 68.23 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 113.891 1.071 . . . . 0.0 113.891 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.6 tpmt? -69.96 -45.59 67.07 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.421 1.089 . . . . 0.0 112.453 177.343 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 5.4 ptp180 -73.07 -27.09 61.53 Favored 'General case' 0 N--CA 1.481 1.095 0 N-CA-C 113.874 1.065 . . . . 0.0 113.874 174.116 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 33.2 mt -67.91 -43.19 79.8 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 113.161 0.8 . . . . 0.0 113.161 168.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -64.67 -46.58 81.81 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 119.006 0.821 . . . . 0.0 112.305 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 64.2 m-80 -75.08 173.91 10.11 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.409 1.484 . . . . 0.0 112.337 174.117 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 60.4 t-20 -87.11 114.17 23.49 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 121.364 -0.835 . . . . 0.0 109.01 168.15 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -137.09 -33.77 0.75 Allowed 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.363 1.065 . . . . 0.0 113.676 179.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -139.45 164.84 28.8 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.765 1.626 . . . . 0.0 111.824 177.416 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 5.6 t-105 -91.63 -22.56 20.22 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.736 1.214 . . . . 0.0 112.829 -179.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 7.5 t -143.9 149.01 36.22 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.561 1.144 . . . . 0.0 113.285 -169.353 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -70.96 -18.59 62.62 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 115.764 1.764 . . . . 0.0 115.764 -172.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 11.4 t -60.51 -25.72 66.31 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.403 1.002 . . . . 0.0 113.004 178.491 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -67.08 -42.25 84.98 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 121.31 -0.869 . . . . 0.0 111.87 173.068 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 42.3 t -65.1 -35.4 81.03 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.819 0.847 . . . . 0.0 112.248 172.556 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 80.8 mtp -63.69 -41.43 98.13 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 121.453 -0.78 . . . . 0.0 112.003 173.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -62.17 -39.36 92.39 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 171.373 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 92.4 m-20 -65.0 -42.19 94.7 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 119.414 1.007 . . . . 0.0 112.303 175.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -61.33 -45.79 92.98 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 121.236 -0.915 . . . . 0.0 112.635 172.098 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 31.9 t30 -58.63 -41.11 85.18 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.653 -0.654 . . . . 0.0 111.752 173.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 85.6 m -66.01 -36.56 83.61 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.055 1.342 . . . . 0.0 112.672 178.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 17.3 ttm -58.67 -57.79 11.42 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.025 0.93 . . . . 0.0 111.365 174.179 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 19.3 m-85 -64.86 -38.18 90.11 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 122.831 0.452 . . . . 0.0 112.141 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 92.6 m -64.63 -48.09 76.14 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.502 0.721 . . . . 0.0 112.167 178.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -64.23 -30.14 71.21 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 119.785 1.175 . . . . 0.0 112.578 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 98.8 m -61.39 -43.68 98.45 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.356 0.663 . . . . 0.0 112.66 170.052 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 -68.3 -32.26 72.27 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 177.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 73.5 mt -73.24 -57.51 6.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 123.214 0.606 . . . . 0.0 111.091 179.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -68.59 -27.18 65.82 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 114.111 1.152 . . . . 0.0 114.111 -172.242 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 -113.74 164.61 13.49 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.479 1.112 . . . . 0.0 112.506 -171.373 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -71.06 146.02 92.16 Favored Pre-proline 0 N--CA 1.474 0.741 0 C-N-CA 123.918 0.887 . . . . 0.0 110.513 175.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -66.87 -5.25 12.89 Favored 'Trans proline' 0 CA--C 1.543 0.97 0 C-N-CA 123.839 3.026 . . . . 0.0 114.659 -176.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 45.3 p -112.98 -3.55 14.03 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 126.999 2.12 . . . . 0.0 113.169 -179.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 37.1 t0 -68.91 152.38 45.35 Favored 'General case' 0 CA--C 1.542 0.658 0 O-C-N 121.462 -0.774 . . . . 0.0 111.319 174.099 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -54.65 -48.28 72.49 Favored 'General case' 0 N--CA 1.47 0.546 0 O-C-N 121.625 -0.672 . . . . 0.0 111.927 -179.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.5 tp -55.94 -31.98 31.9 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 -177.011 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 49.0 t -71.05 -51.21 36.89 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 C-N-CA 123.362 0.665 . . . . 0.0 110.647 173.406 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 75.5 mt -61.13 -37.46 82.92 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 119.082 0.856 . . . . 0.0 112.005 179.715 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 37.3 mtp -60.59 -49.52 77.21 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 126.183 1.793 . . . . 0.0 111.672 171.416 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -62.1 -39.61 93.07 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 175.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 90.6 mt-30 -61.88 -44.47 96.75 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 119.209 0.913 . . . . 0.0 111.98 175.465 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.62 -42.76 95.29 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.656 0.782 . . . . 0.0 112.785 176.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 85.3 mt -63.26 -44.89 93.84 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.282 0.633 . . . . 0.0 111.634 172.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -60.85 -41.43 95.86 Favored 'General case' 0 CA--C 1.538 0.483 0 O-C-N 121.145 -0.972 . . . . 0.0 112.744 -177.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 55.5 mtmt -60.06 -28.49 67.84 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 175.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 58.5 mt -84.9 -39.89 14.56 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 C-N-CA 123.481 0.712 . . . . 0.0 111.901 173.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -51.88 -51.34 57.49 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.134 -0.978 . . . . 0.0 110.554 172.034 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 99.3 mt -62.35 -40.88 97.84 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.596 0.758 . . . . 0.0 113.006 179.229 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -70.83 -28.4 64.59 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.663 1.119 . . . . 0.0 112.996 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 70.8 mmtt -76.14 -47.09 25.61 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 117.925 -1.036 . . . . 0.0 112.74 173.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 9.1 m -68.41 -24.92 30.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 CA-C-N 121.024 1.738 . . . . 0.0 112.187 176.024 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -60.19 -28.08 67.66 Favored 'General case' 0 CA--C 1.541 0.633 0 O-C-N 121.523 -0.736 . . . . 0.0 112.682 171.058 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 93.7 mt-30 -98.58 2.75 47.69 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.358 1.463 . . . . 0.0 112.769 177.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 8.1 ttm -53.45 141.76 42.48 Favored Pre-proline 0 CA--C 1.545 0.769 0 C-N-CA 124.863 1.265 . . . . 0.0 112.78 175.265 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -68.95 111.34 2.62 Favored 'Trans proline' 0 CA--C 1.537 0.666 0 C-N-CA 123.111 2.541 . . . . 0.0 109.02 168.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 -69.3 -22.1 63.82 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 -172.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -84.81 156.77 21.2 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.649 1.579 . . . . 0.0 111.662 175.355 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -131.09 128.84 41.01 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.739 1.216 . . . . 0.0 112.547 -168.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 7.7 p -150.46 146.0 16.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 125.134 1.374 . . . . 0.0 111.88 -178.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -63.22 140.66 58.9 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.008 1.323 . . . . 0.0 112.383 175.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 83.3 mt . . . . . 0 N--CA 1.472 0.643 0 N-CA-C 114.202 1.186 . . . . 0.0 114.202 -177.633 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.164 0 N-CA-C 112.621 -0.191 . . . . 0.0 112.621 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 36.0 ptt180 -144.86 154.43 42.63 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.198 1.399 . . . . 0.0 110.58 169.44 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.6 tptm -81.93 130.73 35.16 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.365 1.066 . . . . 0.0 110.279 177.438 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 65.3 p -135.24 165.22 25.93 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.972 1.309 . . . . 0.0 111.936 -169.459 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -50.31 -35.43 27.41 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 112.354 0.502 . . . . 0.0 112.354 174.617 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 14.2 mp0 -57.91 -65.1 0.69 Allowed 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.137 1.375 . . . . 0.0 111.263 173.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 76.1 mt -63.37 -32.71 74.21 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -175.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 -62.22 -54.65 37.81 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 118.473 0.578 . . . . 0.0 110.77 169.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 65.4 t80 -56.86 -38.26 72.46 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.881 0.872 . . . . 0.0 112.632 -179.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 86.1 mmm -55.07 -49.39 71.77 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 172.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -82.92 -18.03 41.57 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 120.385 1.448 . . . . 0.0 114.524 179.206 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 59.5 t30 -99.09 -24.56 14.85 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.77 1.228 . . . . 0.0 112.767 -170.405 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 39.9 t -130.38 -49.83 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 C-N-CA 123.945 0.898 . . . . 0.0 111.576 -179.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 17.1 t -72.17 -68.14 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 CA-C-N 118.943 0.792 . . . . 0.0 111.058 -170.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 60.4 t -58.54 -40.57 79.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 124.578 1.151 . . . . 0.0 110.199 172.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.4 tppt? -52.84 -51.03 62.49 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 118.837 0.744 . . . . 0.0 112.262 177.151 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 72.5 m -70.52 -43.42 69.64 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.191 0.596 . . . . 0.0 111.82 179.253 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 46.5 mt -63.71 -32.04 73.41 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.396 0.679 . . . . 0.0 112.333 179.216 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 14.3 t-105 -74.33 -30.73 62.16 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.887 1.675 . . . . 0.0 113.058 173.038 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp -79.12 -8.8 59.28 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.135 0.974 . . . . 0.0 113.402 175.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 38.6 t-80 -63.02 156.05 25.84 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.278 1.431 . . . . 0.0 113.436 -178.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 19.1 mm100 -60.34 -22.16 62.92 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.052 1.341 . . . . 0.0 114.039 174.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -124.31 21.24 8.76 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.155 1.382 . . . . 0.0 113.666 -172.577 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.01 -24.77 62.44 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.093 1.357 . . . . 0.0 113.95 174.377 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 64.4 p-90 -59.38 -33.88 19.39 Favored Pre-proline 0 CA--C 1.547 0.827 0 N-CA-C 117.538 2.421 . . . . 0.0 117.538 -170.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -79.31 2.47 8.3 Favored 'Trans proline' 0 CA--C 1.547 1.132 0 CA-C-N 122.985 2.102 . . . . 0.0 113.058 172.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -117.9 9.89 13.0 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.273 1.829 . . . . 0.0 113.206 178.077 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 22.5 m-30 -74.6 -17.02 60.78 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 120.396 -1.44 . . . . 0.0 113.538 174.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 31.4 mm-40 -149.21 148.58 27.15 Favored Pre-proline 0 CA--C 1.546 0.805 0 C-N-CA 126.495 1.918 . . . . 0.0 110.753 -178.685 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -68.05 163.26 36.54 Favored 'Trans proline' 0 CA--C 1.537 0.627 0 C-N-CA 124.085 3.19 . . . . 0.0 113.572 -177.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 46.9 t -72.59 89.12 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 124.685 1.194 . . . . 0.0 110.012 173.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -69.57 78.77 0.41 Allowed 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.824 1.25 . . . . 0.0 109.96 169.165 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -52.28 -24.92 8.22 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.677 1.362 . . . . 0.0 114.677 -174.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 84.9 mt -62.94 -48.89 85.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 125.204 1.401 . . . . 0.0 111.32 170.651 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 56.5 mttm -76.01 -40.97 52.44 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 125.912 1.685 . . . . 0.0 112.836 -179.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -72.12 -11.03 60.56 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.244 1.018 . . . . 0.0 113.555 172.43 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.5 t30 58.46 54.07 5.8 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 126.697 1.999 . . . . 0.0 112.71 178.652 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 37.2 mt -114.61 81.29 6.91 Favored Pre-proline 0 CA--C 1.543 0.691 0 C-N-CA 126.289 1.836 . . . . 0.0 110.17 -178.274 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -66.15 -12.66 36.44 Favored 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 123.325 2.683 . . . . 0.0 113.296 -177.383 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 35.0 m-20 -111.42 6.01 20.02 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 126.074 1.75 . . . . 0.0 113.365 177.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -54.26 -52.22 62.07 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 120.472 1.487 . . . . 0.0 112.15 -178.335 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -76.75 -15.26 59.81 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.692 1.197 . . . . 0.0 114.121 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 9.5 mptt -69.41 -44.52 71.21 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 121.304 -0.873 . . . . 0.0 110.731 174.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.4 mp -81.87 -51.67 14.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 C-N-CA 123.524 0.73 . . . . 0.0 110.151 173.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 22.7 mm -83.41 101.79 8.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 CA-C-O 122.328 1.061 . . . . 0.0 111.599 -177.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -65.7 -30.88 71.62 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 126.046 1.738 . . . . 0.0 113.473 178.063 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -148.6 111.72 3.66 Favored Pre-proline 0 CA--C 1.546 0.819 0 C-N-CA 125.996 1.719 . . . . 0.0 110.488 174.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -87.84 160.23 7.55 Favored 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 124.306 3.337 . . . . 0.0 112.016 172.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.5 tpt -159.3 155.71 27.36 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.84 1.256 . . . . 0.0 111.88 175.578 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -149.65 151.16 33.28 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.103 1.361 . . . . 0.0 113.42 -175.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 4.3 ttp -65.67 -33.24 75.42 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.244 1.017 . . . . 0.0 112.804 -174.396 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -58.53 -45.65 94.24 Favored Glycine 0 CA--C 1.528 0.875 0 C-N-CA 124.327 0.965 . . . . 0.0 112.163 176.012 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 25.4 m -70.13 -43.68 70.47 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.104 0.962 . . . . 0.0 111.885 176.308 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 83.3 mt -52.97 -52.71 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.182 0 CA-C-N 119.428 1.013 . . . . 0.0 111.413 177.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 6.5 ttpm? -56.43 -32.59 65.03 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.424 1.489 . . . . 0.0 113.201 177.548 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.1 tpmt? -72.72 -45.33 59.29 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.936 1.294 . . . . 0.0 113.275 177.394 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 3.1 ptp180 -69.04 -31.09 69.63 Favored 'General case' 0 N--CA 1.483 1.218 0 CA-C-N 119.49 1.041 . . . . 0.0 113.421 174.448 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 55.4 mt -64.94 -41.31 95.62 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 113.774 1.027 . . . . 0.0 113.774 169.255 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -62.3 -33.44 74.66 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 118.809 0.731 . . . . 0.0 112.756 176.709 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 52.5 m-80 -79.52 -176.49 5.31 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 125.624 1.569 . . . . 0.0 112.511 171.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -105.39 42.54 1.22 Allowed 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 125.555 1.542 . . . . 0.0 110.394 174.08 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 45.5 t80 -66.61 -32.99 74.67 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 114.046 1.128 . . . . 0.0 114.046 -168.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -139.04 -177.26 4.81 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.531 1.932 . . . . 0.0 112.755 -177.269 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 4.5 t-105 -107.57 -25.73 11.22 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.41 1.484 . . . . 0.0 112.848 -177.013 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 47.0 t -136.55 143.08 43.49 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.709 1.204 . . . . 0.0 112.162 -170.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -57.56 -19.3 24.5 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.625 1.17 . . . . 0.0 113.839 169.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 10.4 m -53.17 -36.57 61.04 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 119.098 0.863 . . . . 0.0 112.65 177.416 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -71.85 -40.92 68.67 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 123.75 0.82 . . . . 0.0 112.731 176.384 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 43.0 t -61.06 -36.51 79.8 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 123.912 0.885 . . . . 0.0 112.572 170.301 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 78.8 mtp -68.33 -39.8 81.81 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.335 1.054 . . . . 0.0 111.95 175.641 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -61.0 -40.82 95.01 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 123.236 0.614 . . . . 0.0 112.006 169.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -64.03 -43.11 96.55 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 121.535 -0.728 . . . . 0.0 112.245 175.53 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -61.0 -41.72 97.06 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 121.301 -0.874 . . . . 0.0 112.912 172.375 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 13.9 t30 -57.53 -50.47 72.98 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 118.398 0.544 . . . . 0.0 111.193 172.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 53.7 m -57.84 -38.59 75.92 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 176.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 19.3 ttm -59.96 -62.4 1.9 Allowed 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.515 1.052 . . . . 0.0 111.611 176.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -63.02 -39.82 95.91 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -176.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 60.8 m -66.25 -44.39 83.83 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 118.272 -0.871 . . . . 0.0 112.572 178.176 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -64.29 -32.63 74.31 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 120.921 1.691 . . . . 0.0 112.398 178.126 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 57.5 m -60.82 -43.98 97.51 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.229 0.612 . . . . 0.0 112.433 169.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -67.66 -32.99 74.05 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 176.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 80.0 mt -72.58 -58.01 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 123.613 0.765 . . . . 0.0 111.038 178.25 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -69.71 -19.53 63.56 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 114.381 1.252 . . . . 0.0 114.381 -170.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 36.5 m-80 -123.25 160.15 27.24 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.724 1.21 . . . . 0.0 112.144 -173.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.85 148.72 96.51 Favored Pre-proline 0 N--CA 1.472 0.642 0 C-N-CA 124.242 1.017 . . . . 0.0 110.641 176.918 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -65.32 -8.52 19.02 Favored 'Trans proline' 0 CA--C 1.543 0.947 0 C-N-CA 123.67 2.913 . . . . 0.0 114.723 -175.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 44.8 p -107.92 -4.08 18.28 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.745 2.018 . . . . 0.0 113.471 179.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -67.09 145.99 54.75 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 118.909 0.777 . . . . 0.0 111.11 175.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -52.68 -45.32 66.76 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.682 0.793 . . . . 0.0 112.736 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 9.1 tp -57.37 -35.19 48.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 124.387 1.075 . . . . 0.0 113.785 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 48.0 t -68.51 -44.38 83.07 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 C-N-CA 123.393 0.677 . . . . 0.0 110.534 174.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 68.9 mt -62.7 -36.43 82.92 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 118.848 0.749 . . . . 0.0 112.094 176.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 1.1 mmt -57.61 -52.27 66.12 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 118.241 0.473 . . . . 0.0 111.004 170.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -63.17 -37.37 86.95 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.582 0.753 . . . . 0.0 112.758 179.322 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 83.2 mt-30 -62.08 -40.61 96.4 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 119.607 1.094 . . . . 0.0 112.861 173.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -69.81 -45.46 67.83 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.545 -0.722 . . . . 0.0 112.107 176.502 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 83.1 mt -64.54 -43.97 92.31 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.622 0.769 . . . . 0.0 112.234 177.193 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -63.27 -40.95 98.83 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 119.81 1.186 . . . . 0.0 112.874 -175.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 36.0 mtmm -59.77 -39.62 85.49 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 121.528 -0.733 . . . . 0.0 111.954 175.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 77.0 mt -72.75 -41.11 61.91 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 C-N-CA 122.947 0.499 . . . . 0.0 111.424 176.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 16.7 t80 -51.06 -51.24 55.19 Favored 'General case' 0 CA--C 1.538 0.511 0 O-C-N 121.491 -0.756 . . . . 0.0 110.53 172.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 98.1 mt -65.14 -41.28 94.91 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 178.301 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -65.53 -32.16 73.61 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 120.118 1.327 . . . . 0.0 112.293 179.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 70.3 mmtt -75.5 -48.67 21.53 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 117.536 -1.221 . . . . 0.0 112.146 177.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 6.1 m -67.06 -26.76 37.42 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 CA-C-N 121.13 1.786 . . . . 0.0 112.3 177.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -61.22 -30.96 70.75 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 172.041 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 99.5 mt-30 -89.58 -7.92 53.76 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.992 1.317 . . . . 0.0 112.955 175.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 46.2 ttp -65.49 144.32 98.91 Favored Pre-proline 0 CA--C 1.547 0.84 0 CA-C-N 119.141 0.882 . . . . 0.0 111.301 173.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -53.69 142.94 60.0 Favored 'Trans proline' 0 CA--C 1.539 0.738 0 C-N-CA 122.548 2.165 . . . . 0.0 111.904 168.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -91.29 -24.0 19.97 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 112.581 0.586 . . . . 0.0 112.581 176.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -86.74 155.33 20.39 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.662 1.185 . . . . 0.0 111.508 172.562 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -103.09 138.56 39.77 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.196 1.398 . . . . 0.0 111.558 -174.151 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 69.2 t -137.85 124.65 28.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 125.529 1.532 . . . . 0.0 109.129 177.51 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -69.84 128.73 37.41 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.52 1.128 . . . . 0.0 111.084 169.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 49.8 mt . . . . . 0 N--CA 1.471 0.586 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -176.126 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.935 0 CA-C-O 120.832 0.129 . . . . 0.0 113.311 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -173.49 165.12 4.64 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 127.289 2.236 . . . . 0.0 110.983 175.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 5.5 mmtp -64.64 136.22 56.75 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.609 1.164 . . . . 0.0 111.959 173.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 71.0 p -142.0 161.84 36.97 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 126.307 1.843 . . . . 0.0 109.899 177.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 16.0 t30 -52.7 -33.61 48.38 Favored 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 114.622 1.341 . . . . 0.0 114.622 177.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -72.25 -47.15 52.45 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.084 -1.01 . . . . 0.0 112.208 174.002 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 86.1 mt -62.56 -30.88 71.63 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 121.223 -0.923 . . . . 0.0 112.33 174.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -58.98 -54.33 48.3 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.816 1.247 . . . . 0.0 109.947 169.126 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 63.3 t80 -58.49 -41.61 85.72 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.966 0.907 . . . . 0.0 112.909 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 96.2 mmm -54.78 -52.33 62.93 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 118.348 0.522 . . . . 0.0 111.834 173.333 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -71.09 -31.79 68.24 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 113.793 1.034 . . . . 0.0 113.793 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 42.9 t30 -98.89 -16.27 18.88 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 114.658 1.355 . . . . 0.0 114.658 -166.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 17.2 t -132.81 -50.26 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 122.8 0.44 . . . . 0.0 111.271 -179.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 17.9 t -69.86 -66.41 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 123.645 0.778 . . . . 0.0 110.423 -174.291 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 48.7 t -55.1 -47.74 76.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 125.836 1.654 . . . . 0.0 110.303 173.266 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 52.0 tttt -59.8 -37.94 80.55 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.89 0.876 . . . . 0.0 113.176 -175.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 22.2 m -83.52 -38.54 21.61 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 118.542 0.61 . . . . 0.0 112.37 177.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 67.9 mt -60.86 -35.49 76.73 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 121.585 -0.697 . . . . 0.0 112.343 172.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 20.2 t-105 -70.55 -29.69 66.21 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.201 1.4 . . . . 0.0 113.543 176.507 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 55.0 mttm -71.15 -17.59 62.54 Favored 'General case' 0 N--CA 1.484 1.261 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 172.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 44.5 t-80 -62.37 151.15 37.64 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.58 1.152 . . . . 0.0 113.596 -171.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 26.4 mp0 -59.28 -16.77 23.62 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.018 1.727 . . . . 0.0 114.167 176.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 -124.63 17.85 8.78 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.721 1.608 . . . . 0.0 113.747 -177.403 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.24 -28.57 66.46 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 176.139 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 42.9 p-90 -57.42 -38.05 63.63 Favored Pre-proline 0 CA--C 1.547 0.86 0 N-CA-C 117.613 2.449 . . . . 0.0 117.613 -170.201 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -70.97 -6.26 18.8 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 CA-C-N 123.115 2.148 . . . . 0.0 114.225 173.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 56.6 m-85 -109.61 -4.32 16.28 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.343 1.457 . . . . 0.0 112.921 178.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 21.0 m-30 -62.43 -18.26 61.28 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 114.343 1.238 . . . . 0.0 114.343 178.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 86.5 mt-30 -143.79 155.75 59.46 Favored Pre-proline 0 CA--C 1.544 0.727 0 C-N-CA 125.787 1.635 . . . . 0.0 110.559 -175.165 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -64.84 146.36 87.96 Favored 'Trans proline' 0 CA--C 1.539 0.773 0 C-N-CA 122.733 2.289 . . . . 0.0 111.862 173.436 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 95.9 t -62.13 120.54 8.6 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 123.932 0.893 . . . . 0.0 111.732 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 38.2 m-20 -89.02 89.45 7.99 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.505 1.122 . . . . 0.0 109.952 169.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.95 -28.11 48.85 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 113.603 0.964 . . . . 0.0 113.603 178.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 81.8 mt -64.86 -50.08 76.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 124.876 1.27 . . . . 0.0 111.039 172.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -66.86 -41.17 87.76 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.039 1.336 . . . . 0.0 112.807 -179.223 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.4 mp -80.2 -3.78 50.44 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.124 0.969 . . . . 0.0 113.21 176.359 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 61.8 t30 54.89 55.73 7.45 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 126.259 1.824 . . . . 0.0 113.448 -179.422 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 44.1 mt -115.2 80.43 7.26 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 126.587 1.955 . . . . 0.0 110.594 -176.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -68.88 -4.7 13.91 Favored 'Trans proline' 0 CA--C 1.544 1.023 0 C-N-CA 123.992 3.128 . . . . 0.0 114.418 -175.203 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -124.54 15.11 8.84 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.524 1.929 . . . . 0.0 111.951 179.195 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -51.12 -57.12 9.54 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 120.727 -1.233 . . . . 0.0 112.788 -176.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -73.54 -2.41 22.63 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.962 1.305 . . . . 0.0 114.194 178.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -84.52 -43.23 14.74 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.395 1.078 . . . . 0.0 110.611 176.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.3 mp -82.14 -47.57 19.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 C-N-CA 124.397 1.079 . . . . 0.0 110.423 172.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 34.4 mm -78.6 113.7 18.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 123.549 0.74 . . . . 0.0 111.254 -179.04 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -77.01 -31.05 56.14 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.947 1.299 . . . . 0.0 112.575 174.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 18.4 p30 -149.88 83.29 6.29 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 125.609 1.564 . . . . 0.0 112.215 -168.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -70.34 138.42 35.93 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 123.179 2.586 . . . . 0.0 110.932 178.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 8.5 tpt -156.32 137.58 13.81 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.863 1.265 . . . . 0.0 110.017 -174.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -146.17 148.31 32.41 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 125.316 1.446 . . . . 0.0 111.364 -175.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 9.4 ttp -57.54 -36.98 72.33 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.173 1.389 . . . . 0.0 113.181 -171.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.56 -27.05 65.45 Favored Glycine 0 CA--C 1.533 1.206 0 C-N-CA 124.989 1.28 . . . . 0.0 114.366 173.584 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 26.0 m -87.36 -37.28 17.23 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.457 1.103 . . . . 0.0 111.215 172.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 66.5 mt -56.43 -51.14 68.08 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 CA-C-N 119.61 1.096 . . . . 0.0 110.892 176.184 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 15.0 ptmm? -59.39 -37.07 77.04 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 175.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.71 -36.41 80.85 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.473 1.109 . . . . 0.0 112.842 -178.634 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 5.7 ptp180 -80.59 -30.62 36.89 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 114.114 1.153 . . . . 0.0 114.114 172.289 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 76.2 mt -63.74 -30.9 71.94 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-N 119.759 1.163 . . . . 0.0 113.794 168.588 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -66.16 -15.0 62.76 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 114.618 1.34 . . . . 0.0 114.618 -178.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -138.56 177.85 7.58 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 125.397 1.479 . . . . 0.0 113.592 -174.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 4.0 p30 -78.34 97.65 5.68 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 124.431 1.092 . . . . 0.0 111.78 173.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 78.7 t80 -131.24 -37.78 1.24 Allowed 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.54 1.136 . . . . 0.0 113.023 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -132.9 173.44 11.4 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.896 1.678 . . . . 0.0 111.098 169.831 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.6 t-105 -106.78 -19.07 13.76 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.306 1.042 . . . . 0.0 112.544 -177.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 78.6 p -137.63 145.71 43.05 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.487 1.115 . . . . 0.0 114.009 -170.251 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -63.53 -22.22 66.77 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 114.847 1.425 . . . . 0.0 114.847 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 15.3 p -51.54 -35.29 40.18 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.273 1.029 . . . . 0.0 113.452 174.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -70.01 -43.52 71.2 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.117 0.967 . . . . 0.0 112.105 176.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 51.0 t -63.32 -39.33 94.25 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.245 1.018 . . . . 0.0 112.298 173.04 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 86.7 mtp -61.75 -42.14 98.58 Favored 'General case' 0 N--CA 1.47 0.546 0 O-C-N 121.291 -0.881 . . . . 0.0 112.279 174.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 90.8 mm-40 -62.93 -38.57 91.51 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 172.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -63.77 -42.45 97.78 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 119.347 0.976 . . . . 0.0 112.421 174.503 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -59.66 -45.28 92.51 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.21 -0.931 . . . . 0.0 112.356 171.313 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -57.97 -46.03 85.8 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.82 -0.55 . . . . 0.0 112.222 174.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 84.0 m -63.75 -38.31 90.64 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.177 0.991 . . . . 0.0 112.669 176.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 51.0 ttp -59.13 -53.07 62.55 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 119.385 0.993 . . . . 0.0 112.03 176.214 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -68.33 -39.53 81.91 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 121.996 -0.44 . . . . 0.0 112.081 179.367 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 86.4 m -64.24 -48.26 76.5 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.65 0.78 . . . . 0.0 112.063 -179.719 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -64.06 -32.18 73.64 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 119.055 0.843 . . . . 0.0 112.067 -179.7 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 88.7 m -61.16 -44.24 97.63 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.731 0.812 . . . . 0.0 112.885 170.406 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 17.0 m-85 -67.63 -29.45 68.76 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 114.031 1.122 . . . . 0.0 114.031 178.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 87.5 mt -68.83 -56.91 10.43 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 123.136 0.574 . . . . 0.0 110.648 175.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 25.8 t80 -69.61 -37.83 77.03 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 -173.028 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 52.3 m-80 -103.55 151.88 22.36 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.408 1.083 . . . . 0.0 111.164 -172.468 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.34 153.87 93.97 Favored Pre-proline 0 N--CA 1.469 0.493 0 C-N-CA 123.804 0.842 . . . . 0.0 111.135 178.909 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -64.02 -3.28 5.71 Favored 'Trans proline' 0 CA--C 1.547 1.133 0 C-N-CA 124.288 3.325 . . . . 0.0 114.79 -178.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 62.1 p -122.22 0.02 9.47 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 126.944 2.097 . . . . 0.0 113.256 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 65.5 m-20 -67.93 146.1 53.93 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 118.886 0.766 . . . . 0.0 110.759 170.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -56.45 -46.46 80.31 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 121.537 -0.727 . . . . 0.0 112.36 -176.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.5 tp -55.38 -29.84 24.48 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 125.008 1.323 . . . . 0.0 114.321 177.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 40.3 t -72.31 -47.22 53.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 O-C-N 121.272 -0.893 . . . . 0.0 110.431 173.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 71.0 mt -61.03 -36.97 80.94 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 118.943 0.792 . . . . 0.0 111.617 176.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 9.4 mtt -58.92 -51.88 68.13 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.957 1.303 . . . . 0.0 112.081 169.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.6 -40.08 90.51 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.349 0.659 . . . . 0.0 112.702 176.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 89.1 mt-30 -61.73 -45.92 91.85 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 119.072 0.851 . . . . 0.0 111.975 173.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -67.65 -28.72 67.96 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.55 1.14 . . . . 0.0 113.794 178.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 77.1 mt -76.72 -46.84 23.87 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.513 0.725 . . . . 0.0 111.455 169.517 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -61.4 -40.36 94.1 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.186 0.903 . . . . 0.0 113.084 -174.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -60.52 -33.72 73.05 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 113.187 0.81 . . . . 0.0 113.187 177.254 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 48.1 mt -78.75 -43.21 25.36 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 124.026 0.93 . . . . 0.0 111.415 173.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -49.33 -50.06 41.28 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 120.036 1.289 . . . . 0.0 110.907 172.168 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 99.9 mt -62.99 -42.72 99.92 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 113.126 0.788 . . . . 0.0 113.126 179.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -69.7 -28.44 65.83 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.793 1.179 . . . . 0.0 112.782 178.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 33.9 mmtm -72.8 -52.03 16.6 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 125.423 1.489 . . . . 0.0 111.639 175.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.9 m -68.89 -25.09 29.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 CA-C-N 119.88 1.218 . . . . 0.0 112.382 178.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -59.15 -29.01 67.11 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 173.071 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -92.57 -4.11 53.97 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.637 1.175 . . . . 0.0 112.866 176.371 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 40.7 ttp -65.87 139.14 96.7 Favored Pre-proline 0 CA--C 1.546 0.814 0 O-C-N 121.189 -0.945 . . . . 0.0 110.371 170.557 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -65.74 133.25 33.32 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 122.929 2.419 . . . . 0.0 110.896 176.103 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -69.1 -30.8 69.16 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 178.317 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -76.57 162.04 28.1 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.651 1.58 . . . . 0.0 111.153 169.383 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -134.81 145.19 48.11 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.678 1.191 . . . . 0.0 111.802 -176.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 54.9 t -131.55 134.17 60.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 125.311 1.444 . . . . 0.0 110.622 -174.472 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -69.19 120.61 15.29 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.599 1.559 . . . . 0.0 111.399 171.004 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 91.2 mt . . . . . 0 N--CA 1.472 0.65 0 C-N-CA 124.115 0.966 . . . . 0.0 112.986 -179.347 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.82 0 N-CA-C 115.34 0.896 . . . . 0.0 115.34 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 47.7 mtm180 -145.75 179.47 7.42 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 127.129 2.172 . . . . 0.0 111.681 -172.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 40.1 tttm -128.49 69.89 1.37 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 127.196 2.198 . . . . 0.0 109.063 172.389 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 50.3 p -82.71 170.54 14.98 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.313 1.445 . . . . 0.0 113.501 -175.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 27.6 p-10 -48.47 -37.43 17.31 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 125.084 1.354 . . . . 0.0 114.503 169.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -72.82 -49.58 29.51 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 121.481 -0.762 . . . . 0.0 111.539 178.761 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 93.5 mt -63.53 -30.98 72.02 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 121.552 -0.717 . . . . 0.0 112.386 175.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 52.3 tt0 -58.79 -53.78 54.47 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 123.635 0.774 . . . . 0.0 110.498 168.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -59.67 -39.76 85.56 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.794 0.838 . . . . 0.0 112.772 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 93.0 mmm -55.89 -49.19 74.08 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 121.559 -0.713 . . . . 0.0 111.668 171.257 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -85.65 -3.79 58.98 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 115.046 1.499 . . . . 0.0 115.046 -175.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 37.1 m-80 -122.08 -16.76 7.42 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.305 1.442 . . . . 0.0 114.46 -176.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 54.8 t -134.07 -50.26 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 123.77 0.828 . . . . 0.0 111.359 -179.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 22.0 t -69.65 -63.19 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 CA-C-N 119.16 0.891 . . . . 0.0 110.594 -174.36 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 85.1 t -58.65 -44.66 90.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 123.946 0.898 . . . . 0.0 110.405 172.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? -56.91 -45.01 82.92 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.949 0.9 . . . . 0.0 112.614 -177.462 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 56.4 m -72.75 -45.04 60.74 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 122.813 0.445 . . . . 0.0 111.679 177.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 69.8 mt -62.97 -33.54 75.6 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.137 0.575 . . . . 0.0 112.237 179.331 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 19.5 t-105 -71.55 -29.85 65.21 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.288 1.435 . . . . 0.0 113.339 174.073 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -80.49 -7.8 59.32 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 176.032 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 40.2 t-80 -64.02 154.28 34.71 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.691 1.196 . . . . 0.0 113.357 -179.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -61.95 -17.59 57.44 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.143 1.377 . . . . 0.0 114.179 175.721 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -122.9 17.33 10.14 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.557 1.543 . . . . 0.0 113.664 -174.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.53 -27.99 65.64 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 114.165 1.172 . . . . 0.0 114.165 177.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 43.3 p-90 -57.65 -37.81 60.44 Favored Pre-proline 0 CA--C 1.548 0.882 0 N-CA-C 117.808 2.521 . . . . 0.0 117.808 -169.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -74.09 -3.46 13.83 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 CA-C-N 123.143 2.158 . . . . 0.0 113.9 173.609 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -109.96 -4.67 15.79 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.475 1.51 . . . . 0.0 112.969 178.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 22.5 m-30 -63.11 -16.39 59.83 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 114.143 1.164 . . . . 0.0 114.143 175.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 90.3 mt-30 -145.73 157.96 50.47 Favored Pre-proline 0 CA--C 1.546 0.817 0 C-N-CA 126.175 1.79 . . . . 0.0 110.837 -175.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -66.53 155.35 70.63 Favored 'Trans proline' 0 C--N 1.35 0.63 0 C-N-CA 122.933 2.422 . . . . 0.0 111.844 171.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 37.1 t -76.61 99.72 2.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 124.202 1.001 . . . . 0.0 109.879 177.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -71.6 88.63 0.95 Allowed 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.319 1.048 . . . . 0.0 111.351 175.193 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.64 -31.16 46.29 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.576 1.15 . . . . 0.0 114.094 -179.154 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 84.3 mt -66.12 -49.33 77.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 124.702 1.201 . . . . 0.0 111.075 174.476 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -65.42 -37.01 85.67 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 125.464 1.505 . . . . 0.0 113.376 -179.026 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.8 mp -88.25 -2.97 58.91 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.431 1.493 . . . . 0.0 112.558 177.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 24.1 m120 52.55 57.97 5.86 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.015 1.726 . . . . 0.0 113.255 -178.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 47.0 mt -114.29 81.75 6.82 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 126.625 1.97 . . . . 0.0 109.992 -179.369 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -67.19 -8.65 22.54 Favored 'Trans proline' 0 CA--C 1.543 0.963 0 C-N-CA 123.969 3.113 . . . . 0.0 113.684 -175.183 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 18.7 p-10 -118.21 8.2 12.27 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 127.988 2.515 . . . . 0.0 113.078 179.781 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 86.3 t80 -52.25 -57.24 10.31 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 120.164 1.347 . . . . 0.0 112.124 -179.215 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 99.8 m-70 -75.89 -5.93 48.39 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.21 1.404 . . . . 0.0 114.104 178.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -78.08 -32.65 50.84 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.974 0.909 . . . . 0.0 111.419 174.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.1 mp -98.26 -44.85 12.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 125.734 1.613 . . . . 0.0 111.296 175.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 21.3 mm -71.48 114.65 10.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 123.552 0.741 . . . . 0.0 110.929 176.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.69 -35.9 51.73 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 124.709 1.204 . . . . 0.0 113.226 172.448 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 15.2 p30 -145.34 83.81 8.9 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 125.213 1.405 . . . . 0.0 112.119 -167.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -68.63 138.58 42.02 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 123.482 2.788 . . . . 0.0 110.927 178.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.9 tpt -159.58 145.55 16.03 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 125.352 1.461 . . . . 0.0 110.116 -175.43 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -149.77 152.42 35.2 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.869 1.267 . . . . 0.0 112.005 -177.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 6.8 ttp -59.72 -33.87 72.18 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.524 1.129 . . . . 0.0 112.564 -177.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.51 -23.45 60.5 Favored Glycine 0 CA--C 1.536 1.366 0 C-N-CA 125.86 1.695 . . . . 0.0 114.977 172.123 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 89.8 m -97.11 -37.04 10.28 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.393 1.077 . . . . 0.0 111.372 173.178 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 98.7 mt -53.45 -49.75 52.59 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 CA-C-N 119.877 1.217 . . . . 0.0 111.088 175.368 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.7 -30.3 65.4 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 113.828 1.048 . . . . 0.0 113.828 175.846 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.421 ' HA ' ' HE3' ' A' ' 88' ' ' LYS . 1.2 tpmt? -80.17 -35.61 36.21 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.099 0.96 . . . . 0.0 112.992 -175.811 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 9.4 ptp180 -70.27 -29.84 66.73 Favored 'General case' 0 N--CA 1.482 1.138 0 CA-C-N 119.399 0.999 . . . . 0.0 113.03 169.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 70.3 mt -63.58 -43.32 97.32 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.664 0.786 . . . . 0.0 112.341 169.213 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -71.93 -2.22 17.25 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 114.662 1.356 . . . . 0.0 114.662 175.082 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 39.4 m-80 -124.77 15.05 8.67 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.667 1.587 . . . . 0.0 113.565 -177.539 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 40.62 47.83 2.45 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 126.247 1.819 . . . . 0.0 114.287 -179.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 85.8 t80 -63.17 -20.64 65.59 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 126.243 1.817 . . . . 0.0 114.179 -170.318 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -143.18 164.82 29.14 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 128.158 2.583 . . . . 0.0 111.729 -171.009 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 23.9 t-105 -87.6 -25.38 23.61 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.804 1.242 . . . . 0.0 112.703 -179.184 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 6.4 t -145.68 152.52 39.76 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 125.418 1.487 . . . . 0.0 111.981 -169.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -67.38 -15.76 63.86 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 115.248 1.574 . . . . 0.0 115.248 -176.622 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 32.0 p -54.06 -34.93 61.37 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 177.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -72.36 -41.36 66.49 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.669 0.787 . . . . 0.0 111.989 176.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 48.0 t -62.71 -40.48 97.27 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 123.914 0.886 . . . . 0.0 111.838 172.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 88.2 mtp -60.63 -41.69 95.38 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.9 0.88 . . . . 0.0 112.075 172.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 43.2 mm-40 -66.82 -30.32 70.48 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 173.617 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 80.3 m-20 -69.8 -39.95 76.24 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 119.702 1.137 . . . . 0.0 112.075 172.601 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -60.98 -47.99 83.89 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 121.631 -0.668 . . . . 0.0 111.959 169.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 33.0 t30 -55.45 -44.54 76.45 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.616 0.766 . . . . 0.0 111.805 173.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 96.0 m -61.49 -46.8 88.48 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.207 1.003 . . . . 0.0 111.884 177.358 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 50.7 ttp -56.75 -52.91 63.18 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.1 0.96 . . . . 0.0 112.439 177.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -67.16 -39.48 86.5 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.744 -0.597 . . . . 0.0 112.139 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 96.8 m -64.32 -47.89 77.69 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.951 0.9 . . . . 0.0 112.013 178.769 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.3 p30 -63.72 -30.66 71.73 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 118.814 0.734 . . . . 0.0 112.382 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 67.4 m -64.25 -42.24 96.59 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.279 1.031 . . . . 0.0 112.54 172.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 15.0 m-85 -68.23 -29.75 68.64 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 177.704 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 88.1 mt -69.73 -56.34 11.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 123.331 0.652 . . . . 0.0 110.557 176.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 57.4 t80 -70.49 -38.43 74.37 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 114.595 1.332 . . . . 0.0 114.595 -172.004 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 59.9 m-80 -97.36 159.26 15.02 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.262 1.025 . . . . 0.0 111.939 -175.103 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -68.85 150.55 97.59 Favored Pre-proline 0 N--CA 1.473 0.676 0 O-C-N 121.299 -0.875 . . . . 0.0 109.721 173.282 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -65.66 -1.75 5.35 Favored 'Trans proline' 0 CA--C 1.546 1.115 0 C-N-CA 123.854 3.036 . . . . 0.0 114.722 -179.119 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 56.2 p -120.88 -0.33 10.13 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 126.947 2.099 . . . . 0.0 113.198 -179.301 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -66.75 145.77 55.17 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.601 -0.687 . . . . 0.0 110.805 170.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -56.45 -45.42 80.85 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.445 -0.784 . . . . 0.0 112.441 -176.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.6 tp -55.7 -29.93 26.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 124.955 1.302 . . . . 0.0 114.171 177.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 42.3 t -72.81 -45.97 54.65 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 O-C-N 121.314 -0.866 . . . . 0.0 110.519 173.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 68.5 mt -61.44 -36.76 81.27 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 119.137 0.88 . . . . 0.0 111.675 176.231 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 11.5 mtt -59.39 -52.48 65.42 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.581 1.152 . . . . 0.0 111.994 169.72 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -59.56 -40.26 86.73 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.589 0.755 . . . . 0.0 112.431 177.165 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -61.21 -50.39 73.3 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.977 0.911 . . . . 0.0 111.745 174.437 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -63.07 -40.0 96.38 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.434 0.693 . . . . 0.0 112.823 179.573 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 73.7 mt -65.53 -46.88 77.86 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.485 0.714 . . . . 0.0 111.72 172.167 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -62.78 -37.4 86.5 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.11 -0.994 . . . . 0.0 112.908 -177.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 23.5 mmmt -55.79 -41.82 74.66 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.234 1.014 . . . . 0.0 112.214 172.175 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 78.2 mt -78.18 -39.06 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 C-N-CA 123.921 0.888 . . . . 0.0 111.288 178.386 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 31.9 t80 -50.85 -51.99 45.82 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.53 -0.731 . . . . 0.0 110.302 172.08 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.9 mt -62.53 -41.8 99.11 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 178.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -67.64 -30.15 69.64 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 119.885 1.221 . . . . 0.0 112.664 179.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 69.8 mmtt -76.65 -50.18 14.37 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 117.646 -1.168 . . . . 0.0 112.505 175.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 6.6 m -66.71 -25.34 34.56 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 CA-C-N 121.084 1.765 . . . . 0.0 112.329 178.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -58.93 -28.25 66.05 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 171.284 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 95.0 mm-40 -95.95 -4.73 42.82 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.07 1.348 . . . . 0.0 112.925 177.129 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 41.6 ttp -64.96 137.3 97.11 Favored Pre-proline 0 CA--C 1.545 0.779 0 O-C-N 121.402 -0.811 . . . . 0.0 109.994 169.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -67.85 131.3 23.74 Favored 'Trans proline' 0 CA--C 1.535 0.538 0 C-N-CA 122.642 2.228 . . . . 0.0 110.72 178.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 83.0 mt-30 -70.35 -24.95 63.07 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -76.72 154.82 33.76 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.187 0.995 . . . . 0.0 112.469 169.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -132.4 133.22 43.65 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.363 1.065 . . . . 0.0 110.827 -172.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 7.8 p -150.47 142.73 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 124.678 1.191 . . . . 0.0 111.56 -177.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -65.11 142.3 58.42 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-O 121.554 0.692 . . . . 0.0 111.179 171.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 98.6 mt . . . . . 0 CA--C 1.543 0.699 0 N-CA-C 113.882 1.067 . . . . 0.0 113.882 -178.975 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.001 0 CA-C-O 121.109 0.283 . . . . 0.0 113.705 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 12.4 ptm180 -163.34 162.05 24.85 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 126.602 1.961 . . . . 0.0 110.974 172.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 47.8 pttt -61.48 142.4 57.04 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 170.299 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 69.7 p -148.22 165.34 31.23 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 126.763 2.025 . . . . 0.0 110.895 179.661 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 19.7 p-10 -51.41 -35.37 38.8 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 114.561 1.319 . . . . 0.0 114.561 175.781 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -69.37 -50.64 44.3 Favored 'General case' 0 CA--C 1.531 0.243 0 O-C-N 121.899 -0.501 . . . . 0.0 110.531 178.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 86.9 mt -61.44 -34.88 76.16 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.983 0.913 . . . . 0.0 112.052 175.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 7.5 tp60 -59.41 -52.73 64.35 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.253 1.021 . . . . 0.0 111.516 171.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 73.3 t80 -55.04 -42.54 72.8 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.128 0.971 . . . . 0.0 112.269 177.019 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 96.0 mmm -58.27 -51.11 71.15 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.291 0.636 . . . . 0.0 112.615 174.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -79.33 -15.02 58.6 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 114.952 1.464 . . . . 0.0 114.952 179.455 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 35.5 m-20 -103.52 -19.5 14.36 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 119.644 1.111 . . . . 0.0 113.902 -174.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 39.3 t -133.64 -48.55 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 123.926 0.89 . . . . 0.0 111.506 -178.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 19.9 t -72.3 -64.42 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 CA-C-N 119.015 0.825 . . . . 0.0 110.908 -171.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 86.5 t -57.06 -43.3 80.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 124.098 0.959 . . . . 0.0 109.939 171.335 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 12.2 tppt? -58.89 -34.48 71.7 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.195 0.998 . . . . 0.0 113.341 -178.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 78.1 m -84.01 -42.97 15.64 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 118.716 0.689 . . . . 0.0 111.555 175.673 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 67.9 mt -61.85 -33.04 73.44 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.567 0.747 . . . . 0.0 112.313 177.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 19.8 t-105 -74.71 -28.73 60.93 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.782 1.633 . . . . 0.0 113.303 175.335 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 32.5 mtmm -74.71 -13.55 60.63 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 114.001 1.112 . . . . 0.0 114.001 171.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 36.1 t-80 -61.92 154.5 26.11 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.386 1.075 . . . . 0.0 113.507 -175.141 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 65.4 mt-30 -59.87 -18.27 43.13 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.345 1.458 . . . . 0.0 114.148 176.019 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -126.36 20.51 7.38 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.372 1.469 . . . . 0.0 113.882 -174.221 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.1 -28.08 65.11 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 113.774 1.028 . . . . 0.0 113.774 175.177 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 49.7 p-90 -57.89 -37.14 52.56 Favored Pre-proline 0 CA--C 1.548 0.878 0 N-CA-C 117.689 2.477 . . . . 0.0 117.689 -170.171 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -73.02 -5.32 16.99 Favored 'Trans proline' 0 CA--C 1.542 0.924 0 CA-C-N 123.048 2.124 . . . . 0.0 113.925 173.606 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 72.0 m-85 -109.01 -4.87 16.33 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.312 1.445 . . . . 0.0 113.135 178.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -61.97 -18.24 59.73 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 114.327 1.232 . . . . 0.0 114.327 179.388 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -141.44 154.41 66.87 Favored Pre-proline 0 CA--C 1.544 0.718 0 C-N-CA 125.995 1.718 . . . . 0.0 110.348 179.36 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -67.67 150.19 79.37 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 122.755 2.303 . . . . 0.0 112.626 176.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 89.2 t -62.59 142.24 16.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 123.892 0.877 . . . . 0.0 110.904 171.375 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -125.06 96.0 4.7 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.467 1.507 . . . . 0.0 109.767 174.214 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.8 -29.18 59.29 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -178.15 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 85.3 mt -64.88 -49.04 81.8 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 124.652 1.181 . . . . 0.0 110.831 173.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -68.19 -42.05 80.5 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.092 1.357 . . . . 0.0 112.731 -179.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.6 mp -78.79 -5.15 52.61 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 124.418 1.087 . . . . 0.0 113.231 176.274 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 61.5 t30 55.34 53.67 9.63 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.213 1.805 . . . . 0.0 113.647 -179.224 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 25.7 mt -113.43 86.39 10.0 Favored Pre-proline 0 CA--C 1.544 0.715 0 C-N-CA 126.285 1.834 . . . . 0.0 110.094 -177.374 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_endo -67.82 -4.1 11.66 Favored 'Trans proline' 0 CA--C 1.543 0.965 0 C-N-CA 123.548 2.832 . . . . 0.0 113.247 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 16.9 p-10 -123.7 1.25 8.8 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 127.35 2.26 . . . . 0.0 114.277 -178.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -54.42 -51.1 65.97 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 120.288 1.404 . . . . 0.0 112.034 178.056 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 99.7 m-70 -77.26 1.99 16.95 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.607 1.563 . . . . 0.0 114.281 177.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.6 mmtp -95.92 -42.55 8.24 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.835 1.254 . . . . 0.0 110.553 177.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.9 mp -76.59 -48.33 26.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 C-N-CA 124.05 0.94 . . . . 0.0 110.279 171.357 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 36.6 mm -96.3 128.7 47.25 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 124.318 1.047 . . . . 0.0 111.35 -177.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -95.86 -37.86 10.54 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.831 1.252 . . . . 0.0 111.588 -178.597 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 42.2 m-20 -130.13 78.73 74.17 Favored Pre-proline 0 CA--C 1.547 0.863 0 C-N-CA 125.421 1.488 . . . . 0.0 109.963 -173.063 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -71.13 143.96 45.65 Favored 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 123.948 3.099 . . . . 0.0 111.6 -179.514 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 8.5 tpt -156.88 141.09 16.47 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.316 1.046 . . . . 0.0 111.875 -171.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -148.99 150.8 33.45 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 125.765 1.626 . . . . 0.0 112.409 -175.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 7.0 ttp -59.04 -36.84 75.68 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.893 1.277 . . . . 0.0 113.77 -171.355 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -59.99 -21.27 55.62 Favored Glycine 0 CA--C 1.533 1.183 0 C-N-CA 125.591 1.567 . . . . 0.0 114.739 175.025 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 35.1 m -90.18 -42.04 11.27 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.724 0.81 . . . . 0.0 111.196 173.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 66.4 mt -56.15 -48.28 79.43 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 124.215 1.006 . . . . 0.0 111.407 -178.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.78 -33.59 66.78 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 178.531 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 2.5 tppp? -74.31 -41.89 60.41 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.483 1.113 . . . . 0.0 112.362 -178.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 4.6 ptp180 -71.52 -30.9 66.46 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 172.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 23.7 mt -61.31 -39.16 89.47 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.292 0.951 . . . . 0.0 113.404 169.547 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -67.58 -13.13 61.8 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 115.354 1.613 . . . . 0.0 115.354 -174.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -132.67 175.36 9.39 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.426 1.49 . . . . 0.0 113.727 -178.357 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -77.69 80.84 4.14 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 125.0 1.32 . . . . 0.0 111.999 -178.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 49.3 t80 -114.79 -36.5 4.48 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.815 1.246 . . . . 0.0 113.097 -175.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -137.92 169.95 16.9 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 127.431 2.292 . . . . 0.0 110.925 171.769 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.1 t-105 -102.19 -23.84 13.99 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.675 1.19 . . . . 0.0 112.763 -175.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 35.3 t -139.34 146.51 40.36 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.897 1.279 . . . . 0.0 111.003 177.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -59.74 -13.99 12.49 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.789 2.036 . . . . 0.0 115.133 176.14 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 53.5 p -52.23 -33.0 39.33 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 120.564 1.529 . . . . 0.0 113.353 172.503 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -74.86 -39.56 61.49 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.608 1.163 . . . . 0.0 112.479 176.412 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -71.89 -31.05 66.03 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 124.142 0.977 . . . . 0.0 112.391 178.157 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 86.2 mtp -62.18 -40.72 96.98 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 125.114 1.365 . . . . 0.0 111.875 170.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -66.31 -31.08 71.65 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 174.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -67.85 -42.77 80.86 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 119.42 1.009 . . . . 0.0 111.659 170.439 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -59.96 -44.7 94.27 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 121.072 -1.018 . . . . 0.0 112.646 171.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 19.3 t30 -57.45 -44.58 84.87 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 121.57 -0.706 . . . . 0.0 111.656 172.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 63.7 m -65.66 -35.76 81.71 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.333 1.053 . . . . 0.0 112.528 178.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 16.5 ttm -58.89 -60.27 4.13 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.982 0.913 . . . . 0.0 111.475 173.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -63.63 -38.58 91.65 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 122.612 0.365 . . . . 0.0 111.781 -177.684 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 72.9 m -64.8 -47.85 76.58 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.377 0.671 . . . . 0.0 112.133 178.036 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -64.64 -30.98 72.01 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 120.155 1.343 . . . . 0.0 112.406 178.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 85.5 m -62.35 -45.98 90.75 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.356 0.662 . . . . 0.0 112.229 170.072 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -66.12 -34.45 78.08 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 177.126 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 77.4 mt -69.78 -57.6 7.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 C-N-CA 123.407 0.683 . . . . 0.0 110.782 177.583 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 48.7 t80 -69.45 -26.71 64.73 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -171.069 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 46.0 m-80 -114.76 161.04 18.7 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.091 0.956 . . . . 0.0 112.45 -171.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -66.26 146.01 99.01 Favored Pre-proline 0 N--CA 1.473 0.695 0 C-N-CA 124.228 1.011 . . . . 0.0 110.341 176.398 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -65.89 -7.84 17.99 Favored 'Trans proline' 0 CA--C 1.542 0.924 0 C-N-CA 123.659 2.906 . . . . 0.0 114.595 -175.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 56.8 p -115.26 0.96 13.67 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 126.703 2.001 . . . . 0.0 113.175 179.133 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -65.83 148.0 52.47 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 121.476 -0.765 . . . . 0.0 110.844 172.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -51.55 -49.55 61.78 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 123.417 0.687 . . . . 0.0 112.203 178.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 9.7 tp -57.28 -30.14 34.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 -179.221 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 42.7 t -73.15 -47.08 48.76 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 O-C-N 121.515 -0.74 . . . . 0.0 110.588 173.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 80.3 mt -61.29 -37.39 83.01 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 119.11 0.868 . . . . 0.0 111.649 176.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 8.8 mtt -59.12 -51.14 71.32 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.993 1.317 . . . . 0.0 111.915 169.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.09 -39.67 86.93 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 176.196 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -62.49 -45.32 93.54 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 119.502 1.046 . . . . 0.0 111.872 174.094 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -66.57 -29.61 69.72 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.304 1.042 . . . . 0.0 113.724 179.637 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 80.4 mt -78.05 -47.61 17.99 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.976 0.91 . . . . 0.0 111.65 169.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -62.1 -38.65 89.69 Favored 'General case' 0 N--CA 1.468 0.45 0 O-C-N 121.05 -1.032 . . . . 0.0 113.128 -174.486 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 19.7 pttp -58.26 -42.88 87.44 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 118.783 0.72 . . . . 0.0 111.874 176.179 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 77.0 mt -67.74 -46.49 82.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 C-N-CA 124.3 1.04 . . . . 0.0 110.743 176.073 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 44.8 t80 -50.94 -50.63 57.44 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.142 0.883 . . . . 0.0 111.237 173.753 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.1 mt -62.98 -41.21 99.5 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 179.151 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -61.43 -37.96 85.41 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 119.409 1.004 . . . . 0.0 112.955 173.154 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -72.47 -49.5 32.79 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.175 0.99 . . . . 0.0 112.616 179.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 7.1 m -69.21 -25.79 30.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 CA-C-N 119.955 1.252 . . . . 0.0 112.126 177.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -59.37 -31.02 68.83 Favored 'General case' 0 CA--C 1.541 0.596 0 O-C-N 121.607 -0.683 . . . . 0.0 112.208 171.377 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 29.1 mm100 -97.0 3.84 51.79 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.239 1.415 . . . . 0.0 113.106 177.729 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 9.6 ttm -54.26 140.89 53.32 Favored Pre-proline 0 CA--C 1.546 0.826 0 C-N-CA 124.642 1.177 . . . . 0.0 112.164 174.392 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -68.82 112.62 2.95 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 122.901 2.401 . . . . 0.0 109.008 168.184 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -68.81 -20.13 64.31 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 -173.654 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -82.41 157.7 23.59 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.547 1.539 . . . . 0.0 112.269 176.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -117.65 128.22 54.71 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.608 1.563 . . . . 0.0 110.865 -174.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 63.4 t -141.88 135.07 29.1 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 126.472 1.909 . . . . 0.0 109.901 -171.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -70.55 131.29 43.76 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.534 1.534 . . . . 0.0 112.404 175.602 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 93.9 mt . . . . . 0 N--CA 1.474 0.767 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 177.89 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.164 0 N-CA-C 112.165 -0.374 . . . . 0.0 112.165 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 7.2 ptp180 -160.1 165.46 31.7 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 126.072 1.749 . . . . 0.0 110.44 178.881 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.0 ttpt -75.4 132.52 40.94 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 166.352 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 66.6 p -124.85 170.14 11.35 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 126.115 1.766 . . . . 0.0 108.829 177.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 23.8 p-10 -52.03 -32.09 32.71 Favored 'General case' 0 N--CA 1.475 0.819 0 O-C-N 121.161 -0.962 . . . . 0.0 113.349 173.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.9 mm-40 -70.7 -53.44 15.63 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 123.846 0.859 . . . . 0.0 111.745 177.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.8 mt -64.25 -32.75 74.46 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.067 0.848 . . . . 0.0 112.551 176.657 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 22.8 tt0 -59.65 -50.22 74.71 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.144 0.977 . . . . 0.0 111.146 170.126 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 62.5 t80 -57.83 -40.9 81.13 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.625 0.77 . . . . 0.0 112.376 176.63 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 82.0 mmm -56.64 -52.44 64.86 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 122.765 0.426 . . . . 0.0 112.007 174.106 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -78.24 -18.1 55.82 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 -178.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 42.3 m-20 -99.47 -21.56 15.9 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.594 0.961 . . . . 0.0 113.594 -173.241 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 29.3 t -135.89 -48.45 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 CA-C-O 118.511 -0.757 . . . . 0.0 111.915 -177.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 18.4 t -68.23 -63.67 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 CA-C-N 119.151 0.887 . . . . 0.0 110.669 -173.811 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 81.7 t -57.83 -47.13 86.83 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 C-N-CA 124.454 1.101 . . . . 0.0 110.13 173.348 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -57.41 -44.09 84.32 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 118.682 0.674 . . . . 0.0 112.703 -176.341 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 48.1 m -69.87 -46.72 64.9 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 121.977 -0.452 . . . . 0.0 111.654 176.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 66.7 mt -61.63 -33.46 73.97 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.236 0.614 . . . . 0.0 112.157 178.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 24.0 t-105 -71.29 -29.36 64.96 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.88 1.672 . . . . 0.0 113.413 176.013 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 54.2 mtmt -83.83 -8.34 59.24 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.066 0.947 . . . . 0.0 113.503 177.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 43.2 t-80 -62.69 154.67 28.64 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.719 1.208 . . . . 0.0 113.152 -178.249 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -60.29 -17.14 40.45 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.307 1.443 . . . . 0.0 114.176 174.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -124.14 15.24 9.13 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.735 1.614 . . . . 0.0 113.984 -174.562 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.82 -30.2 67.66 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.802 1.241 . . . . 0.0 114.14 178.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . 0.41 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 38.6 p-90 -56.26 -37.85 61.95 Favored Pre-proline 0 CA--C 1.548 0.9 0 N-CA-C 117.466 2.395 . . . . 0.0 117.466 -170.471 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.41 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 72.1 Cg_endo -72.05 -5.71 17.65 Favored 'Trans proline' 0 CA--C 1.544 0.976 0 CA-C-N 123.164 2.166 . . . . 0.0 114.179 173.434 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -108.91 -4.83 16.46 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.352 1.461 . . . . 0.0 113.057 178.323 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 21.3 m-30 -64.29 -16.17 61.63 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 113.927 1.084 . . . . 0.0 113.927 176.107 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -143.37 158.61 57.42 Favored Pre-proline 0 CA--C 1.546 0.826 0 C-N-CA 126.437 1.895 . . . . 0.0 110.726 -177.123 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -64.81 157.67 55.05 Favored 'Trans proline' 0 CA--C 1.536 0.6 0 C-N-CA 123.052 2.501 . . . . 0.0 112.75 175.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 36.0 t -75.71 87.3 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 C-N-CA 124.679 1.192 . . . . 0.0 109.434 174.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 58.4 m-20 -69.87 85.81 0.5 Allowed 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.837 1.255 . . . . 0.0 111.78 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.3 -28.24 27.19 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.913 1.285 . . . . 0.0 114.128 178.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 82.7 mt -66.44 -49.89 71.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 125.177 1.391 . . . . 0.0 111.152 173.265 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -66.69 -38.63 87.18 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.93 1.292 . . . . 0.0 112.543 178.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 84.7 mt -85.24 -5.29 59.33 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 126.439 1.896 . . . . 0.0 113.205 -178.118 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 51.37 54.88 10.32 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.907 1.683 . . . . 0.0 113.174 -176.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 45.0 mt -114.41 81.5 6.79 Favored Pre-proline 0 N--CA 1.474 0.742 0 C-N-CA 125.803 1.641 . . . . 0.0 110.676 -179.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -66.57 -14.14 42.79 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 123.423 2.748 . . . . 0.0 113.583 -175.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 34.4 m-20 -106.95 5.07 27.89 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.615 1.566 . . . . 0.0 113.269 177.005 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -53.54 -51.65 62.22 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 120.321 1.419 . . . . 0.0 112.788 -175.244 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -76.8 -16.05 59.56 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.857 1.263 . . . . 0.0 113.839 -179.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 9.4 mptt -68.37 -42.22 79.48 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.875 0.87 . . . . 0.0 110.363 174.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.9 mp -81.1 -55.34 8.37 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 C-N-CA 124.534 1.133 . . . . 0.0 110.431 173.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 50.5 mm -85.44 100.69 8.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 CA-C-O 122.322 1.058 . . . . 0.0 111.295 -176.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -66.93 -29.38 69.23 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 126.121 1.769 . . . . 0.0 114.091 179.328 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -145.51 78.34 12.06 Favored Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 125.689 1.596 . . . . 0.0 110.909 -171.349 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -68.66 149.67 73.85 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 124.157 3.238 . . . . 0.0 112.087 -178.441 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 8.7 tpt -158.22 148.83 20.46 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.771 1.228 . . . . 0.0 111.1 -171.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -152.75 152.08 31.24 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.069 1.348 . . . . 0.0 112.278 178.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 6.6 ttp -60.24 -33.73 72.69 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.632 1.173 . . . . 0.0 112.477 -176.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -61.52 -23.52 62.82 Favored Glycine 0 CA--C 1.536 1.397 0 C-N-CA 125.734 1.635 . . . . 0.0 114.769 172.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 93.3 m -93.98 -38.95 10.91 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 118.363 1.081 . . . . 0.0 111.387 172.079 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 89.9 mt -53.07 -50.03 47.27 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 CA-C-N 119.69 1.132 . . . . 0.0 111.108 176.462 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -57.89 -35.78 71.49 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 176.414 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 22.5 ttmm -70.86 -38.51 73.13 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.229 1.012 . . . . 0.0 113.208 -177.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -72.78 -30.48 64.14 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-N 119.122 0.874 . . . . 0.0 113.189 171.062 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 48.8 mt -63.7 -39.09 93.45 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-N 119.744 1.156 . . . . 0.0 113.243 168.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -77.52 14.42 1.0 Allowed 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.88 1.272 . . . . 0.0 113.732 176.685 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 32.6 m-80 -137.08 167.51 21.39 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 127.006 2.122 . . . . 0.0 111.317 177.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -75.94 37.0 0.15 Allowed 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 125.514 1.526 . . . . 0.0 111.952 173.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 30.0 t80 -70.82 -31.03 67.64 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 120.438 -1.413 . . . . 0.0 113.324 -169.254 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -144.12 -178.31 5.88 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 127.127 2.171 . . . . 0.0 110.389 175.196 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 6.6 t-105 -113.99 -25.17 8.68 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.565 1.146 . . . . 0.0 111.485 177.002 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.1 m -130.27 136.45 49.19 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.165 1.386 . . . . 0.0 111.775 -168.493 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -66.24 -16.48 64.04 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 115.669 1.729 . . . . 0.0 115.669 -173.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 16.5 m -53.76 -32.31 51.81 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.381 0.991 . . . . 0.0 112.909 175.089 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -69.87 -44.13 70.44 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.822 0.849 . . . . 0.0 112.442 175.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 43.4 t -61.72 -37.55 84.62 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.165 0.986 . . . . 0.0 112.466 171.277 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 83.2 mtp -65.96 -40.04 90.95 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.037 0.935 . . . . 0.0 112.155 176.395 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -63.44 -36.31 83.32 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 112.716 0.635 . . . . 0.0 112.716 170.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 91.8 m-20 -65.47 -43.67 89.57 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 119.445 1.02 . . . . 0.0 112.12 173.29 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -57.72 -45.78 85.29 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 121.374 -0.829 . . . . 0.0 112.445 171.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 13.6 t30 -55.92 -52.43 64.15 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.385 0.674 . . . . 0.0 111.779 174.293 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 53.5 m -57.86 -43.43 85.96 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.831 0.852 . . . . 0.0 112.476 178.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 53.2 ttp -56.72 -53.42 57.92 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 118.996 0.817 . . . . 0.0 112.9 177.407 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -69.25 -35.54 76.22 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 179.689 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.7 m -58.75 -49.96 75.68 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.372 1.069 . . . . 0.0 111.983 172.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -57.86 -38.72 76.22 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.316 0.646 . . . . 0.0 112.108 -178.335 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 24.0 m -56.1 -42.22 76.46 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.027 0.931 . . . . 0.0 112.707 172.612 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 7.0 m-85 -71.18 -29.34 65.06 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 176.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 79.3 mt -75.26 -57.75 5.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 123.617 0.767 . . . . 0.0 110.654 179.546 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -71.44 -27.06 63.02 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 114.362 1.245 . . . . 0.0 114.362 -171.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 36.6 m-80 -113.1 161.68 16.82 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.591 1.156 . . . . 0.0 111.729 -173.1 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -71.82 151.45 93.19 Favored Pre-proline 0 N--CA 1.471 0.621 0 C-N-CA 123.998 0.919 . . . . 0.0 109.79 176.557 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -65.38 -1.03 4.07 Favored 'Trans proline' 0 CA--C 1.547 1.134 0 C-N-CA 123.763 2.976 . . . . 0.0 114.691 -179.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 53.8 p -118.8 -2.28 10.92 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 127.176 2.191 . . . . 0.0 113.167 -179.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 58.4 m-20 -68.56 145.87 53.59 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 118.929 0.786 . . . . 0.0 110.804 170.598 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -56.74 -45.1 82.2 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.413 -0.805 . . . . 0.0 112.589 -176.318 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.6 tp -55.88 -29.37 25.96 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 124.946 1.298 . . . . 0.0 114.214 178.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 37.3 t -71.07 -48.3 56.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 O-C-N 121.364 -0.835 . . . . 0.0 110.416 172.779 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 66.4 mt -61.41 -36.59 80.72 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 118.829 0.74 . . . . 0.0 111.697 177.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 10.8 mtt -58.93 -51.73 68.8 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 124.854 1.261 . . . . 0.0 112.048 170.153 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.82 -39.35 91.46 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.358 0.663 . . . . 0.0 112.681 176.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 90.1 mt-30 -61.51 -47.06 87.3 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 119.107 0.867 . . . . 0.0 111.817 174.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -63.16 -45.2 92.97 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 123.802 0.841 . . . . 0.0 112.512 178.112 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 81.7 mt -64.96 -45.02 87.43 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.742 0.817 . . . . 0.0 112.084 175.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -63.71 -37.46 87.43 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 121.093 -1.004 . . . . 0.0 112.751 -177.071 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -58.53 -40.03 81.81 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 121.399 -0.813 . . . . 0.0 112.272 172.377 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 78.5 mt -74.3 -40.92 50.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 C-N-CA 123.243 0.617 . . . . 0.0 111.349 177.086 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -51.16 -51.36 54.46 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.456 -0.778 . . . . 0.0 110.364 171.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 96.1 mt -62.92 -41.31 99.43 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 112.904 0.705 . . . . 0.0 112.904 177.581 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -67.16 -29.98 69.82 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 120.199 1.363 . . . . 0.0 112.845 -179.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 71.5 mmtt -74.86 -52.43 11.35 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.953 0.901 . . . . 0.0 112.285 174.34 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.8 m -65.96 -24.81 34.66 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 120.316 1.416 . . . . 0.0 112.151 179.126 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -61.84 -28.54 69.56 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 121.475 -0.765 . . . . 0.0 112.933 171.207 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -96.51 -3.34 43.39 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.462 1.505 . . . . 0.0 112.599 177.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 5.9 ttm -57.24 142.01 76.21 Favored Pre-proline 0 CA--C 1.548 0.898 0 C-N-CA 124.298 1.039 . . . . 0.0 110.727 169.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_endo -63.16 145.96 93.89 Favored 'Trans proline' 0 CA--C 1.537 0.675 0 C-N-CA 122.563 2.175 . . . . 0.0 110.252 169.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -77.75 -17.66 57.32 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 120.827 -1.171 . . . . 0.0 113.344 177.468 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -94.45 154.11 17.6 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.32 1.448 . . . . 0.0 112.605 -177.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -128.91 133.28 47.83 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.247 1.419 . . . . 0.0 111.335 -172.168 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 9.1 p -147.87 145.13 18.98 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 124.184 0.994 . . . . 0.0 112.914 -174.289 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -64.15 132.93 51.88 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.304 1.841 . . . . 0.0 111.684 171.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 92.8 mt . . . . . 0 CA--C 1.545 0.786 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 178.722 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.974 0 CA-C-O 121.081 0.267 . . . . 0.0 113.314 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.5 ptt180 -157.53 164.84 36.94 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.39 1.876 . . . . 0.0 110.601 174.019 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 8.3 mmmt -71.48 121.02 17.9 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.878 1.271 . . . . 0.0 111.419 170.259 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 34.3 p -135.02 160.01 39.67 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 125.027 1.331 . . . . 0.0 112.376 -179.254 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 36.1 t30 -53.69 -33.21 54.69 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.808 1.643 . . . . 0.0 114.53 174.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 70.1 mm-40 -62.93 -56.94 12.81 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.041 0.936 . . . . 0.0 111.148 170.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 89.8 mt -65.42 -31.37 72.43 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 179.306 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -58.44 -55.25 37.4 Favored 'General case' 0 C--O 1.223 -0.298 0 C-N-CA 123.332 0.653 . . . . 0.0 110.082 169.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -57.29 -40.61 78.17 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 118.819 0.736 . . . . 0.0 112.305 -178.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 95.3 mmm -56.8 -52.36 65.35 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 121.856 -0.527 . . . . 0.0 112.373 172.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -83.64 -10.31 58.3 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 114.904 1.446 . . . . 0.0 114.904 -174.323 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -116.75 -18.6 10.21 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.477 1.511 . . . . 0.0 112.744 -170.069 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 10.9 t -133.03 -53.08 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 C-N-CA 123.574 0.75 . . . . 0.0 111.628 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.7 t -66.0 -63.99 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 CA-C-N 118.856 0.753 . . . . 0.0 110.599 -175.41 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 82.8 t -57.15 -47.59 83.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 124.022 0.929 . . . . 0.0 109.757 172.021 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.0 tptp -57.34 -43.12 83.16 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 113.442 0.904 . . . . 0.0 113.442 -171.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 91.2 m -77.67 -42.95 32.83 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 118.915 0.78 . . . . 0.0 112.556 174.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 79.7 mt -58.31 -30.85 66.99 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.397 0.998 . . . . 0.0 112.258 175.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 40.9 t-105 -75.77 -35.51 60.1 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 126.521 1.929 . . . . 0.0 114.129 179.171 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 21.6 pttp -88.93 -3.64 58.68 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 114.244 1.202 . . . . 0.0 114.244 178.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 60.1 t-80 -54.31 152.67 6.1 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.99 2.116 . . . . 0.0 113.318 173.088 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 22.8 tp60 -56.8 -21.39 28.44 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 126.158 1.783 . . . . 0.0 114.738 177.308 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -123.19 15.2 9.81 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.43 1.492 . . . . 0.0 114.077 -173.507 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.06 -27.39 62.65 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 114.444 1.276 . . . . 0.0 114.444 179.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 38.0 p-90 -55.64 -37.14 53.72 Favored Pre-proline 0 CA--C 1.55 0.958 0 N-CA-C 117.725 2.491 . . . . 0.0 117.725 -170.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -73.28 -5.49 17.24 Favored 'Trans proline' 0 CA--C 1.543 0.949 0 CA-C-N 123.249 2.196 . . . . 0.0 114.022 174.219 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 62.0 m-85 -107.47 -5.53 17.59 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.479 1.512 . . . . 0.0 112.918 179.086 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -64.29 -14.79 58.04 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.673 1.36 . . . . 0.0 114.673 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -138.87 153.98 72.4 Favored Pre-proline 0 CA--C 1.543 0.688 0 C-N-CA 125.597 1.559 . . . . 0.0 110.146 -179.377 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -65.41 149.11 88.4 Favored 'Trans proline' 0 CA--C 1.537 0.632 0 C-N-CA 122.595 2.197 . . . . 0.0 111.898 174.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 74.0 t -58.58 138.04 20.14 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 123.505 0.722 . . . . 0.0 110.991 171.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -128.7 106.62 9.06 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 125.547 1.539 . . . . 0.0 108.841 171.593 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.08 -28.0 64.16 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.276 1.03 . . . . 0.0 113.576 -178.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 79.7 mt -66.94 -50.91 60.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 124.751 1.22 . . . . 0.0 110.913 172.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 56.6 mttm -66.09 -39.33 89.9 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.771 1.228 . . . . 0.0 112.854 -177.587 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 55.3 mt -91.29 1.0 57.43 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.851 1.26 . . . . 0.0 113.745 179.624 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 65.0 t30 51.42 53.54 12.65 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 126.237 1.815 . . . . 0.0 113.768 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 36.0 mt -107.47 98.26 22.94 Favored Pre-proline 0 CA--C 1.544 0.718 0 C-N-CA 125.802 1.641 . . . . 0.0 109.769 -177.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -69.11 -10.55 29.4 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 122.984 2.456 . . . . 0.0 114.744 -171.318 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -139.95 17.54 2.47 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.261 1.424 . . . . 0.0 113.384 -173.337 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -47.99 -52.01 21.57 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-N 120.025 1.284 . . . . 0.0 113.729 -172.248 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -75.37 -9.62 58.72 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.166 1.387 . . . . 0.0 114.38 -178.7 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 29.4 mmmt -78.7 -44.85 22.63 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 121.229 -0.92 . . . . 0.0 110.59 174.337 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.3 mp -74.14 -45.35 48.13 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 124.111 0.964 . . . . 0.0 110.426 173.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 35.3 mm -101.24 109.97 26.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 CA-C-O 122.252 1.025 . . . . 0.0 111.896 -175.6 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.5 mptp? -79.49 -29.77 41.74 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.754 1.622 . . . . 0.0 113.0 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -138.06 85.1 19.65 Favored Pre-proline 0 CA--C 1.544 0.737 0 C-N-CA 125.207 1.403 . . . . 0.0 110.463 -178.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -73.15 144.89 38.28 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 123.529 2.82 . . . . 0.0 111.058 176.369 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.8 tpt -155.0 142.18 19.38 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.969 1.307 . . . . 0.0 110.508 -178.575 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 20.4 m-20 -146.36 150.44 35.69 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.639 1.576 . . . . 0.0 111.422 -175.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.9 ttp -61.13 -35.73 77.86 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.331 1.052 . . . . 0.0 112.743 -173.169 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -59.93 -21.86 56.5 Favored Glycine 0 CA--C 1.537 1.428 0 C-N-CA 125.625 1.583 . . . . 0.0 114.433 171.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 19.2 m -98.27 -34.08 10.84 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.208 1.403 . . . . 0.0 111.81 174.134 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 90.0 mt -55.36 -50.38 65.75 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 CA-C-N 119.538 1.063 . . . . 0.0 110.655 172.467 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -60.16 -37.04 78.94 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 113.218 0.822 . . . . 0.0 113.218 176.943 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.409 ' HE2' ' HA ' ' A' ' 88' ' ' LYS . 0.5 OUTLIER -62.09 -36.32 81.35 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.319 1.048 . . . . 0.0 113.008 -177.761 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 6.2 ptp180 -80.53 -32.35 36.8 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 173.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 65.0 mt -62.01 -32.1 72.55 Favored 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 114.447 1.277 . . . . 0.0 114.447 169.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -64.38 -12.23 40.64 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 114.745 1.387 . . . . 0.0 114.745 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 6.9 p30 -134.89 176.27 8.81 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.781 1.632 . . . . 0.0 112.851 177.033 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -78.03 44.94 0.5 Allowed 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 125.286 1.435 . . . . 0.0 113.126 -177.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 50.9 t80 -65.18 -30.69 71.62 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 121.278 -0.889 . . . . 0.0 112.977 -174.7 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -141.01 172.16 13.06 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 127.249 2.22 . . . . 0.0 111.479 176.796 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 15.8 t-105 -95.45 -22.25 17.81 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.42 1.088 . . . . 0.0 113.23 177.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 24.2 t -145.07 153.22 41.21 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.581 1.152 . . . . 0.0 113.448 -169.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -65.18 -21.24 66.74 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 116.285 1.957 . . . . 0.0 116.285 -175.442 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 15.2 m -58.84 -32.7 69.65 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 119.485 1.039 . . . . 0.0 113.24 -175.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -63.85 -44.07 94.24 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.408 -0.808 . . . . 0.0 112.17 173.601 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 50.5 t -64.21 -38.07 89.74 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.036 0.935 . . . . 0.0 112.117 175.143 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 78.3 mtp -62.43 -41.12 98.47 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.272 -0.892 . . . . 0.0 112.393 173.581 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -61.39 -39.65 91.46 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 112.27 0.471 . . . . 0.0 112.27 170.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -65.81 -39.85 91.3 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 118.963 0.801 . . . . 0.0 112.713 177.343 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 -60.05 -45.37 93.08 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 121.51 -0.744 . . . . 0.0 112.369 170.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 18.1 t30 -57.72 -46.81 83.9 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 121.875 -0.516 . . . . 0.0 112.023 174.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 93.1 m -65.36 -34.45 78.36 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.888 0.875 . . . . 0.0 112.764 177.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 50.9 ttp -61.21 -55.21 34.77 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 119.608 1.095 . . . . 0.0 111.844 174.495 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 24.0 m-85 -65.18 -38.36 90.24 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 122.004 -0.435 . . . . 0.0 111.977 179.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 88.6 m -64.69 -47.78 77.13 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 123.601 0.761 . . . . 0.0 112.397 179.009 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.1 p30 -64.67 -31.28 72.43 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 119.774 1.17 . . . . 0.0 112.568 -179.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 56.1 m -60.95 -44.24 97.57 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.542 0.737 . . . . 0.0 112.547 169.522 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -67.84 -31.32 71.07 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 113.736 1.013 . . . . 0.0 113.736 177.291 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 80.9 mt -72.17 -56.65 9.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 123.343 0.657 . . . . 0.0 110.617 177.042 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 41.9 t80 -67.31 -30.54 70.41 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 114.152 1.168 . . . . 0.0 114.152 -173.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -113.47 156.35 23.69 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.03 0.932 . . . . 0.0 112.361 -171.577 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 3.0 mppt? -67.43 148.68 98.64 Favored Pre-proline 0 N--CA 1.471 0.576 0 C-N-CA 124.684 1.194 . . . . 0.0 110.666 176.213 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -65.46 -7.23 15.42 Favored 'Trans proline' 0 CA--C 1.544 0.976 0 C-N-CA 123.749 2.966 . . . . 0.0 114.674 -176.243 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 43.5 p -108.55 -4.74 16.94 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 127.123 2.169 . . . . 0.0 113.268 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -67.79 146.55 53.61 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 118.883 0.765 . . . . 0.0 110.821 174.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -53.27 -47.76 68.85 Favored 'General case' 0 N--CA 1.469 0.519 0 O-C-N 121.59 -0.694 . . . . 0.0 112.258 179.097 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.2 tp -57.39 -30.03 34.79 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 C-N-CA 124.298 1.039 . . . . 0.0 113.786 -178.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 42.5 t -71.99 -48.52 49.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 O-C-N 121.535 -0.728 . . . . 0.0 110.442 174.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 79.8 mt -61.13 -36.96 81.16 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 118.978 0.808 . . . . 0.0 111.857 177.508 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 13.5 mtt -58.55 -52.73 64.43 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.919 1.288 . . . . 0.0 111.965 169.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.61 -38.75 88.76 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.464 0.706 . . . . 0.0 112.704 177.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -59.48 -51.11 71.27 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 119.229 0.922 . . . . 0.0 111.687 173.26 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.57 -43.28 99.19 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.752 0.821 . . . . 0.0 112.844 179.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 80.0 mt -62.95 -43.75 97.94 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.718 0.807 . . . . 0.0 111.748 173.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -60.9 -39.13 88.14 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 121.018 -1.051 . . . . 0.0 112.699 -179.111 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 7.2 mmpt? -61.69 -37.99 86.15 Favored 'General case' 0 N--CA 1.476 0.871 0 O-C-N 121.191 -0.943 . . . . 0.0 111.304 178.027 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 77.7 mt -74.41 -39.95 48.79 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 C-N-CA 123.685 0.794 . . . . 0.0 111.312 176.611 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -51.53 -51.36 55.95 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 118.943 0.792 . . . . 0.0 110.411 172.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 93.1 mt -63.67 -40.79 97.71 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 118.532 -0.747 . . . . 0.0 112.819 177.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -67.18 -32.69 73.95 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 120.327 1.421 . . . . 0.0 112.426 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 65.3 mmtt -71.23 -53.4 14.49 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.952 0.901 . . . . 0.0 111.753 175.49 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.4 m -65.48 -25.15 36.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 CA-C-N 120.326 1.421 . . . . 0.0 112.222 179.662 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -64.42 -34.9 79.26 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 171.588 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -84.3 -13.28 52.9 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.475 1.11 . . . . 0.0 113.087 173.532 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 48.0 ttp -61.62 141.97 94.6 Favored Pre-proline 0 CA--C 1.543 0.704 0 CA-C-N 119.262 0.937 . . . . 0.0 110.564 172.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -60.53 152.2 69.87 Favored 'Trans proline' 0 CA--C 1.538 0.705 0 C-N-CA 122.716 2.277 . . . . 0.0 111.205 172.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -88.8 -21.17 23.9 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 121.777 -0.577 . . . . 0.0 112.388 172.23 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -84.75 167.16 16.37 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.835 1.254 . . . . 0.0 112.396 172.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -137.13 146.76 45.42 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.76 1.224 . . . . 0.0 111.175 -176.848 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 8.2 p -144.16 145.18 21.99 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 C-N-CA 124.899 1.279 . . . . 0.0 110.437 176.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -69.38 137.92 53.23 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.429 0.692 . . . . 0.0 111.246 173.12 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 83.4 mt . . . . . 0 CA--C 1.544 0.734 0 N-CA-C 113.886 1.069 . . . . 0.0 113.886 -175.666 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.998 0 CA-C-O 121.005 0.225 . . . . 0.0 113.251 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 8.0 ptm180 -164.63 165.44 21.01 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.761 2.025 . . . . 0.0 110.87 175.232 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 30.7 tttp -61.83 132.23 52.4 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.143 1.377 . . . . 0.0 110.938 173.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 48.9 p -139.38 165.04 28.26 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.967 1.707 . . . . 0.0 110.141 178.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 24.8 t30 -52.6 -32.49 41.69 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 175.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 63.4 mm-40 -60.68 -59.92 4.62 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.535 1.134 . . . . 0.0 111.616 169.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 94.5 mt -67.12 -32.21 73.2 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.215 1.006 . . . . 0.0 112.911 -177.297 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 -58.8 -51.34 70.42 Favored 'General case' 0 C--O 1.225 -0.225 0 C-N-CA 124.362 1.065 . . . . 0.0 110.223 170.031 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 49.8 t80 -58.07 -39.34 78.27 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 118.909 0.777 . . . . 0.0 112.347 178.366 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 89.0 mmm -57.08 -55.04 39.89 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 121.662 -0.649 . . . . 0.0 112.266 172.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -82.32 -4.44 57.23 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 115.108 1.521 . . . . 0.0 115.108 -175.2 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -117.21 -19.64 9.56 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.247 1.419 . . . . 0.0 112.778 -174.041 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.6 t -133.47 -52.72 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 CA-C-O 118.757 -0.64 . . . . 0.0 112.266 179.202 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.8 t -69.08 -67.71 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 CA-C-N 118.794 0.724 . . . . 0.0 110.848 -172.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 99.3 t -57.07 -46.11 84.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.928 1.291 . . . . 0.0 109.743 171.587 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 40.3 tptt -58.77 -22.22 57.56 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 114.301 1.222 . . . . 0.0 114.301 -176.233 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 34.2 m -99.43 -41.09 7.56 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.196 0.998 . . . . 0.0 113.151 172.717 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 62.3 mt -60.05 -28.95 68.2 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.257 0.935 . . . . 0.0 112.682 173.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 36.0 t-105 -79.04 -33.85 44.38 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 127.123 2.169 . . . . 0.0 113.843 178.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 61.2 pttt -86.56 -5.18 59.21 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 175.682 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 57.4 t-80 -54.28 152.53 6.19 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.507 1.923 . . . . 0.0 113.473 174.526 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 22.7 tp60 -56.83 -21.13 26.66 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 126.029 1.732 . . . . 0.0 114.676 176.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -124.35 19.66 8.91 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.409 1.484 . . . . 0.0 113.916 -175.068 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -74.0 -24.69 59.62 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 114.106 1.151 . . . . 0.0 114.106 175.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . 0.41 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 49.4 p-90 -57.17 -36.4 46.1 Favored Pre-proline 0 CA--C 1.548 0.876 0 N-CA-C 117.206 2.299 . . . . 0.0 117.206 -173.508 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.41 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 85.0 Cg_endo -74.82 0.02 9.33 Favored 'Trans proline' 0 CA--C 1.545 1.039 0 CA-C-N 123.013 2.112 . . . . 0.0 113.934 171.514 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -117.98 6.19 12.15 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.96 1.704 . . . . 0.0 113.321 -178.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 23.3 m-30 -72.31 -14.22 61.69 Favored 'General case' 0 CA--C 1.545 0.758 0 O-C-N 120.28 -1.512 . . . . 0.0 114.059 176.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 89.1 mt-30 -151.57 145.99 18.41 Favored Pre-proline 0 CA--C 1.544 0.724 0 C-N-CA 125.233 1.413 . . . . 0.0 110.536 -177.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -65.36 151.65 84.49 Favored 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 123.383 2.722 . . . . 0.0 112.765 -178.218 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 41.6 t -64.17 135.79 27.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 124.737 1.215 . . . . 0.0 111.071 -178.703 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 52.8 m-20 -112.71 92.41 4.01 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.925 1.29 . . . . 0.0 110.163 175.33 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.57 -27.42 38.79 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.286 1.034 . . . . 0.0 113.682 175.651 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 81.8 mt -65.71 -49.6 76.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 C-N-CA 125.392 1.477 . . . . 0.0 111.104 173.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -65.99 -38.92 89.73 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.48 1.112 . . . . 0.0 112.589 179.21 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 90.3 mt -87.35 -3.6 59.03 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.893 1.677 . . . . 0.0 113.518 -177.268 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 51.14 56.55 7.81 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 125.584 1.554 . . . . 0.0 113.01 -176.424 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 58.0 mt -113.87 78.36 4.05 Favored Pre-proline 0 CA--C 1.543 0.7 0 C-N-CA 126.157 1.783 . . . . 0.0 110.651 -179.811 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -66.28 -17.2 53.87 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 123.323 2.682 . . . . 0.0 113.101 -177.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 -100.35 7.13 44.52 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.884 1.674 . . . . 0.0 113.184 175.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 85.8 t80 -52.28 -57.62 9.16 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 120.015 1.28 . . . . 0.0 112.117 -177.474 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -74.81 -11.65 60.2 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.888 1.275 . . . . 0.0 114.33 179.606 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 10.1 mptt -72.7 -32.54 65.83 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 121.263 -0.898 . . . . 0.0 111.296 176.349 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.2 mp -99.07 -48.71 11.86 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 125.439 1.496 . . . . 0.0 111.088 175.003 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 28.0 mm -67.18 110.95 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 C-N-CA 123.66 0.784 . . . . 0.0 110.082 178.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -68.25 -44.87 74.65 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.972 0.909 . . . . 0.0 112.113 -178.441 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 71.5 m-80 -150.22 117.83 3.56 Favored Pre-proline 0 CA--C 1.546 0.789 0 C-N-CA 126.5 1.92 . . . . 0.0 109.075 173.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -74.24 146.95 36.76 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 123.116 2.544 . . . . 0.0 111.478 177.346 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.0 tpt -156.25 146.68 21.63 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.984 1.314 . . . . 0.0 110.52 176.678 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -152.11 153.22 33.48 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.258 1.423 . . . . 0.0 112.099 -171.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 2.7 ttp -64.74 -38.3 90.53 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.197 0.599 . . . . 0.0 112.456 -175.426 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -59.26 -34.09 78.49 Favored Glycine 0 CA--C 1.53 1.02 0 C-N-CA 124.63 1.11 . . . . 0.0 113.056 173.552 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 24.2 m -76.23 -47.17 24.91 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 117.868 0.834 . . . . 0.0 111.278 172.056 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 86.7 mt -52.66 -53.14 21.98 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.197 0 C-N-CA 124.568 1.147 . . . . 0.0 111.247 178.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.37 -30.42 71.24 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -178.964 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.02 -40.0 94.21 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 117.712 -1.137 . . . . 0.0 113.413 171.012 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . 0.275 6.4 ptp180 -72.68 -30.03 63.9 Favored 'General case' 0 N--CA 1.484 1.24 0 CA-C-N 120.544 1.52 . . . . 0.0 114.135 172.712 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 86.9 mt -66.87 -36.14 81.63 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 119.763 1.165 . . . . 0.0 112.949 167.679 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 88.5 mt-10 -78.02 9.33 3.74 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.685 1.594 . . . . 0.0 113.704 178.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 38.8 m-80 -138.42 166.79 23.35 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 127.023 2.129 . . . . 0.0 111.788 179.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 13.9 p-10 -79.96 108.41 13.51 Favored 'General case' 0 CA--C 1.544 0.719 0 O-C-N 121.4 -0.813 . . . . 0.0 109.773 168.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 49.4 t80 -140.36 -46.26 0.42 Allowed 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -178.277 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -133.15 177.0 8.01 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.836 2.054 . . . . 0.0 111.625 178.427 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.3 t-105 -112.99 -21.86 10.89 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.898 1.279 . . . . 0.0 112.787 -177.598 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 28.2 t -138.07 142.95 40.27 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.046 -1.034 . . . . 0.0 112.337 -172.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -68.89 -13.55 62.49 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 115.316 1.599 . . . . 0.0 115.316 -173.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 23.2 m -55.45 -29.97 59.66 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 119.412 1.006 . . . . 0.0 112.775 173.873 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 40.0 mm-40 -72.5 -41.37 66.01 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.202 -0.936 . . . . 0.0 112.258 174.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 42.2 t -62.23 -38.24 88.45 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.025 0.93 . . . . 0.0 111.998 172.209 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 82.9 mtp -65.6 -40.67 92.92 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 124.124 0.969 . . . . 0.0 112.171 174.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 62.6 mt-30 -59.96 -44.5 94.39 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 122.895 0.478 . . . . 0.0 111.606 171.072 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -64.44 -38.56 91.46 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 118.797 0.726 . . . . 0.0 112.663 178.173 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -61.21 -45.04 96.22 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 121.265 -0.897 . . . . 0.0 112.357 170.002 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 33.2 t30 -59.22 -43.05 92.32 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 121.506 -0.747 . . . . 0.0 111.963 174.722 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 85.0 m -62.69 -39.51 94.21 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.192 0.997 . . . . 0.0 112.414 174.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 12.9 ttm -58.2 -60.88 3.07 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 119.485 1.039 . . . . 0.0 111.272 174.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -61.01 -41.0 95.68 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.035 0.534 . . . . 0.0 111.966 -177.506 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 77.3 m -64.46 -47.93 77.18 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.294 0.638 . . . . 0.0 112.083 178.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -64.7 -31.93 73.38 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 119.493 1.042 . . . . 0.0 112.643 -178.687 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 40.8 m -59.91 -43.7 94.73 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.906 0.883 . . . . 0.0 112.516 169.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -68.9 -29.17 67.39 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 179.106 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 86.1 mt -72.25 -57.47 7.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 123.256 0.622 . . . . 0.0 110.906 178.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -71.62 -35.03 70.32 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -171.221 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 59.5 m-80 -95.99 162.65 13.47 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.456 1.103 . . . . 0.0 111.733 -178.651 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -73.45 152.07 89.74 Favored Pre-proline 0 N--CA 1.474 0.764 0 O-C-N 121.261 -0.9 . . . . 0.0 110.426 170.545 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -65.87 -1.67 5.45 Favored 'Trans proline' 0 CA--C 1.544 1.019 0 C-N-CA 123.569 2.846 . . . . 0.0 114.922 -178.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 65.0 p -118.06 -0.62 11.58 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.703 2.001 . . . . 0.0 113.063 -179.609 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 58.5 m-20 -68.48 144.98 54.45 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 118.719 0.69 . . . . 0.0 110.709 170.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -55.87 -45.77 78.43 Favored 'General case' 0 N--CA 1.471 0.625 0 O-C-N 121.682 -0.636 . . . . 0.0 112.504 -175.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.5 tp -55.32 -30.4 25.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 124.918 1.287 . . . . 0.0 114.058 177.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 48.3 t -73.31 -46.56 49.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 O-C-N 121.427 -0.796 . . . . 0.0 110.582 174.06 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 72.4 mt -61.39 -37.15 82.39 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 119.103 0.865 . . . . 0.0 111.523 177.008 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 8.9 mtt -59.63 -51.21 70.77 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.963 1.305 . . . . 0.0 112.04 169.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.97 -38.75 87.03 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.387 0.675 . . . . 0.0 112.701 176.425 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 90.0 mt-30 -62.5 -45.51 92.69 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 119.329 0.968 . . . . 0.0 112.094 173.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.25 -44.28 96.91 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.543 0.737 . . . . 0.0 112.473 177.045 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 85.2 mt -65.4 -45.67 83.06 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.913 0.885 . . . . 0.0 112.042 174.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.94 -37.68 88.02 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.138 -0.976 . . . . 0.0 113.075 -176.502 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 55.7 mtmt -58.85 -46.16 88.37 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 121.744 -0.598 . . . . 0.0 111.727 172.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 89.6 mt -67.6 -43.9 86.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 123.429 0.692 . . . . 0.0 110.702 178.142 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 34.0 t80 -50.57 -51.09 51.42 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.851 0.861 . . . . 0.0 111.095 174.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 99.6 mt -64.0 -40.26 95.96 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 178.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 82.8 mm-40 -62.64 -37.25 85.6 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 119.42 1.009 . . . . 0.0 113.004 173.576 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 33.2 mmtm -70.99 -52.66 18.35 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.111 1.364 . . . . 0.0 111.47 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.5 m -67.44 -25.16 32.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 CA-C-N 119.603 1.092 . . . . 0.0 112.366 178.395 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -62.22 -30.4 71.06 Favored 'General case' 0 CA--C 1.54 0.582 0 O-C-N 121.573 -0.705 . . . . 0.0 112.703 172.043 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -88.77 -9.16 52.86 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.478 1.111 . . . . 0.0 112.844 174.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 40.1 ttp -67.26 145.2 98.55 Favored Pre-proline 0 CA--C 1.545 0.786 0 C-N-CA 124.074 0.95 . . . . 0.0 110.347 170.033 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -60.13 156.75 38.0 Favored 'Trans proline' 0 CA--C 1.539 0.737 0 C-N-CA 123.23 2.62 . . . . 0.0 111.63 170.159 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.25 -26.74 19.91 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.503 0.721 . . . . 0.0 112.893 172.152 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -85.7 170.38 12.56 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 126.254 1.822 . . . . 0.0 111.333 171.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -132.57 171.72 13.45 Favored 'General case' 0 CA--C 1.533 0.304 0 O-C-N 120.683 -1.261 . . . . 0.0 112.294 173.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 15.0 p -152.2 142.74 15.5 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 C-N-CA 124.033 0.933 . . . . 0.0 110.656 174.05 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -64.88 136.88 57.36 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.701 1.6 . . . . 0.0 111.686 173.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 59.8 mt . . . . . 0 N--CA 1.47 0.539 0 C-N-CA 124.069 0.947 . . . . 0.0 113.327 -174.054 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.119 0 CA-C-O 121.097 0.276 . . . . 0.0 113.59 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 32.3 ptt180 -163.23 159.55 22.94 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 126.739 2.016 . . . . 0.0 110.721 172.717 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.2 tttm -71.11 137.25 48.72 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.192 0.997 . . . . 0.0 111.244 174.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 76.0 p -144.44 167.24 22.96 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 125.817 1.647 . . . . 0.0 110.922 -175.319 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 25.5 p-10 -51.13 -36.01 38.53 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 113.51 0.929 . . . . 0.0 113.51 169.359 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.5 mm100 -64.67 -54.09 37.24 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.269 1.028 . . . . 0.0 110.762 178.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.1 mt -66.97 -34.36 77.59 Favored 'General case' 0 CA--C 1.537 0.442 0 N-CA-C 112.524 0.564 . . . . 0.0 112.524 178.647 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.1 tp60 -57.55 -53.86 53.42 Favored 'General case' 0 C--O 1.222 -0.354 0 C-N-CA 123.036 0.534 . . . . 0.0 110.498 169.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 60.5 t80 -56.58 -41.89 77.72 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.348 0.976 . . . . 0.0 112.626 179.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 94.8 mmm -57.62 -51.24 70.32 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.69 -0.631 . . . . 0.0 112.184 172.421 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -85.32 -5.29 59.32 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 -173.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 60.0 t30 -124.72 -14.48 6.75 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.764 1.626 . . . . 0.0 113.294 -171.549 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 21.4 t -133.15 -52.8 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 C-N-CA 123.192 0.597 . . . . 0.0 111.058 177.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.4 t -68.95 -65.63 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 123.34 0.656 . . . . 0.0 110.696 -174.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 89.9 t -57.8 -46.7 87.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 C-N-CA 124.093 0.957 . . . . 0.0 110.322 173.24 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 69.7 tttt -58.62 -39.19 79.8 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.357 0.663 . . . . 0.0 112.552 -174.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 40.9 m -78.03 -43.56 29.05 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 118.461 0.573 . . . . 0.0 112.212 175.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 62.8 mt -61.6 -33.32 73.69 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 118.821 0.737 . . . . 0.0 112.411 177.67 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 30.9 t-105 -71.27 -31.44 67.51 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.701 1.6 . . . . 0.0 113.346 176.12 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.7 mtmp? -80.49 -7.42 59.17 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 175.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 53.0 t-80 -63.56 152.94 37.28 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.701 1.2 . . . . 0.0 112.981 -179.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 99.9 mm-40 -61.54 -19.63 62.35 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.072 1.349 . . . . 0.0 114.394 177.299 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -117.85 13.06 14.0 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.34 1.456 . . . . 0.0 113.706 -176.289 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.14 -25.93 64.63 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.815 1.246 . . . . 0.0 114.12 177.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 69.2 p-90 -56.5 -35.49 35.77 Favored Pre-proline 0 CA--C 1.547 0.865 0 N-CA-C 118.113 2.635 . . . . 0.0 118.113 -169.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -78.71 -6.94 15.54 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 CA-C-N 123.33 2.225 . . . . 0.0 112.985 176.565 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 57.7 m-85 -103.09 -7.67 21.15 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.307 1.443 . . . . 0.0 112.382 179.311 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 20.3 m-30 -62.42 -17.61 59.67 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 114.559 1.318 . . . . 0.0 114.559 179.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 89.5 mt-30 -139.7 150.88 64.63 Favored Pre-proline 0 CA--C 1.544 0.727 0 C-N-CA 124.947 1.299 . . . . 0.0 111.127 -179.088 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -70.67 143.89 47.66 Favored 'Trans proline' 0 CA--C 1.537 0.645 0 C-N-CA 123.151 2.567 . . . . 0.0 112.672 178.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 63.8 t -64.64 145.32 13.99 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 C-N-CA 124.309 1.043 . . . . 0.0 110.56 169.152 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -130.04 109.51 10.91 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.315 1.446 . . . . 0.0 110.116 173.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.32 -29.12 60.86 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.478 1.111 . . . . 0.0 113.645 179.082 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 84.4 mt -66.33 -48.87 79.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 125.227 1.411 . . . . 0.0 110.882 174.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 45.9 mmtm -68.46 -39.16 81.54 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.767 1.227 . . . . 0.0 113.126 -178.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.5 mp -87.89 -3.97 58.88 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.611 1.164 . . . . 0.0 112.774 179.482 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 52.29 58.15 5.7 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 126.083 1.753 . . . . 0.0 113.243 -177.007 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 44.7 mt -115.63 82.67 10.33 Favored Pre-proline 0 CA--C 1.544 0.749 0 C-N-CA 126.135 1.774 . . . . 0.0 110.512 -177.157 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -67.04 -8.31 21.37 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 123.911 3.074 . . . . 0.0 114.108 -173.419 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 24.9 p-10 -116.02 2.58 13.48 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 127.566 2.346 . . . . 0.0 113.737 179.24 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 58.7 t80 -49.65 -50.68 42.28 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 119.933 1.242 . . . . 0.0 113.199 -175.167 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 99.7 m-70 -76.39 -18.47 58.85 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.878 1.271 . . . . 0.0 114.115 -178.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 10.7 mmpt? -69.7 -45.13 68.94 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.071 0.948 . . . . 0.0 110.563 174.654 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.6 mp -72.37 -51.71 27.83 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 C-N-CA 123.44 0.696 . . . . 0.0 109.929 171.241 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 37.7 mm -99.54 103.66 15.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 CA-C-O 122.586 1.184 . . . . 0.0 112.156 -171.774 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 40.3 mmtm -65.47 -32.91 74.78 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.318 1.447 . . . . 0.0 113.146 175.689 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -137.01 76.77 44.87 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 125.217 1.407 . . . . 0.0 111.561 -170.03 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -70.78 128.51 15.19 Favored 'Trans proline' 0 CA--C 1.537 0.658 0 C-N-CA 124.102 3.202 . . . . 0.0 111.052 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 17.7 tpp -155.41 140.99 17.9 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.078 1.751 . . . . 0.0 109.455 -173.461 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -141.26 148.34 39.68 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 127.561 2.344 . . . . 0.0 109.161 172.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 13.0 ttp -49.45 -33.11 13.34 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 115.341 1.608 . . . . 0.0 115.341 -170.077 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -57.49 -20.07 36.49 Favored Glycine 0 CA--C 1.538 1.502 0 C-N-CA 125.382 1.468 . . . . 0.0 115.271 173.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 28.7 m -85.58 -40.13 16.6 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.51 1.124 . . . . 0.0 111.694 172.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 34.5 mt -56.39 -49.5 76.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 C-N-CA 124.431 1.092 . . . . 0.0 110.945 -177.472 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -58.32 -33.74 69.82 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 178.352 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -70.73 -45.6 64.56 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.415 1.086 . . . . 0.0 112.214 -178.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 3.8 ptp180 -69.47 -26.87 64.79 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 113.76 1.022 . . . . 0.0 113.76 172.121 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 45.7 mt -68.97 -42.47 76.56 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 119.339 0.972 . . . . 0.0 113.344 168.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -71.73 -36.37 70.45 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.666 0.786 . . . . 0.0 112.83 178.231 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 -74.17 167.62 21.21 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.004 0.922 . . . . 0.0 111.43 169.251 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 61.3 t-20 -89.6 96.51 10.73 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 121.064 -1.022 . . . . 0.0 109.139 168.074 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 57.8 t80 -123.6 -25.61 4.32 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.317 1.047 . . . . 0.0 113.74 -178.313 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -145.61 179.97 7.07 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.737 1.215 . . . . 0.0 113.565 175.814 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 2.3 t-105 -113.0 -27.5 8.04 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 126.057 1.743 . . . . 0.0 112.361 -177.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 21.0 p -135.9 137.0 40.95 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 125.164 1.386 . . . . 0.0 112.688 -168.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -58.27 -19.88 37.86 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 115.588 1.699 . . . . 0.0 115.588 -178.308 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 11.1 m -56.2 -34.43 66.26 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 119.466 1.03 . . . . 0.0 113.173 176.305 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -67.0 -44.03 81.39 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.508 0.671 . . . . 0.0 111.437 173.447 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 1.9 m -66.53 -33.39 75.57 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 126.046 1.738 . . . . 0.0 112.279 178.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 76.0 mtp -68.25 -43.58 77.53 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 125.138 1.375 . . . . 0.0 112.376 172.209 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -63.49 -30.8 71.87 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 118.02 0.373 . . . . 0.0 111.704 176.206 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 93.2 m-20 -68.36 -44.04 76.11 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.727 0.811 . . . . 0.0 112.116 173.212 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -60.54 -45.1 95.11 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 118.936 0.789 . . . . 0.0 112.528 171.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 16.8 t30 -56.33 -45.98 80.09 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.241 0.617 . . . . 0.0 111.402 172.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 71.6 m -63.33 -33.36 75.37 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.462 1.105 . . . . 0.0 112.581 176.428 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 12.1 tmm? -68.99 -55.44 10.87 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 124.59 1.156 . . . . 0.0 111.906 -177.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 29.6 m-85 -62.58 -39.13 92.74 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.392 0.677 . . . . 0.0 112.423 173.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 97.0 m -66.08 -47.19 75.07 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 121.427 -0.796 . . . . 0.0 112.287 -179.662 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -62.98 -30.71 71.8 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 119.891 1.223 . . . . 0.0 112.479 179.473 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 92.1 m -63.45 -43.5 97.21 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.059 0.944 . . . . 0.0 112.54 170.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 15.2 m-30 -65.18 -35.76 82.1 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 175.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 77.6 mt -70.27 -56.83 9.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 C-N-CA 123.214 0.606 . . . . 0.0 110.923 -178.504 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.3 t80 -69.28 -32.5 71.71 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 114.087 1.143 . . . . 0.0 114.087 -172.198 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 60.2 m-80 -101.39 164.76 11.61 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.232 1.013 . . . . 0.0 112.546 -174.235 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -67.07 140.88 96.13 Favored Pre-proline 0 N--CA 1.472 0.659 0 C-N-CA 123.816 0.846 . . . . 0.0 109.831 173.538 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -67.48 -5.32 13.78 Favored 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 123.669 2.912 . . . . 0.0 114.634 -174.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 51.7 p -116.6 -0.29 12.45 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.573 1.949 . . . . 0.0 113.187 179.69 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -67.08 151.7 47.13 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 121.601 -0.687 . . . . 0.0 111.222 172.59 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -50.45 -49.88 53.78 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.499 0.719 . . . . 0.0 112.257 178.472 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.5 tp -56.55 -33.18 38.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 -176.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 54.6 t -71.25 -49.3 49.14 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 CA-C-O 118.868 -0.586 . . . . 0.0 110.583 173.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 76.0 mt -61.47 -37.06 82.24 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.499 1.045 . . . . 0.0 112.115 178.659 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 32.0 mtp -61.97 -48.57 79.77 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 126.027 1.731 . . . . 0.0 111.543 172.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.6 -39.72 92.23 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 173.319 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -63.66 -38.7 92.11 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 119.37 0.986 . . . . 0.0 112.696 175.273 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -66.4 -46.32 76.98 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.629 0.772 . . . . 0.0 111.874 175.311 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 86.6 mt -63.73 -44.43 93.58 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.186 0.994 . . . . 0.0 112.308 175.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -65.18 -37.06 86.17 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.045 -1.035 . . . . 0.0 113.056 -175.655 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 36.1 mtmm -61.0 -41.94 97.48 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 121.341 -0.85 . . . . 0.0 111.719 172.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 81.4 mt -65.62 -45.55 91.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 CA-C-O 118.785 -0.626 . . . . 0.0 110.464 174.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 34.1 t80 -50.2 -51.08 47.0 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 119.226 0.921 . . . . 0.0 111.427 174.385 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.4 mt -63.19 -42.24 99.31 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 121.652 -0.655 . . . . 0.0 112.643 179.075 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 93.3 mm-40 -61.56 -36.12 79.73 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 119.341 0.973 . . . . 0.0 113.022 174.086 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 34.5 mmtm -70.98 -53.57 14.38 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.99 1.316 . . . . 0.0 111.409 179.435 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 4.7 m -68.92 -25.54 30.41 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 CA-C-N 119.654 1.115 . . . . 0.0 112.647 179.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -59.14 -28.37 66.51 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 173.06 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -93.52 -4.96 50.14 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.943 1.297 . . . . 0.0 112.569 177.603 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 38.8 ttp -67.2 139.16 94.87 Favored Pre-proline 0 CA--C 1.548 0.901 0 C-N-CA 124.028 0.931 . . . . 0.0 110.532 171.577 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -64.91 156.08 64.26 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 123.045 2.497 . . . . 0.0 112.269 175.609 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 62.2 mm-40 -85.37 -16.04 41.2 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.98 0.912 . . . . 0.0 113.172 177.489 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 13.6 mp0 -103.82 146.56 28.46 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.587 1.155 . . . . 0.0 113.097 -175.673 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.43 146.09 27.14 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.305 1.042 . . . . 0.0 111.715 174.056 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 82.4 t -141.46 125.47 16.58 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 C-N-CA 127.338 2.255 . . . . 0.0 108.71 174.071 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -65.61 125.07 24.09 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.84 1.656 . . . . 0.0 111.329 169.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 90.6 mt . . . . . 0 CA--C 1.541 0.6 0 C-N-CA 123.485 0.714 . . . . 0.0 112.75 177.719 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.367 0 N-CA-C 110.99 -0.844 . . . . 0.0 110.99 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.9 p -68.51 156.18 38.49 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.565 1.146 . . . . 0.0 113.394 176.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 50.2 m -68.08 134.41 50.56 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.323 1.049 . . . . 0.0 112.107 176.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 176.22 27.81 0.03 OUTLIER Glycine 0 CA--C 1.536 1.399 0 C-N-CA 123.976 0.798 . . . . 0.0 114.914 179.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 50.4 m -145.82 170.09 17.25 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.497 1.519 . . . . 0.0 111.958 -169.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.5 m -127.21 22.19 6.62 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 125.627 1.571 . . . . 0.0 112.675 178.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 83.71 -171.87 49.63 Favored Glycine 0 CA--C 1.536 1.346 0 C-N-CA 124.954 1.264 . . . . 0.0 113.401 -174.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -127.04 176.39 7.38 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.854 1.262 . . . . 0.0 112.062 -176.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 18.6 m -123.7 -15.52 5.27 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 C-N-CA 124.491 1.116 . . . . 0.0 113.819 -172.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 10.9 t -150.99 160.35 43.99 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 125.816 1.647 . . . . 0.0 109.171 169.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -155.52 121.42 2.6 Favored Pre-proline 0 CA--C 1.546 0.796 0 O-C-N 121.684 -0.635 . . . . 0.0 111.68 -176.817 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -81.75 -28.37 2.18 Favored 'Trans proline' 0 CA--C 1.542 0.898 0 C-N-CA 123.441 2.761 . . . . 0.0 113.419 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.8 t -77.64 -44.94 26.56 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.047 0.939 . . . . 0.0 112.281 -177.257 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 52.4 tttm -72.94 133.65 81.77 Favored Pre-proline 0 N--CA 1.473 0.702 0 C-N-CA 124.53 1.132 . . . . 0.0 110.375 174.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -70.89 147.5 55.71 Favored 'Trans proline' 0 CA--C 1.535 0.55 0 C-N-CA 122.08 1.853 . . . . 0.0 111.89 177.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 178.82 150.47 8.87 Favored Glycine 0 CA--C 1.528 0.896 0 N-CA-C 114.715 0.646 . . . . 0.0 114.715 178.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 19.7 ptt180 -161.42 166.49 27.22 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 126.901 2.08 . . . . 0.0 110.678 175.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -71.42 117.33 12.82 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.378 1.471 . . . . 0.0 111.882 -177.014 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 69.4 p -126.99 163.21 24.21 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.667 1.187 . . . . 0.0 112.089 -179.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -56.54 -35.41 68.09 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.302 1.441 . . . . 0.0 113.636 174.496 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -67.38 -50.21 60.69 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 122.874 0.47 . . . . 0.0 111.255 177.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 89.3 mt -62.05 -35.77 79.64 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.443 -0.786 . . . . 0.0 112.178 173.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 19.1 tp60 -58.75 -49.17 78.62 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 119.012 -0.518 . . . . 0.0 111.201 173.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 55.4 t80 -58.28 -42.57 86.86 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 119.437 1.017 . . . . 0.0 112.402 177.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 97.0 mmm -55.82 -51.42 67.54 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.128 0.571 . . . . 0.0 112.142 173.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -83.46 -12.68 56.07 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 114.971 1.471 . . . . 0.0 114.971 -175.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 59.0 t30 -107.4 -22.77 12.45 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.545 1.138 . . . . 0.0 112.869 -172.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 13.5 t -129.69 -49.69 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 C-N-CA 123.361 0.664 . . . . 0.0 112.081 -179.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.5 t -69.6 -64.16 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 CA-C-N 118.694 0.679 . . . . 0.0 110.586 -173.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 73.3 t -57.04 -45.08 83.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.675 0 C-N-CA 124.703 1.201 . . . . 0.0 110.259 172.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.3 tppp? -53.15 -47.34 68.84 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.179 0.991 . . . . 0.0 112.066 -179.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 32.6 m -76.68 -40.95 47.3 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -179.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 59.6 mt -63.25 -33.4 75.41 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.264 0.626 . . . . 0.0 112.329 176.328 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 22.3 t-105 -73.2 -31.06 63.96 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.56 1.544 . . . . 0.0 113.274 174.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 54.8 mtmt -77.65 -9.52 59.02 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 174.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 47.0 t-80 -63.29 149.38 45.79 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.746 1.218 . . . . 0.0 113.221 -179.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 17.1 pt20 -61.31 -12.53 14.06 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 115.265 1.58 . . . . 0.0 115.265 176.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 20.2 m-85 -124.22 17.04 9.13 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.96 1.704 . . . . 0.0 113.645 -179.341 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.51 -27.81 65.51 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 114.168 1.173 . . . . 0.0 114.168 176.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 41.5 p-90 -56.62 -37.78 61.37 Favored Pre-proline 0 CA--C 1.547 0.831 0 N-CA-C 118.096 2.628 . . . . 0.0 118.096 -169.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -75.17 -5.81 17.16 Favored 'Trans proline' 0 CA--C 1.544 0.988 0 CA-C-N 123.221 2.186 . . . . 0.0 113.623 174.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -106.49 -5.61 18.74 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.432 1.493 . . . . 0.0 112.877 178.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -61.24 -18.07 56.52 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 114.392 1.256 . . . . 0.0 114.392 178.214 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -143.48 155.98 60.46 Favored Pre-proline 0 CA--C 1.545 0.755 0 C-N-CA 125.868 1.667 . . . . 0.0 110.677 -175.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -65.67 151.32 84.92 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 122.752 2.302 . . . . 0.0 111.912 171.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 60.8 t -66.78 104.67 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 124.051 0.94 . . . . 0.0 110.773 176.3 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 -74.88 85.59 2.23 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.202 1.001 . . . . 0.0 110.089 169.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -51.84 -25.91 8.82 Favored 'General case' 0 CA--C 1.548 0.904 0 N-CA-C 114.053 1.131 . . . . 0.0 114.053 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 81.7 mt -64.17 -49.9 79.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 C-N-CA 125.618 1.567 . . . . 0.0 111.436 171.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -73.88 -40.52 63.15 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 125.239 1.416 . . . . 0.0 112.87 -178.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -74.29 -10.71 59.86 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.928 1.291 . . . . 0.0 113.132 174.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 68.3 m-20 56.11 56.53 5.8 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.48 1.912 . . . . 0.0 112.503 -179.283 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 46.6 mt -115.67 80.51 8.39 Favored Pre-proline 0 CA--C 1.545 0.77 0 C-N-CA 126.318 1.847 . . . . 0.0 110.35 -177.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -68.1 -6.26 16.77 Favored 'Trans proline' 0 CA--C 1.543 0.937 0 C-N-CA 123.977 3.118 . . . . 0.0 114.361 -174.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 29.4 m-20 -122.29 12.44 10.2 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.06 1.744 . . . . 0.0 112.53 178.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 80.0 t80 -48.5 -55.44 11.01 Favored 'General case' 0 N--CA 1.476 0.859 0 O-C-N 120.915 -1.116 . . . . 0.0 113.319 -175.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -73.95 -12.17 60.57 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.825 1.25 . . . . 0.0 114.353 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.61 -34.69 67.54 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 121.123 -0.986 . . . . 0.0 111.807 174.072 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.4 mp -92.28 -47.42 14.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 124.68 1.192 . . . . 0.0 110.906 174.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 38.6 mm -76.99 110.51 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 123.511 0.724 . . . . 0.0 111.335 -177.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -71.31 -35.87 71.41 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.805 1.242 . . . . 0.0 112.836 174.747 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 13.2 p30 -147.69 83.14 7.66 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 125.534 1.534 . . . . 0.0 111.721 -168.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -69.37 131.66 22.27 Favored 'Trans proline' 0 CA--C 1.535 0.566 0 C-N-CA 123.467 2.778 . . . . 0.0 110.919 -177.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 6.4 tpt -156.49 133.73 10.62 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.004 1.322 . . . . 0.0 110.28 -170.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -146.79 151.06 36.53 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.631 1.572 . . . . 0.0 111.22 -176.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.6 ttp -56.23 -36.78 68.86 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.462 1.505 . . . . 0.0 113.284 -170.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -58.94 -25.77 59.86 Favored Glycine 0 CA--C 1.533 1.188 0 C-N-CA 125.014 1.292 . . . . 0.0 114.77 174.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 39.8 m -92.96 -33.63 14.09 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.572 1.149 . . . . 0.0 111.634 175.133 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 44.7 mt -56.78 -50.84 73.32 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 CA-C-N 119.196 0.907 . . . . 0.0 110.497 174.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -62.07 -33.06 73.7 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 177.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.416 ' HA ' ' HE3' ' A' ' 88' ' ' LYS . 0.6 OUTLIER -67.45 -27.73 67.29 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -176.501 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 5.1 ptp180 -84.06 -31.93 25.1 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 113.839 1.051 . . . . 0.0 113.839 169.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 87.4 mt -62.04 -33.71 74.87 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 119.541 1.064 . . . . 0.0 113.311 168.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -67.73 1.92 2.22 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 125.603 1.561 . . . . 0.0 113.805 172.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 57.8 m-80 -137.57 -169.78 2.6 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 128.494 2.718 . . . . 0.0 110.696 -177.285 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 75.1 m-80 -113.73 44.21 1.66 Allowed 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.537 1.535 . . . . 0.0 111.051 -178.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 41.2 t80 -64.4 -35.95 82.56 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.553 0.741 . . . . 0.0 111.92 -175.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -137.6 176.43 8.71 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 127.098 2.159 . . . . 0.0 111.842 -178.303 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 2.5 t-105 -108.89 -25.29 10.84 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.882 1.673 . . . . 0.0 112.283 -178.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 51.9 p -133.05 145.73 51.06 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.25 1.42 . . . . 0.0 113.678 -168.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -69.9 -19.66 63.4 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 115.229 1.566 . . . . 0.0 115.229 -175.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 18.0 m -56.24 -28.81 59.78 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.785 0.834 . . . . 0.0 113.067 174.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -71.98 -44.12 64.03 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.554 0.742 . . . . 0.0 112.299 174.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 42.5 t -61.16 -38.97 88.38 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.713 0.805 . . . . 0.0 111.797 172.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 83.5 mtp -61.42 -43.17 99.33 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 121.44 -0.787 . . . . 0.0 112.387 172.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . 0.253 2.4 pt20 -67.43 -30.4 70.13 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 175.763 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -68.03 -43.62 78.34 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.374 -0.829 . . . . 0.0 111.961 170.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -59.36 -45.44 91.41 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 121.202 -0.936 . . . . 0.0 112.312 172.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 18.6 t30 -56.83 -47.38 80.44 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 122.965 0.506 . . . . 0.0 111.67 172.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 74.6 m -61.05 -37.91 84.32 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.907 0.883 . . . . 0.0 112.508 178.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 51.9 ttp -59.99 -55.9 28.34 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 119.091 0.86 . . . . 0.0 111.983 173.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -64.74 -42.47 95.18 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 112.207 0.447 . . . . 0.0 112.207 -177.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 98.0 m -64.61 -46.91 80.62 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.444 -0.785 . . . . 0.0 112.355 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -63.56 -32.49 73.97 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 119.909 1.232 . . . . 0.0 112.143 179.317 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 94.8 m -61.97 -43.62 98.46 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.761 0.824 . . . . 0.0 112.927 170.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -67.37 -32.71 73.83 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 178.163 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 89.1 mt -65.12 -56.3 16.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 C-N-CA 123.388 0.675 . . . . 0.0 110.825 177.232 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 31.9 t80 -69.13 -37.25 78.2 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 -172.483 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 64.7 m-80 -100.79 159.3 15.3 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.862 0.865 . . . . 0.0 112.724 -170.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 49.2 mmtm -66.82 146.11 99.03 Favored Pre-proline 0 N--CA 1.476 0.867 0 C-N-CA 123.773 0.829 . . . . 0.0 110.571 172.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -66.24 -7.61 17.9 Favored 'Trans proline' 0 CA--C 1.542 0.919 0 C-N-CA 123.604 2.87 . . . . 0.0 114.656 -175.402 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 50.8 p -113.6 -0.66 14.28 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 126.624 1.969 . . . . 0.0 113.235 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -65.89 147.25 53.67 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.568 -0.708 . . . . 0.0 111.027 173.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -51.85 -48.49 63.96 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.568 0.747 . . . . 0.0 112.405 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 9.9 tp -57.02 -30.9 35.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 N-CA-C 114.073 1.138 . . . . 0.0 114.073 -179.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 51.9 t -72.76 -47.44 49.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 O-C-N 121.55 -0.719 . . . . 0.0 110.394 174.121 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 75.0 mt -61.08 -36.74 80.46 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 118.994 0.816 . . . . 0.0 111.808 176.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 11.2 mtt -59.01 -52.64 64.9 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.892 1.277 . . . . 0.0 112.011 169.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.14 -39.78 87.5 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.254 0.621 . . . . 0.0 112.542 176.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 90.3 mt-30 -62.51 -38.36 89.61 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.909 0.884 . . . . 0.0 112.833 174.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -75.49 -34.7 60.89 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.196 0.998 . . . . 0.0 113.214 178.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 72.0 mt -68.87 -45.51 70.81 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.182 0.593 . . . . 0.0 111.383 170.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -62.54 -39.95 95.24 Favored 'General case' 0 N--CA 1.468 0.467 0 O-C-N 121.281 -0.887 . . . . 0.0 112.98 -175.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 5.2 ptpp? -61.0 -42.36 98.3 Favored 'General case' 0 N--CA 1.474 0.737 0 O-C-N 121.382 -0.824 . . . . 0.0 112.36 176.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 87.8 mt -66.26 -46.24 87.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 C-N-CA 123.828 0.851 . . . . 0.0 110.632 174.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -50.09 -50.22 48.95 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 119.102 0.864 . . . . 0.0 111.188 174.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.2 mt -63.01 -42.17 99.76 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 178.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -62.0 -35.43 78.52 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 119.444 1.02 . . . . 0.0 112.964 174.143 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 34.6 mmtm -72.98 -52.43 14.52 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.862 1.265 . . . . 0.0 111.635 179.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.0 m -67.92 -25.24 31.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 CA-C-N 119.736 1.153 . . . . 0.0 112.447 178.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -61.69 -30.32 70.67 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.58 -0.7 . . . . 0.0 112.604 170.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -90.24 -9.45 47.99 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.758 1.223 . . . . 0.0 112.683 175.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 40.0 ttp -64.77 141.55 98.35 Favored Pre-proline 0 CA--C 1.547 0.859 0 CA-C-N 119.004 0.82 . . . . 0.0 109.86 169.014 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -51.99 151.69 15.66 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 122.945 2.43 . . . . 0.0 113.43 170.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 18.7 mm100 -90.64 -21.05 21.87 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.385 0.674 . . . . 0.0 112.648 172.161 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -93.97 159.39 15.19 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.673 1.589 . . . . 0.0 111.053 173.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -125.3 139.11 53.99 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.07 1.348 . . . . 0.0 111.293 -171.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 9.9 p -146.01 150.73 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 124.315 1.046 . . . . 0.0 111.438 -175.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 24.6 tp10 -69.35 146.69 51.94 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.109 0.964 . . . . 0.0 111.715 171.593 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 88.3 mt -75.64 156.84 34.46 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 113.608 0.966 . . . . 0.0 113.608 173.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 96.8 mt -69.03 155.28 93.9 Favored Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 124.315 1.046 . . . . 0.0 110.766 168.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -70.15 147.17 59.75 Favored 'Trans proline' 0 CA--C 1.547 1.166 0 C-N-CA 122.549 2.166 . . . . 0.0 111.992 -179.07 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -73.91 160.63 42.93 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 123.51 2.806 . . . . 0.0 112.465 179.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -65.79 150.04 96.78 Favored Pre-proline 0 CA--C 1.552 1.051 0 C-N-CA 123.577 0.751 . . . . 0.0 111.822 170.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -71.86 154.33 58.53 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 123.091 2.528 . . . . 0.0 112.397 178.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.43 162.64 17.38 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.381 1.072 . . . . 0.0 113.02 171.853 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . -147.08 6.72 1.14 Allowed Glycine 0 CA--C 1.538 1.487 0 N-CA-C 115.876 1.11 . . . . 0.0 115.876 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 25.8 ttmm . . . . . 0 C--O 1.252 1.22 0 C-N-CA 125.108 1.363 . . . . 0.0 111.741 173.856 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.43 0 N-CA-C 110.69 -0.964 . . . . 0.0 110.69 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 34.1 m -75.08 51.39 0.52 Allowed 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 125.906 1.682 . . . . 0.0 112.901 176.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.3 m -71.67 48.33 0.15 Allowed 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 127.789 2.435 . . . . 0.0 114.469 -172.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -163.46 -23.59 0.02 OUTLIER Glycine 0 CA--C 1.538 1.516 0 C-N-CA 125.646 1.593 . . . . 0.0 114.883 -178.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 64.0 p -155.42 142.46 19.17 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 118.931 1.366 . . . . 0.0 112.331 173.337 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.3 m -78.29 -14.94 59.21 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 -178.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 169.41 -168.97 41.69 Favored Glycine 0 CA--C 1.535 1.307 0 C-N-CA 125.486 1.517 . . . . 0.0 112.535 -175.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -143.71 157.72 44.19 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.013 1.325 . . . . 0.0 112.767 179.25 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 34.1 m -132.69 -15.8 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 C-N-CA 125.963 1.705 . . . . 0.0 113.273 177.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 18.6 m -145.7 140.49 27.28 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 127.221 2.208 . . . . 0.0 108.713 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -149.19 134.71 9.68 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 123.786 0.835 . . . . 0.0 111.01 -172.521 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -77.77 -7.65 16.64 Favored 'Trans proline' 0 CA--C 1.543 0.972 0 C-N-CA 123.989 3.126 . . . . 0.0 115.339 -173.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 7.5 t -133.56 -21.07 2.01 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 -172.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 60.4 tttp -65.49 128.78 94.08 Favored Pre-proline 0 N--CA 1.476 0.861 0 CA-C-N 119.451 1.023 . . . . 0.0 109.871 169.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -71.84 144.32 43.24 Favored 'Trans proline' 0 CA--C 1.534 0.489 0 C-N-CA 122.602 2.202 . . . . 0.0 112.254 -178.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 171.4 166.18 29.8 Favored Glycine 0 CA--C 1.528 0.888 0 C-N-CA 123.866 0.746 . . . . 0.0 114.33 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 8.6 ptp180 -164.66 167.83 18.71 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 127.461 2.304 . . . . 0.0 110.175 176.223 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 8.3 tppt? -76.11 114.24 14.54 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 166.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 67.2 p -105.84 169.5 8.45 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 125.18 1.392 . . . . 0.0 110.297 174.012 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 24.0 p-10 -50.52 -37.86 41.36 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 174.266 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -71.51 -48.07 51.26 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.519 0.727 . . . . 0.0 111.595 178.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 75.9 mt -65.54 -30.78 71.57 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.472 -0.767 . . . . 0.0 112.753 177.047 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 39.3 tt0 -59.56 -52.62 64.76 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 123.913 0.885 . . . . 0.0 109.681 168.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 64.9 t80 -58.73 -42.35 88.54 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.025 0.93 . . . . 0.0 112.755 179.453 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 96.7 mmm -53.95 -51.71 62.95 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 118.514 0.597 . . . . 0.0 112.008 174.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 4.3 tp60 -75.08 -34.06 61.72 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 121.17 -0.956 . . . . 0.0 113.496 -178.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 52.3 t30 -89.81 -22.67 21.99 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.512 1.125 . . . . 0.0 113.479 -168.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 6.0 t -130.64 -50.13 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 CA-C-N 118.103 0.411 . . . . 0.0 111.195 -175.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 17.0 t -68.19 -62.93 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 122.783 0.433 . . . . 0.0 110.189 -175.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 43.1 t -56.4 -48.47 79.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 C-N-CA 125.368 1.467 . . . . 0.0 110.387 173.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 24.6 ttpt -60.37 -43.01 96.98 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -173.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 53.1 m -71.42 -44.96 63.9 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 119.01 0.823 . . . . 0.0 112.22 173.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 70.0 mt -60.4 -35.09 74.95 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.315 0.961 . . . . 0.0 112.325 178.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 26.0 t-105 -69.77 -30.1 67.59 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.538 1.535 . . . . 0.0 113.494 176.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -84.38 -6.21 59.36 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 124.302 1.041 . . . . 0.0 113.756 177.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 45.7 t-80 -63.15 154.73 30.21 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.74 1.216 . . . . 0.0 113.154 -179.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 60.9 tt0 -56.47 -24.54 46.52 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.598 1.559 . . . . 0.0 113.931 175.084 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 -122.0 19.28 10.86 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.326 1.451 . . . . 0.0 113.841 -173.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.79 -26.74 63.47 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 176.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 61.3 p-90 -59.58 -35.45 30.05 Favored Pre-proline 0 CA--C 1.548 0.893 0 N-CA-C 117.861 2.541 . . . . 0.0 117.861 -169.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -74.93 -3.42 13.89 Favored 'Trans proline' 0 CA--C 1.544 0.986 0 CA-C-N 123.232 2.19 . . . . 0.0 113.558 174.23 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 56.5 m-85 -109.98 -6.48 15.16 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.472 1.509 . . . . 0.0 113.066 178.259 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 20.4 m-30 -62.87 -16.53 59.04 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 178.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -142.02 156.52 65.08 Favored Pre-proline 0 CA--C 1.544 0.739 0 C-N-CA 126.372 1.869 . . . . 0.0 110.239 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -64.65 152.96 79.91 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 122.673 2.249 . . . . 0.0 112.054 173.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 54.6 t -66.38 101.12 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 C-N-CA 124.088 0.955 . . . . 0.0 110.675 176.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 52.7 m-20 -75.5 84.67 2.58 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.512 1.125 . . . . 0.0 110.613 172.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.97 -28.29 36.65 Favored 'General case' 0 CA--C 1.547 0.827 0 N-CA-C 113.987 1.106 . . . . 0.0 113.987 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 81.9 mt -65.37 -50.1 74.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 124.766 1.226 . . . . 0.0 111.097 172.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -66.33 -41.83 89.05 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.217 1.407 . . . . 0.0 112.56 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.6 mp -80.13 -4.76 54.24 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.631 1.173 . . . . 0.0 113.22 177.278 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 60.3 t30 54.8 55.05 8.28 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 126.107 1.763 . . . . 0.0 113.48 -179.239 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 34.8 mt -114.62 83.13 8.57 Favored Pre-proline 0 CA--C 1.543 0.673 0 C-N-CA 126.387 1.875 . . . . 0.0 110.343 -178.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -68.07 -3.44 10.66 Favored 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 123.884 3.056 . . . . 0.0 114.337 -175.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -127.34 9.86 6.71 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 126.174 1.79 . . . . 0.0 112.821 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 65.7 t80 -51.93 -51.86 54.07 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-N 120.284 1.402 . . . . 0.0 112.89 -175.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -76.17 -10.88 59.75 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.16 1.384 . . . . 0.0 113.89 179.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -72.44 -42.95 64.45 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.82 0.848 . . . . 0.0 110.267 175.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.9 mp -79.11 -55.54 9.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 C-N-CA 124.708 1.203 . . . . 0.0 110.262 172.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 47.9 mm -85.01 104.22 12.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 CA-C-O 122.153 0.978 . . . . 0.0 111.387 -175.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -71.24 -29.46 65.15 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.955 1.702 . . . . 0.0 114.058 -179.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -143.75 77.42 15.0 Favored Pre-proline 0 CA--C 1.542 0.639 0 C-N-CA 125.486 1.514 . . . . 0.0 110.712 -172.582 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -67.06 142.84 63.11 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 123.983 3.122 . . . . 0.0 111.648 -179.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 8.0 tpt -157.46 137.87 12.86 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.555 1.542 . . . . 0.0 109.846 -176.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -146.54 150.04 34.77 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.955 1.302 . . . . 0.0 111.401 -176.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 9.7 ttp -56.78 -36.72 70.18 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.992 1.317 . . . . 0.0 113.511 -169.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -61.31 -21.59 59.98 Favored Glycine 0 CA--C 1.536 1.405 0 C-N-CA 124.888 1.233 . . . . 0.0 114.77 173.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 24.3 m -97.08 -34.1 11.28 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.807 1.243 . . . . 0.0 111.523 172.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 76.8 mt -55.42 -50.37 66.24 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 119.467 1.031 . . . . 0.0 110.653 173.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 14.1 ptmm? -61.81 -29.71 70.34 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 113.976 1.102 . . . . 0.0 113.976 176.368 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.5 tpmt? -70.64 -32.9 70.37 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.748 1.219 . . . . 0.0 113.301 -175.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 3.8 ptp180 -77.95 -31.43 50.91 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 169.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 80.8 mt -67.6 -28.47 67.78 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 114.04 1.126 . . . . 0.0 114.04 169.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -65.92 -8.48 22.63 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 125.271 1.428 . . . . 0.0 114.149 174.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 -135.17 163.64 29.49 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.702 1.601 . . . . 0.0 112.819 -171.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 -81.12 105.39 12.29 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 169.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -140.53 -40.71 0.42 Allowed 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.308 1.043 . . . . 0.0 112.675 -172.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -130.81 175.53 8.96 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 126.603 1.961 . . . . 0.0 111.25 172.67 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 3.1 t-105 -115.24 -21.2 10.04 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.602 1.161 . . . . 0.0 112.833 -174.308 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 91.7 p -127.19 149.16 50.1 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.387 1.075 . . . . 0.0 112.783 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -64.32 -20.32 66.02 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 114.212 1.19 . . . . 0.0 114.212 175.227 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 83.1 p -51.13 -38.38 51.66 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.022 0.929 . . . . 0.0 113.255 177.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -67.19 -43.16 82.84 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.357 1.063 . . . . 0.0 111.782 179.241 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 49.6 t -66.92 -36.35 82.06 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.23 1.012 . . . . 0.0 112.742 174.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 88.1 mtp -62.42 -41.66 98.87 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 121.425 -0.797 . . . . 0.0 111.964 176.615 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 61.8 mm-40 -64.68 -33.93 77.11 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 112.767 0.655 . . . . 0.0 112.767 173.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 87.5 m-20 -67.69 -41.86 82.98 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 120.967 -1.083 . . . . 0.0 111.78 174.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -59.38 -47.58 84.91 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.208 0.603 . . . . 0.0 112.308 169.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.75 -42.0 92.22 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 121.776 -0.577 . . . . 0.0 111.297 177.029 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 62.4 m -62.49 -45.47 92.85 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.72 0.808 . . . . 0.0 111.547 178.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 57.5 ttp -55.68 -52.4 63.99 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.157 0.983 . . . . 0.0 112.778 176.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -68.46 -37.28 80.04 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.0 m -59.28 -50.15 75.1 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.226 1.01 . . . . 0.0 111.818 173.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -57.97 -37.46 74.22 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.268 0.627 . . . . 0.0 112.18 -178.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 90.3 m -57.29 -43.16 82.94 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.122 0.969 . . . . 0.0 112.386 173.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -70.18 -29.57 66.47 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.3 1.04 . . . . 0.0 113.632 176.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 82.2 mt -75.67 -57.13 6.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 123.804 0.842 . . . . 0.0 110.894 179.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -69.74 -23.04 63.33 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 114.507 1.299 . . . . 0.0 114.507 -172.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 36.6 m-80 -120.32 165.93 14.21 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.336 1.054 . . . . 0.0 112.724 -170.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -70.19 148.47 95.85 Favored Pre-proline 0 N--CA 1.475 0.813 0 C-N-CA 124.178 0.991 . . . . 0.0 110.477 174.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -65.99 -6.38 14.25 Favored 'Trans proline' 0 CA--C 1.543 0.963 0 C-N-CA 123.634 2.889 . . . . 0.0 114.568 -178.319 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 67.9 p -116.0 1.32 13.26 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 126.641 1.977 . . . . 0.0 113.099 179.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -66.91 147.81 52.75 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 121.478 -0.764 . . . . 0.0 110.833 173.135 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -52.29 -48.55 65.28 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.441 0.696 . . . . 0.0 112.322 178.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.1 tp -58.15 -30.11 38.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 -178.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 39.2 t -71.38 -48.3 54.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 O-C-N 121.538 -0.726 . . . . 0.0 110.383 173.226 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 74.3 mt -61.35 -36.65 80.76 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 118.876 0.762 . . . . 0.0 111.701 177.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 11.7 mtt -59.23 -51.75 68.63 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 124.735 1.214 . . . . 0.0 111.984 169.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -59.97 -40.9 90.68 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 123.191 0.596 . . . . 0.0 112.474 176.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 89.5 mt-30 -61.71 -45.96 91.71 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 119.085 0.857 . . . . 0.0 111.972 174.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -69.0 -28.0 66.2 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.445 1.098 . . . . 0.0 113.862 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 78.7 mt -78.36 -45.09 23.36 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.857 0.863 . . . . 0.0 111.547 169.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -61.04 -40.31 93.12 Favored 'General case' 0 N--CA 1.47 0.569 0 O-C-N 121.124 -0.985 . . . . 0.0 112.777 -175.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 60.6 pttt -59.22 -39.76 83.71 Favored 'General case' 0 N--CA 1.474 0.741 0 O-C-N 121.535 -0.728 . . . . 0.0 112.282 176.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 69.1 mt -72.66 -42.37 62.61 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 C-N-CA 124.457 1.103 . . . . 0.0 111.272 175.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -50.85 -51.58 49.9 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.395 0.998 . . . . 0.0 110.384 171.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 99.1 mt -62.18 -45.03 95.21 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 177.027 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -62.89 -30.61 71.66 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 119.603 1.092 . . . . 0.0 113.402 179.074 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 70.3 mmtt -75.1 -54.92 6.31 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 124.658 1.183 . . . . 0.0 112.262 174.216 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 6.0 m -66.13 -25.03 34.8 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 CA-C-N 120.691 1.587 . . . . 0.0 112.535 -178.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -58.09 -28.47 64.62 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 172.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -97.81 -3.18 39.38 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.235 1.414 . . . . 0.0 112.423 178.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 42.9 ttp -62.64 138.27 96.71 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 123.994 0.917 . . . . 0.0 110.728 173.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.07 125.98 15.62 Favored 'Trans proline' 0 CA--C 1.534 0.516 0 C-N-CA 122.864 2.376 . . . . 0.0 110.365 177.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 80.4 mm-40 -76.2 -22.4 55.34 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 113.472 0.915 . . . . 0.0 113.472 -173.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -75.13 159.02 32.14 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.244 1.417 . . . . 0.0 111.585 169.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -122.59 129.65 52.14 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.574 1.55 . . . . 0.0 111.208 -174.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 78.8 t -141.76 131.5 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 125.545 1.538 . . . . 0.0 110.961 -169.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -69.31 125.03 25.42 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.601 1.56 . . . . 0.0 111.074 169.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 97.7 mt -76.1 152.59 36.75 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 178.418 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 4.5 pp -73.81 153.94 89.16 Favored Pre-proline 0 CA--C 1.552 1.02 0 C-N-CA 124.165 0.986 . . . . 0.0 111.217 168.264 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -78.21 156.52 29.67 Favored 'Trans proline' 0 CA--C 1.548 1.183 0 C-N-CA 123.179 2.586 . . . . 0.0 113.057 -175.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -70.94 170.12 18.77 Favored 'Trans proline' 0 CA--C 1.542 0.911 0 C-N-CA 123.748 2.966 . . . . 0.0 112.752 174.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -144.53 154.83 56.89 Favored Pre-proline 0 CA--C 1.551 0.985 0 C-N-CA 125.326 1.45 . . . . 0.0 111.89 -179.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.13 167.86 24.93 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 123.64 2.893 . . . . 0.0 113.116 178.188 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 64.4 pttt -146.5 168.75 20.44 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.971 1.708 . . . . 0.0 112.383 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . -165.19 37.93 0.28 Allowed Glycine 0 CA--C 1.534 1.275 0 C-N-CA 124.611 1.101 . . . . 0.0 113.785 -175.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 15.4 ptmm? . . . . . 0 C--O 1.255 1.367 0 C-N-CA 126.502 1.921 . . . . 0.0 112.919 -175.727 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.488 0 N-CA-C 112.13 -0.388 . . . . 0.0 112.13 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 49.2 m -74.29 64.26 1.09 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 126.138 1.775 . . . . 0.0 113.29 179.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 78.6 p -62.08 167.04 4.2 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.097 1.359 . . . . 0.0 113.446 172.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -140.31 82.58 0.24 Allowed Glycine 0 CA--C 1.531 1.073 0 C-N-CA 125.088 1.328 . . . . 0.0 112.438 -172.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 91.6 p -141.16 171.82 13.53 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 125.644 1.578 . . . . 0.0 112.318 -179.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 77.2 p -139.37 13.85 2.58 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.057 1.343 . . . . 0.0 114.366 -169.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 88.22 -138.25 14.91 Favored Glycine 0 CA--C 1.533 1.179 0 C-N-CA 124.292 0.948 . . . . 0.0 111.885 -173.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -130.79 166.53 20.61 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.895 1.278 . . . . 0.0 112.576 175.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 27.2 m -136.92 -11.31 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.259 0 C-N-CA 125.986 1.714 . . . . 0.0 113.417 -175.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 40.3 p -150.18 143.7 25.18 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 126.691 1.997 . . . . 0.0 110.87 -177.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -154.55 134.62 8.05 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 124.473 1.109 . . . . 0.0 110.092 -173.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -70.17 -16.73 35.91 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 123.562 2.842 . . . . 0.0 115.309 -173.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 44.2 m -159.09 91.12 1.01 Allowed 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 119.859 1.209 . . . . 0.0 111.794 176.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.73 159.68 64.11 Favored Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 126.581 1.952 . . . . 0.0 112.604 -176.376 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -70.94 157.72 57.34 Favored 'Trans proline' 0 CA--C 1.539 0.767 0 C-N-CA 122.906 2.404 . . . . 0.0 112.257 176.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 129.1 164.03 11.38 Favored Glycine 0 CA--C 1.529 0.96 0 C-N-CA 124.481 1.039 . . . . 0.0 113.299 176.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 34.8 ptt180 -163.79 157.87 19.46 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 126.235 1.814 . . . . 0.0 110.425 175.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 26.0 ttpt -71.45 135.96 47.42 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.451 0.7 . . . . 0.0 110.315 170.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 70.9 p -140.22 166.79 23.71 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 125.951 1.701 . . . . 0.0 110.181 -175.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 25.1 p-10 -46.63 -37.69 8.59 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 170.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 -70.31 -55.57 8.87 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.573 0.749 . . . . 0.0 111.683 179.205 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 86.2 mt -62.67 -34.55 77.34 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 121.534 -0.729 . . . . 0.0 112.597 178.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -56.24 -54.3 47.01 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.904 0.882 . . . . 0.0 110.842 170.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 75.1 t80 -59.29 -40.54 86.45 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 119.098 0.863 . . . . 0.0 112.925 179.175 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 92.3 mmm -55.48 -50.98 68.47 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 118.754 0.706 . . . . 0.0 111.795 172.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -85.56 -3.39 58.86 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 114.874 1.435 . . . . 0.0 114.874 -175.147 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 38.5 m-80 -118.33 -17.48 9.46 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.027 1.331 . . . . 0.0 114.265 -178.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 37.9 t -136.99 -50.18 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-N 119.211 0.914 . . . . 0.0 111.866 -178.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.4 t -67.75 -62.71 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 CA-C-N 119.378 0.99 . . . . 0.0 110.634 -174.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 84.5 t -60.71 -44.46 97.24 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 C-N-CA 123.736 0.814 . . . . 0.0 110.481 174.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt -56.68 -44.23 81.23 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 118.688 0.676 . . . . 0.0 112.401 -178.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 56.4 m -70.56 -47.14 61.75 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 122.672 0.389 . . . . 0.0 111.815 176.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 63.2 mt -61.48 -33.24 73.44 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 123.323 0.649 . . . . 0.0 112.199 179.09 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . 0.459 ' CZ3' ' HE3' ' A' ' 87' ' ' LYS . 21.3 t-105 -72.48 -29.18 63.42 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 125.655 1.582 . . . . 0.0 113.475 175.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt -82.04 -8.96 59.69 Favored 'General case' 0 N--CA 1.479 0.984 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 176.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 44.2 t-80 -62.17 152.76 32.21 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.638 1.175 . . . . 0.0 113.096 -178.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 22.6 tp60 -57.87 -19.84 32.24 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.487 1.515 . . . . 0.0 114.017 174.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 15.4 m-85 -122.9 16.09 10.08 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.709 1.604 . . . . 0.0 113.995 -173.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.34 -29.64 66.39 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 114.149 1.166 . . . . 0.0 114.149 178.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 39.8 p-90 -56.4 -37.31 56.12 Favored Pre-proline 0 CA--C 1.547 0.841 0 N-CA-C 117.079 2.252 . . . . 0.0 117.079 -171.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -67.95 -6.53 17.27 Favored 'Trans proline' 0 C--N 1.356 0.924 0 CA-C-N 122.997 2.106 . . . . 0.0 114.985 172.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -113.69 -3.08 13.6 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.424 1.489 . . . . 0.0 113.129 179.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.8 m-30 -63.76 -20.61 65.9 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 113.666 0.987 . . . . 0.0 113.666 176.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -140.65 157.32 68.2 Favored Pre-proline 0 CA--C 1.545 0.772 0 C-N-CA 126.683 1.993 . . . . 0.0 110.048 -177.541 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -65.08 153.46 78.18 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 122.608 2.205 . . . . 0.0 112.144 174.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 63.7 t -65.77 102.51 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 C-N-CA 124.179 0.992 . . . . 0.0 110.963 176.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 42.9 m-20 -74.58 86.76 2.11 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.627 1.171 . . . . 0.0 109.855 169.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -52.47 -25.75 11.02 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.408 1.262 . . . . 0.0 114.408 -177.041 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 80.7 mt -64.5 -50.58 75.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 125.207 1.403 . . . . 0.0 111.323 171.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 55.2 mttm -73.48 -40.64 63.95 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 125.277 1.431 . . . . 0.0 112.937 -178.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -74.36 -10.65 59.79 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.19 0.996 . . . . 0.0 113.406 173.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 60.3 t30 58.87 54.58 5.05 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 126.7 2.0 . . . . 0.0 112.865 177.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 48.4 mt -115.21 81.59 8.29 Favored Pre-proline 0 CA--C 1.545 0.788 0 C-N-CA 126.681 1.993 . . . . 0.0 110.147 -175.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -67.68 -5.78 15.11 Favored 'Trans proline' 0 CA--C 1.543 0.956 0 C-N-CA 124.154 3.236 . . . . 0.0 114.925 -171.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -128.92 15.47 6.33 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.895 1.678 . . . . 0.0 112.51 179.357 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 63.4 t80 -47.25 -55.14 9.2 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 113.987 1.106 . . . . 0.0 113.987 -172.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -74.28 -13.23 60.74 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.783 1.233 . . . . 0.0 114.207 -178.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.9 mmpt? -76.41 -33.12 58.83 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.622 1.169 . . . . 0.0 111.981 175.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.3 mp -91.84 -46.42 14.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 124.687 1.195 . . . . 0.0 110.67 172.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 35.7 mm -84.34 99.01 6.25 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 CA-C-O 122.148 0.975 . . . . 0.0 111.276 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.55 -38.44 87.45 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 126.172 1.789 . . . . 0.0 113.85 177.09 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 -142.52 87.25 9.36 Favored Pre-proline 0 CA--C 1.543 0.706 0 C-N-CA 125.055 1.342 . . . . 0.0 110.616 -176.03 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -68.4 141.98 53.05 Favored 'Trans proline' 0 CA--C 1.538 0.691 0 C-N-CA 123.668 2.912 . . . . 0.0 111.666 -176.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.8 tpt -156.25 134.89 11.68 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.498 1.119 . . . . 0.0 110.773 -171.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -147.68 152.87 38.55 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.518 1.527 . . . . 0.0 111.237 -176.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 6.6 ttp -58.01 -36.89 73.33 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.434 1.094 . . . . 0.0 113.62 -170.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -59.49 -29.66 66.94 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 124.497 1.046 . . . . 0.0 114.296 174.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 27.9 m -85.88 -31.31 22.28 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.282 1.033 . . . . 0.0 111.786 176.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 62.4 mt -60.57 -52.48 61.04 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 CA-C-N 118.887 0.767 . . . . 0.0 110.661 174.465 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.459 ' HE3' ' CZ3' ' A' ' 51' ' ' TRP . 17.0 ptpt -57.89 -32.84 68.12 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 178.523 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 2.8 tppp? -59.29 -38.55 80.45 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 178.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 5.6 ptp180 -86.46 -19.06 30.15 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 114.213 1.19 . . . . 0.0 114.213 175.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 52.9 mt -70.68 -48.15 56.28 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 119.061 0.846 . . . . 0.0 111.964 167.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -62.86 -14.27 44.01 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 115.076 1.51 . . . . 0.0 115.076 -171.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 46.2 p30 -124.25 14.04 8.98 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 126.141 1.776 . . . . 0.0 113.133 177.181 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . 0.269 6.3 p30 37.24 65.75 0.49 Allowed 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 127.149 2.18 . . . . 0.0 114.403 -174.043 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 74.1 t80 -59.29 -24.2 63.07 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.013 1.325 . . . . 0.0 114.097 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -132.42 -174.31 3.41 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 129.101 2.96 . . . . 0.0 111.863 -169.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 2.3 t-105 -112.67 -27.47 8.17 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.761 1.224 . . . . 0.0 113.382 -174.353 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 39.9 t -134.15 145.29 49.12 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.627 1.171 . . . . 0.0 111.773 -177.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -57.24 -18.86 18.01 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.837 1.655 . . . . 0.0 114.769 172.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 10.8 m -53.82 -32.89 54.42 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.206 1.002 . . . . 0.0 113.132 177.191 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -73.91 -42.61 60.4 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.214 1.006 . . . . 0.0 112.757 175.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 49.5 t -60.4 -40.75 92.06 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.271 1.028 . . . . 0.0 112.091 171.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 81.7 mtp -61.5 -41.59 97.52 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.099 0.96 . . . . 0.0 112.553 174.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -65.5 -34.04 77.34 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 174.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -67.26 -42.79 83.32 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 121.25 -0.907 . . . . 0.0 111.762 173.019 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -60.75 -45.86 92.67 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.254 -0.904 . . . . 0.0 112.599 172.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 35.5 t30 -55.62 -45.06 77.57 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.218 0.607 . . . . 0.0 111.678 173.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 88.7 m -62.69 -45.18 93.95 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.389 1.076 . . . . 0.0 112.149 179.104 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 12.7 ttm -55.69 -59.56 4.69 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.537 1.135 . . . . 0.0 112.453 177.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 -65.18 -34.98 79.66 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 121.98 -0.45 . . . . 0.0 112.136 -178.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 16.5 m -58.92 -51.77 68.62 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.322 1.049 . . . . 0.0 111.92 173.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -56.43 -40.08 74.16 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.773 0.829 . . . . 0.0 111.763 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 96.6 m -55.8 -50.72 69.73 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.3 0.64 . . . . 0.0 111.955 171.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -62.25 -26.59 68.47 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 114.07 1.137 . . . . 0.0 114.07 178.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 74.4 mt -73.63 -59.17 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 C-N-CA 123.75 0.82 . . . . 0.0 110.615 173.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -74.29 -46.42 41.28 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 -172.2 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -97.58 152.01 19.48 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.769 1.228 . . . . 0.0 111.305 -179.296 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 49.5 mmtm -81.9 155.87 70.17 Favored Pre-proline 0 N--CA 1.475 0.815 0 C-N-CA 125.343 1.457 . . . . 0.0 111.558 -175.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -62.95 -0.7 2.25 Favored 'Trans proline' 0 CA--C 1.543 0.973 0 C-N-CA 124.181 3.254 . . . . 0.0 115.759 -178.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 64.0 p -114.13 -4.23 13.15 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 126.878 2.071 . . . . 0.0 113.097 178.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 74.9 m-20 -76.24 142.74 41.33 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.038 0.836 . . . . 0.0 110.814 172.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -57.62 -46.27 84.31 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 121.49 -0.756 . . . . 0.0 112.299 -176.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.1 tp -53.63 -28.58 16.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 125.823 1.649 . . . . 0.0 114.629 175.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 55.8 t -75.66 -44.54 40.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 O-C-N 121.021 -1.049 . . . . 0.0 110.758 173.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 67.1 mt -61.11 -36.15 78.94 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 119.058 0.844 . . . . 0.0 111.579 174.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 10.4 mtt -58.9 -51.64 69.15 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.582 1.153 . . . . 0.0 111.972 169.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.27 -40.55 94.5 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.432 0.693 . . . . 0.0 112.536 177.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -61.36 -49.17 78.04 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.793 0.837 . . . . 0.0 111.664 174.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.87 -43.43 98.42 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.735 0.814 . . . . 0.0 112.495 179.419 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 87.2 mt -64.66 -45.79 85.22 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.593 0.757 . . . . 0.0 111.893 173.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -64.38 -36.42 84.08 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.056 -1.027 . . . . 0.0 113.352 -176.213 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 69.5 mttt -57.65 -49.23 77.16 Favored 'General case' 0 N--CA 1.478 0.937 0 O-C-N 121.453 -0.779 . . . . 0.0 111.179 173.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 89.9 mt -66.08 -43.37 92.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 123.918 0.887 . . . . 0.0 111.17 178.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -51.4 -53.3 38.1 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.741 0.816 . . . . 0.0 110.783 173.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 95.6 mt -61.69 -42.61 99.16 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.01 0.524 . . . . 0.0 112.392 177.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.61 -34.59 75.92 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-N 119.084 0.857 . . . . 0.0 113.072 178.506 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -74.69 -54.36 7.55 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.507 1.123 . . . . 0.0 112.401 175.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.9 m -64.94 -23.94 34.48 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 CA-C-N 120.306 1.412 . . . . 0.0 112.509 -178.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -59.29 -31.26 68.96 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 170.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 91.5 mt-30 -90.36 -11.75 39.68 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.016 1.326 . . . . 0.0 112.742 176.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 45.3 ttp -64.91 137.32 97.11 Favored Pre-proline 0 CA--C 1.546 0.792 0 CA-C-N 119.066 0.848 . . . . 0.0 110.571 174.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -66.65 130.9 24.52 Favored 'Trans proline' 0 CA--C 1.537 0.636 0 C-N-CA 122.911 2.407 . . . . 0.0 111.665 -179.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -68.52 -30.52 69.34 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.069 1.347 . . . . 0.0 112.45 178.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -76.35 158.83 31.08 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.655 1.582 . . . . 0.0 113.21 173.566 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -112.68 139.58 48.16 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 124.939 1.296 . . . . 0.0 110.499 177.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 10.2 p -143.97 134.62 21.36 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-O 122.245 1.021 . . . . 0.0 110.76 169.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 45.9 tt0 -64.28 128.85 37.6 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.412 1.885 . . . . 0.0 111.219 174.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 88.5 mt -75.06 145.37 42.39 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 113.208 0.818 . . . . 0.0 113.208 -177.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 4.4 pp -70.13 154.0 94.89 Favored Pre-proline 0 CA--C 1.551 0.998 0 C-N-CA 124.296 1.038 . . . . 0.0 111.718 169.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_endo -77.2 150.0 28.73 Favored 'Trans proline' 0 CA--C 1.546 1.111 0 C-N-CA 123.086 2.524 . . . . 0.0 112.346 -178.008 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -71.7 160.94 46.72 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 123.517 2.811 . . . . 0.0 112.561 177.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -64.9 145.84 98.89 Favored Pre-proline 0 CA--C 1.552 1.056 0 C-N-CA 123.712 0.805 . . . . 0.0 112.243 174.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -74.17 142.88 31.28 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.229 2.62 . . . . 0.0 112.475 -178.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -145.39 166.56 25.25 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 126.787 2.035 . . . . 0.0 110.803 175.106 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . -177.71 -7.16 0.02 OUTLIER Glycine 0 CA--C 1.541 1.663 0 N-CA-C 116.998 1.559 . . . . 0.0 116.998 179.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 86.4 tttt . . . . . 0 C--O 1.252 1.235 0 C-N-CA 126.006 1.722 . . . . 0.0 111.139 178.657 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.49 0 N-CA-C 111.78 -0.528 . . . . 0.0 111.78 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 19.7 m -74.51 39.24 0.12 Allowed 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 126.763 2.025 . . . . 0.0 114.885 -174.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.5 t 52.57 30.42 8.51 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 126.284 1.834 . . . . 0.0 114.7 -179.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 70.79 28.89 70.04 Favored Glycine 0 CA--C 1.537 1.437 0 O-C-N 121.025 -1.047 . . . . 0.0 114.887 179.562 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 65.4 p -52.65 138.15 29.22 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 125.339 1.456 . . . . 0.0 113.803 178.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 73.7 m -143.75 156.1 44.4 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.62 1.568 . . . . 0.0 111.744 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -176.36 34.7 0.09 OUTLIER Glycine 0 CA--C 1.534 1.25 0 C-N-CA 124.453 1.025 . . . . 0.0 113.885 -178.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.491 ' HG3' ' HH ' ' A' ' 94' ' ' TYR . 9.2 pt-20 -63.64 156.31 27.17 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 114.388 1.255 . . . . 0.0 114.388 -176.511 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 34.4 m -137.73 -17.8 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 C-N-CA 125.373 1.469 . . . . 0.0 113.988 -174.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.7 t -150.56 124.83 9.45 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 125.378 1.471 . . . . 0.0 109.875 177.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -155.81 122.12 2.63 Favored Pre-proline 0 CA--C 1.546 0.789 0 C-N-CA 124.511 1.124 . . . . 0.0 110.12 -172.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -77.04 -175.48 2.68 Favored 'Trans proline' 0 N--CA 1.454 -0.848 0 C-N-CA 123.938 3.092 . . . . 0.0 110.373 174.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 34.3 m 51.18 24.23 1.91 Allowed 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 126.14 1.776 . . . . 0.0 114.582 -170.059 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -130.03 134.43 26.13 Favored Pre-proline 0 N--CA 1.475 0.812 0 C-N-CA 127.374 2.269 . . . . 0.0 109.782 -178.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -70.47 143.26 46.92 Favored 'Trans proline' 0 CA--C 1.535 0.54 0 C-N-CA 122.596 2.198 . . . . 0.0 112.493 177.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 154.18 157.88 8.37 Favored Glycine 0 CA--C 1.529 0.962 0 C-N-CA 125.636 1.589 . . . . 0.0 112.279 177.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -172.22 165.55 6.01 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.965 1.706 . . . . 0.0 111.384 -174.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 26.1 pttm -67.11 139.44 57.52 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.013 0.925 . . . . 0.0 112.822 172.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 45.7 p -148.78 164.75 33.48 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 126.257 1.823 . . . . 0.0 110.582 178.152 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 23.7 p-10 -50.89 -39.24 53.68 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 178.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 66.8 mt-30 -72.62 -44.07 62.44 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 121.561 -0.712 . . . . 0.0 111.634 179.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 89.3 mt -64.22 -32.21 73.71 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 118.707 0.685 . . . . 0.0 111.99 174.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -61.18 -52.7 63.72 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-N 118.443 0.565 . . . . 0.0 109.924 168.521 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -55.09 -41.03 71.07 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.27 -0.894 . . . . 0.0 112.635 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 88.7 mmm -57.64 -56.43 22.04 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.878 -0.513 . . . . 0.0 112.042 170.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -77.19 -9.14 58.58 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 114.984 1.476 . . . . 0.0 114.984 -173.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -117.75 -23.63 7.51 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.353 1.461 . . . . 0.0 112.598 -169.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 18.7 t -127.53 -54.65 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 C-N-CA 123.429 0.692 . . . . 0.0 111.295 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.6 t -64.23 -59.95 3.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 CA-C-N 118.446 0.567 . . . . 0.0 110.652 -174.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 72.1 t -59.36 -46.38 92.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 124.457 1.103 . . . . 0.0 110.664 174.319 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 36.0 ttmt -57.39 -49.77 75.13 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.278 0.631 . . . . 0.0 112.357 -174.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 61.5 m -67.1 -43.85 81.45 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 118.599 0.636 . . . . 0.0 112.089 176.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 82.9 mt -62.28 -35.18 78.21 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 119.021 0.828 . . . . 0.0 112.481 178.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 20.7 t-105 -72.17 -27.09 62.36 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.76 1.624 . . . . 0.0 113.385 175.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.1 mtmp? -85.94 -4.47 59.17 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 177.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 39.7 t-80 -63.93 156.44 27.76 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.98 1.312 . . . . 0.0 113.185 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -57.77 -23.28 51.43 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.503 1.521 . . . . 0.0 113.638 173.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 -123.0 18.93 10.08 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.345 1.458 . . . . 0.0 114.137 -171.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.11 -26.34 63.92 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 176.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 58.9 p-90 -59.22 -35.92 36.41 Favored Pre-proline 0 CA--C 1.547 0.836 0 N-CA-C 117.978 2.585 . . . . 0.0 117.978 -169.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -74.52 -3.5 13.96 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 CA-C-N 123.277 2.206 . . . . 0.0 113.691 173.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 55.9 m-85 -110.3 -5.27 15.3 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.428 1.491 . . . . 0.0 113.14 178.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -62.84 -16.16 57.38 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 179.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -142.18 155.59 64.91 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 125.969 1.708 . . . . 0.0 110.389 -177.206 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -64.48 144.0 83.81 Favored 'Trans proline' 0 CA--C 1.538 0.677 0 C-N-CA 122.641 2.227 . . . . 0.0 111.713 173.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 76.5 t -60.6 115.58 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 123.546 0.738 . . . . 0.0 111.261 175.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 57.9 m-20 -92.44 103.89 16.27 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.249 1.02 . . . . 0.0 109.019 169.146 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.55 -30.08 60.12 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 113.418 0.896 . . . . 0.0 113.418 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 81.9 mt -65.03 -49.88 77.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 124.85 1.26 . . . . 0.0 111.155 174.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -63.84 -37.3 86.89 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.819 1.248 . . . . 0.0 113.403 -177.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.4 mp -89.68 -1.76 58.1 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.231 1.413 . . . . 0.0 112.36 178.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 23.0 m120 52.78 52.64 13.57 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 126.162 1.785 . . . . 0.0 113.264 -177.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 29.1 mt -107.71 94.28 11.91 Favored Pre-proline 0 CA--C 1.544 0.713 0 C-N-CA 126.26 1.824 . . . . 0.0 109.767 -179.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -68.72 -13.81 37.85 Favored 'Trans proline' 0 CA--C 1.542 0.877 0 C-N-CA 123.084 2.523 . . . . 0.0 114.55 -170.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 -136.65 21.05 3.1 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.573 1.549 . . . . 0.0 112.921 -173.437 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 64.7 t80 -46.14 -50.49 15.45 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.338 1.055 . . . . 0.0 113.827 -175.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 98.8 m-70 -73.48 -17.81 61.19 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 114.454 1.279 . . . . 0.0 114.454 -177.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 43.7 mttp -68.15 -39.53 82.63 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 119.343 0.974 . . . . 0.0 111.855 174.339 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.2 mp -81.37 -46.11 20.46 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 C-N-CA 124.8 1.24 . . . . 0.0 110.288 175.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 49.4 mm -98.57 98.48 7.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 CA-C-O 122.224 1.011 . . . . 0.0 111.353 -176.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.94 -32.5 74.06 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 126.397 1.879 . . . . 0.0 113.868 177.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -141.2 75.78 22.82 Favored Pre-proline 0 CA--C 1.542 0.664 0 C-N-CA 125.259 1.423 . . . . 0.0 110.559 -171.317 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -67.08 142.35 61.17 Favored 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 124.174 3.249 . . . . 0.0 111.289 -178.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 8.1 tpt -158.09 136.21 10.8 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.61 1.164 . . . . 0.0 110.221 -170.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -145.98 149.94 35.11 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.929 1.292 . . . . 0.0 111.563 -176.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.4 ttp -57.99 -37.01 73.45 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.667 1.187 . . . . 0.0 113.079 -171.052 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -61.7 -26.1 66.4 Favored Glycine 0 CA--C 1.533 1.178 0 C-N-CA 125.02 1.295 . . . . 0.0 114.597 174.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 20.2 m -82.74 -41.73 18.88 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.178 0.991 . . . . 0.0 110.708 170.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 68.4 mt -56.02 -51.9 56.23 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 124.114 0.966 . . . . 0.0 111.39 179.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.9 -35.68 71.38 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 113.291 0.848 . . . . 0.0 113.291 176.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -69.39 -34.34 74.37 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.089 0.956 . . . . 0.0 113.409 -177.301 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 4.9 ptp180 -76.89 -30.59 56.25 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 170.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 74.5 mt -63.9 -37.4 87.27 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 119.643 1.111 . . . . 0.0 113.011 168.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -75.87 8.55 2.99 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.495 1.518 . . . . 0.0 114.087 177.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 37.0 m-80 -137.3 167.07 22.31 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.652 1.981 . . . . 0.0 111.952 -179.564 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 5.4 p30 -80.62 111.49 17.1 Favored 'General case' 0 CA--C 1.545 0.75 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 168.025 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . 0.491 ' HH ' ' HG3' ' A' ' 25' ' ' GLU . 56.2 t80 -148.25 -38.12 0.18 Allowed 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.864 0.691 . . . . 0.0 112.864 -171.447 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -138.56 173.12 11.92 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.35 1.86 . . . . 0.0 111.365 169.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.4 t-105 -108.86 -20.33 13.09 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 125.293 1.437 . . . . 0.0 112.162 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 40.5 t -130.34 138.48 50.45 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 126.087 1.755 . . . . 0.0 111.623 -171.132 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -65.92 -17.08 64.42 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 114.968 1.47 . . . . 0.0 114.968 178.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 35.6 p -53.18 -26.92 19.02 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.073 1.349 . . . . 0.0 114.019 172.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 53.7 mm-40 -80.54 -41.89 23.37 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.213 1.005 . . . . 0.0 111.999 177.032 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 52.0 t -60.37 -41.8 94.51 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.417 -0.802 . . . . 0.0 111.994 169.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 88.8 mtp -60.07 -43.88 95.13 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 121.305 -0.872 . . . . 0.0 112.827 175.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -72.06 -28.3 63.25 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 179.13 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 -66.32 -44.33 83.68 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.217 -0.927 . . . . 0.0 111.071 169.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -58.5 -47.53 83.78 Favored 'General case' 0 CA--C 1.539 0.519 0 O-C-N 121.273 -0.892 . . . . 0.0 112.422 172.225 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -61.55 -39.3 90.61 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 118.635 0.652 . . . . 0.0 111.724 177.225 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 89.2 m -63.61 -44.71 93.18 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.88 0.872 . . . . 0.0 111.972 176.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 52.0 ttp -56.67 -52.7 63.9 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.011 0.924 . . . . 0.0 112.675 176.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -68.48 -34.42 75.9 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 17.5 m -59.34 -52.05 67.31 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.295 1.038 . . . . 0.0 111.807 173.197 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 -57.48 -37.43 72.91 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.89 0.876 . . . . 0.0 112.193 -178.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 94.6 m -57.11 -44.12 82.97 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.18 0.992 . . . . 0.0 112.188 173.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -69.65 -30.05 67.66 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.393 1.077 . . . . 0.0 113.68 176.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 82.3 mt -74.26 -57.57 6.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 123.476 0.711 . . . . 0.0 110.747 178.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 37.4 t80 -68.11 -30.25 69.36 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 114.068 1.136 . . . . 0.0 114.068 -173.132 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 37.9 m-80 -113.74 162.92 15.69 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.981 0.912 . . . . 0.0 112.803 -169.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -68.6 148.12 98.06 Favored Pre-proline 0 N--CA 1.472 0.633 0 C-N-CA 124.635 1.174 . . . . 0.0 110.321 175.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -65.85 -6.89 15.18 Favored 'Trans proline' 0 CA--C 1.544 1.016 0 C-N-CA 123.718 2.945 . . . . 0.0 114.654 -176.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 53.9 p -114.3 -0.48 13.85 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 126.686 1.994 . . . . 0.0 113.199 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -66.3 147.2 53.66 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 121.528 -0.732 . . . . 0.0 110.967 173.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -52.56 -47.79 66.58 Favored 'General case' 0 CA--C 1.536 0.432 0 O-C-N 121.562 -0.711 . . . . 0.0 112.422 179.154 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.2 tp -58.37 -30.31 40.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -179.224 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 41.0 t -71.56 -47.43 58.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 O-C-N 121.499 -0.751 . . . . 0.0 110.332 173.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 76.1 mt -61.86 -36.73 82.09 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.124 0.875 . . . . 0.0 111.844 177.409 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 13.5 mtt -59.15 -51.53 69.63 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 124.638 1.175 . . . . 0.0 111.936 170.025 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.94 -39.07 90.82 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.265 0.626 . . . . 0.0 112.675 177.257 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 88.4 mt-30 -61.33 -47.76 84.42 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 119.121 0.873 . . . . 0.0 111.826 173.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -61.61 -45.59 93.44 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.73 0.812 . . . . 0.0 112.48 178.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 83.5 mt -65.91 -44.72 84.38 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.761 0.824 . . . . 0.0 112.268 175.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -65.08 -36.19 83.54 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 120.972 -1.08 . . . . 0.0 112.755 -177.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 55.0 mtmt -58.68 -45.5 89.3 Favored 'General case' 0 N--CA 1.474 0.746 0 O-C-N 121.5 -0.75 . . . . 0.0 111.701 172.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 93.2 mt -66.86 -43.51 89.54 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 123.507 0.723 . . . . 0.0 110.927 176.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -51.69 -51.42 56.12 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.757 0.823 . . . . 0.0 111.136 173.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 91.9 mt -61.98 -41.77 98.39 Favored 'General case' 0 CA--C 1.541 0.603 0 O-C-N 121.738 -0.601 . . . . 0.0 112.573 178.015 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 91.2 mm-40 -61.44 -36.47 80.49 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 119.392 0.997 . . . . 0.0 113.173 174.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 66.9 mmtt -72.62 -51.57 19.09 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.973 0.909 . . . . 0.0 112.435 177.311 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 6.0 m -67.98 -24.85 30.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 CA-C-N 120.333 1.424 . . . . 0.0 112.352 179.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -59.14 -27.19 65.39 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.535 -0.728 . . . . 0.0 112.833 171.18 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -99.84 2.22 43.7 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.539 1.536 . . . . 0.0 112.427 178.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 11.2 ttm -55.7 141.05 66.21 Favored Pre-proline 0 CA--C 1.548 0.869 0 C-N-CA 124.671 1.188 . . . . 0.0 111.824 172.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -67.24 122.15 9.38 Favored 'Trans proline' 0 CA--C 1.538 0.68 0 C-N-CA 122.996 2.464 . . . . 0.0 109.566 169.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -70.63 -17.99 62.87 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -171.453 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 9.8 mp0 -94.39 159.58 15.05 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.551 1.54 . . . . 0.0 111.941 179.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -120.96 129.81 53.59 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.113 1.365 . . . . 0.0 110.856 -175.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 9.5 p -152.63 151.41 11.87 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 124.624 1.17 . . . . 0.0 112.338 -179.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -57.24 137.91 55.38 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.55 1.54 . . . . 0.0 112.619 169.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 52.0 mt -78.32 139.27 38.84 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.486 0.714 . . . . 0.0 112.444 169.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 4.5 pp -75.52 153.99 85.68 Favored Pre-proline 0 CA--C 1.552 1.032 0 C-N-CA 123.885 0.874 . . . . 0.0 111.237 168.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 80.9 Cg_endo -76.79 151.16 31.45 Favored 'Trans proline' 0 CA--C 1.546 1.078 0 C-N-CA 123.177 2.585 . . . . 0.0 112.132 -178.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -71.99 157.64 54.16 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 123.258 2.639 . . . . 0.0 112.648 -179.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -71.81 154.14 92.92 Favored Pre-proline 0 CA--C 1.552 1.041 0 C-N-CA 124.371 1.069 . . . . 0.0 112.742 175.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -71.88 170.97 17.52 Favored 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 123.587 2.858 . . . . 0.0 112.403 171.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 49.1 mmtm -60.2 152.59 24.25 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.585 1.154 . . . . 0.0 112.609 174.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . -93.03 -173.63 40.76 Favored Glycine 0 CA--C 1.536 1.381 0 C-N-CA 125.101 1.334 . . . . 0.0 114.116 179.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.252 1.194 0 C-N-CA 125.707 1.603 . . . . 0.0 112.961 176.039 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.491 0 N-CA-C 111.222 -0.751 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 24.5 t -151.19 68.48 0.93 Allowed 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.023 1.329 . . . . 0.0 111.203 -177.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.2 t -142.53 166.71 23.91 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 125.195 1.398 . . . . 0.0 111.845 -178.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 78.52 -32.66 1.85 Allowed Glycine 0 CA--C 1.538 1.507 0 C-N-CA 125.917 1.722 . . . . 0.0 115.471 177.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 66.9 m -74.41 -35.97 63.46 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 118.407 1.104 . . . . 0.0 112.512 174.325 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.4 m -74.43 152.23 39.51 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.638 1.175 . . . . 0.0 111.335 170.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 76.63 38.03 33.35 Favored Glycine 0 CA--C 1.534 1.26 0 O-C-N 121.843 -0.535 . . . . 0.0 112.377 -173.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.7 pm0 -53.67 157.94 2.07 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.919 1.688 . . . . 0.0 114.033 178.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 20.8 m -94.37 -14.27 8.14 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 C-N-CA 124.429 1.092 . . . . 0.0 113.763 -170.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.7 t -133.95 155.37 50.05 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.363 1.465 . . . . 0.0 111.536 -176.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 17.6 p-10 -121.99 102.2 41.1 Favored Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 125.617 1.567 . . . . 0.0 112.617 -168.425 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -73.75 -25.61 14.43 Favored 'Trans proline' 0 CA--C 1.543 0.948 0 C-N-CA 122.651 2.234 . . . . 0.0 113.155 173.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 42.2 m -141.82 -24.92 0.69 Allowed 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 115.165 1.543 . . . . 0.0 115.165 -174.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 25.1 ttmm -63.66 131.71 94.96 Favored Pre-proline 0 N--CA 1.478 0.964 0 CA-C-N 119.507 1.049 . . . . 0.0 110.907 177.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -74.14 155.11 47.22 Favored 'Trans proline' 0 CA--C 1.54 0.778 0 C-N-CA 123.011 2.474 . . . . 0.0 112.849 -178.251 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 171.2 173.41 38.21 Favored Glycine 0 CA--C 1.534 1.232 0 C-N-CA 125.5 1.524 . . . . 0.0 112.056 178.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 37.7 ptt180 -155.11 156.8 36.45 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.569 1.548 . . . . 0.0 110.74 172.074 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 36.3 mtpt -76.02 143.16 41.61 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 121.285 0.564 . . . . 0.0 110.053 168.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 67.0 p -139.45 165.41 27.31 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 125.134 1.373 . . . . 0.0 109.953 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 27.1 p-10 -52.49 -31.33 34.58 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 171.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.5 mm100 -67.91 -50.43 56.25 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.775 0.83 . . . . 0.0 111.377 176.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.0 mt -65.51 -32.65 74.37 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.736 -0.603 . . . . 0.0 112.519 175.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -61.6 -50.63 71.82 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 118.341 0.518 . . . . 0.0 110.77 169.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 65.4 t80 -57.61 -41.26 80.91 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.624 0.77 . . . . 0.0 112.313 178.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 91.0 mmm -56.91 -50.41 72.65 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 121.886 -0.509 . . . . 0.0 112.115 171.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -83.2 -10.07 58.8 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.704 1.372 . . . . 0.0 114.704 -174.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 61.9 t30 -119.79 -15.87 8.82 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.196 1.399 . . . . 0.0 113.297 -169.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 42.0 t -130.28 -53.56 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 C-N-CA 123.281 0.632 . . . . 0.0 110.96 176.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.6 t -69.83 -65.72 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 123.119 0.568 . . . . 0.0 110.77 -172.033 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 79.4 t -57.19 -46.0 84.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 124.398 1.079 . . . . 0.0 110.368 173.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.8 tttt -59.84 -40.05 87.19 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.386 0.674 . . . . 0.0 112.734 -175.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 62.7 m -73.85 -45.45 50.99 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 118.343 0.52 . . . . 0.0 111.801 174.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 67.9 mt -62.03 -33.46 74.41 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.295 0.638 . . . . 0.0 112.388 179.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 25.0 t-105 -69.46 -31.26 69.44 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.428 1.491 . . . . 0.0 113.188 175.085 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 56.4 mtmt -82.49 -5.34 58.65 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 113.692 0.997 . . . . 0.0 113.692 176.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 39.4 t-80 -64.22 156.38 28.92 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.6 1.16 . . . . 0.0 113.401 -179.023 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 19.2 mm100 -59.69 -23.27 62.98 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.241 1.416 . . . . 0.0 114.104 175.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -124.65 20.22 8.6 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.214 1.406 . . . . 0.0 113.48 -172.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.64 -26.59 64.49 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.102 1.361 . . . . 0.0 113.958 176.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 64.1 p-90 -58.87 -34.16 22.22 Favored Pre-proline 0 CA--C 1.547 0.84 0 N-CA-C 117.875 2.546 . . . . 0.0 117.875 -169.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -77.75 -0.18 10.4 Favored 'Trans proline' 0 CA--C 1.544 0.994 0 CA-C-N 123.213 2.183 . . . . 0.0 113.387 175.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -114.63 -3.67 12.88 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.759 1.624 . . . . 0.0 113.158 178.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 18.4 m-30 -62.68 -7.52 5.0 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 115.276 1.584 . . . . 0.0 115.276 179.443 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 25.1 pt20 -159.66 157.98 26.89 Favored Pre-proline 0 CA--C 1.545 0.773 0 C-N-CA 126.188 1.795 . . . . 0.0 110.009 -169.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -66.08 142.25 67.14 Favored 'Trans proline' 0 CA--C 1.538 0.676 0 C-N-CA 122.702 2.268 . . . . 0.0 111.731 177.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 68.1 t -60.3 139.0 20.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 123.859 0.864 . . . . 0.0 111.322 173.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 50.6 m-20 -114.4 107.09 15.09 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.079 1.352 . . . . 0.0 109.497 169.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.32 -26.89 63.59 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.148 0.979 . . . . 0.0 113.419 177.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 80.3 mt -66.56 -50.17 68.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 124.979 1.311 . . . . 0.0 110.864 173.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -64.56 -40.66 95.98 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.547 1.139 . . . . 0.0 112.695 -178.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 47.7 mt -88.78 -0.76 57.63 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.555 1.142 . . . . 0.0 114.007 179.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 61.0 t30 52.28 58.07 5.8 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.019 1.728 . . . . 0.0 113.68 -179.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 54.2 mt -114.42 83.21 8.32 Favored Pre-proline 0 CA--C 1.547 0.842 0 C-N-CA 126.331 1.852 . . . . 0.0 110.089 -176.074 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -67.79 -7.44 19.53 Favored 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 124.207 3.271 . . . . 0.0 115.456 -169.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -130.38 19.04 5.31 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.774 1.63 . . . . 0.0 112.257 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 70.4 t80 -46.96 -56.44 6.39 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.496 1.118 . . . . 0.0 113.526 -173.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -76.23 -3.07 34.44 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 114.608 1.336 . . . . 0.0 114.608 -179.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -84.1 -42.0 16.53 Favored 'General case' 0 N--CA 1.477 0.879 0 O-C-N 121.127 -0.983 . . . . 0.0 110.855 173.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.2 mp -81.67 -51.04 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 124.103 0.961 . . . . 0.0 110.408 173.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 44.2 mm -71.92 114.47 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 CA-C-O 121.556 0.693 . . . . 0.0 110.142 178.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 70.6 mmtt -83.85 -27.93 28.37 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.619 1.168 . . . . 0.0 113.045 179.595 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 21.4 p30 -153.16 81.63 5.05 Favored Pre-proline 0 CA--C 1.548 0.866 0 C-N-CA 126.09 1.756 . . . . 0.0 111.326 -170.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -69.17 138.11 38.86 Favored 'Trans proline' 0 CA--C 1.54 0.791 0 C-N-CA 123.498 2.799 . . . . 0.0 111.097 -179.126 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.8 tpt -154.59 141.19 18.91 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.236 1.414 . . . . 0.0 110.03 -178.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -144.68 148.14 33.87 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.397 1.479 . . . . 0.0 111.139 -177.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.6 ttp -57.19 -36.2 70.55 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.903 1.281 . . . . 0.0 113.3 -172.216 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.89 -22.82 60.54 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 125.127 1.346 . . . . 0.0 114.603 173.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 24.5 m -97.12 -34.59 11.09 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.846 1.258 . . . . 0.0 111.425 174.229 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 81.4 mt -53.94 -50.93 50.08 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 CA-C-N 119.31 0.959 . . . . 0.0 110.569 173.145 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -61.88 -32.5 72.87 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 178.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.408 ' HA ' ' HE3' ' A' ' 88' ' ' LYS . 1.1 tpmt? -68.78 -31.9 71.26 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -175.238 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 3.8 ptp180 -78.08 -26.45 48.17 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 113.941 1.089 . . . . 0.0 113.941 170.041 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 82.2 mt -70.66 -31.45 68.38 Favored 'General case' 0 N--CA 1.481 1.092 0 CA-C-N 119.648 1.113 . . . . 0.0 113.037 168.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -68.18 3.61 1.58 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.401 1.48 . . . . 0.0 113.476 171.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -130.74 163.18 27.85 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 127.685 2.394 . . . . 0.0 110.484 175.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -83.31 37.5 0.56 Allowed 'General case' 0 CA--C 1.55 0.966 0 O-C-N 120.834 -1.166 . . . . 0.0 111.581 169.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -60.76 -32.14 71.46 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.088 1.355 . . . . 0.0 114.32 -168.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -132.99 175.88 8.98 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 127.602 2.361 . . . . 0.0 111.057 178.199 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 9.7 t-105 -100.95 -25.91 13.92 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.893 1.277 . . . . 0.0 112.886 -178.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 34.7 t -143.77 148.64 35.91 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.287 1.035 . . . . 0.0 112.82 -170.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -65.36 -18.8 65.6 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 115.991 1.848 . . . . 0.0 115.991 -174.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 32.6 t -56.08 -32.48 64.16 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.398 0.999 . . . . 0.0 112.603 178.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -63.53 -45.97 88.13 Favored 'General case' 0 CA--C 1.544 0.727 0 O-C-N 121.272 -0.892 . . . . 0.0 112.264 173.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 48.8 t -65.28 -37.1 86.13 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.869 0.868 . . . . 0.0 112.602 174.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 82.5 mtp -65.65 -40.47 92.51 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.724 0.81 . . . . 0.0 111.881 175.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -62.1 -39.8 93.72 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.369 0.668 . . . . 0.0 112.076 170.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 85.2 m-20 -64.28 -39.58 94.23 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.366 0.985 . . . . 0.0 112.73 175.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -61.01 -46.98 88.54 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.5 -0.75 . . . . 0.0 112.315 170.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 17.5 t30 -56.63 -45.25 81.66 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.084 0.553 . . . . 0.0 111.893 174.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 52.3 m -62.51 -40.36 96.47 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.381 1.072 . . . . 0.0 112.687 175.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 53.1 ttp -59.52 -52.32 66.09 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 119.708 1.14 . . . . 0.0 112.061 177.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -68.45 -39.81 81.32 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 179.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 85.6 m -64.72 -47.55 77.89 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.588 0.755 . . . . 0.0 112.037 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -64.69 -31.94 73.39 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 119.024 0.829 . . . . 0.0 112.121 -179.551 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 81.3 m -61.66 -43.44 98.86 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.816 0.846 . . . . 0.0 112.794 170.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -68.02 -32.2 72.41 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.929 1.085 . . . . 0.0 113.929 178.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 92.3 mt -64.38 -57.63 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 C-N-CA 123.471 0.708 . . . . 0.0 110.994 177.21 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 31.0 t80 -68.79 -35.94 77.65 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 114.375 1.25 . . . . 0.0 114.375 -172.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 64.1 m-80 -103.98 159.84 15.33 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.804 0.841 . . . . 0.0 113.164 -169.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 3.4 mppt? -66.0 148.44 98.34 Favored Pre-proline 0 N--CA 1.472 0.667 0 C-N-CA 124.187 0.995 . . . . 0.0 110.523 172.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -65.37 -7.8 16.96 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 123.563 2.842 . . . . 0.0 114.567 -177.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 69.5 p -115.53 1.79 13.69 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 126.473 1.909 . . . . 0.0 113.108 179.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -65.89 143.73 57.26 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 121.491 -0.756 . . . . 0.0 110.509 173.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -52.59 -45.62 66.59 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.633 -0.667 . . . . 0.0 112.526 -178.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 9.5 tp -56.55 -34.7 42.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 124.637 1.175 . . . . 0.0 113.885 177.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 55.7 t -71.49 -42.52 72.71 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 C-N-CA 123.403 0.681 . . . . 0.0 110.65 175.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 66.5 mt -62.37 -36.24 81.65 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.099 0.863 . . . . 0.0 111.917 175.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -58.11 -53.45 58.11 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 118.298 0.499 . . . . 0.0 110.919 170.597 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -59.39 -41.43 89.35 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 123.745 0.818 . . . . 0.0 112.399 179.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -61.16 -39.9 91.84 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.999 0.92 . . . . 0.0 113.12 175.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -79.13 -31.57 44.17 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 85.1 mt -71.02 -46.4 62.2 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.351 0.66 . . . . 0.0 111.297 170.053 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -63.31 -38.04 89.6 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 121.102 -0.999 . . . . 0.0 113.244 -173.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 4.9 ptpp? -60.14 -39.36 86.06 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 121.456 -0.778 . . . . 0.0 112.543 175.136 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 78.4 mt -73.18 -41.2 58.53 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 C-N-CA 124.193 0.997 . . . . 0.0 111.518 175.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -50.96 -52.14 45.51 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 119.162 0.892 . . . . 0.0 110.438 172.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.3 mt -63.63 -40.1 96.03 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 118.558 -0.734 . . . . 0.0 112.909 177.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -68.43 -30.56 69.48 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 120.373 1.442 . . . . 0.0 112.657 179.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 69.0 mmtt -75.94 -48.19 22.19 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 117.89 -1.052 . . . . 0.0 112.301 176.122 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.9 m -67.84 -25.79 33.33 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 CA-C-N 120.765 1.62 . . . . 0.0 112.04 176.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -62.19 -30.53 71.13 Favored 'General case' 0 CA--C 1.541 0.609 0 O-C-N 121.492 -0.755 . . . . 0.0 112.477 171.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -91.29 -3.26 57.02 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.062 1.345 . . . . 0.0 112.913 176.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 5.9 ttm -57.0 141.2 76.5 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 124.152 0.981 . . . . 0.0 111.271 171.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -63.05 144.23 92.31 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 C-N-CA 122.494 2.129 . . . . 0.0 109.911 168.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -74.87 -23.46 58.4 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 114.239 1.199 . . . . 0.0 114.239 -179.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -100.04 155.25 17.82 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.636 1.574 . . . . 0.0 113.024 -169.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -112.79 137.1 51.62 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.962 1.705 . . . . 0.0 111.229 -174.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 12.7 p -146.62 141.18 20.69 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 C-N-CA 124.657 1.183 . . . . 0.0 110.735 172.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -68.52 134.71 50.47 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.509 1.124 . . . . 0.0 111.074 175.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 96.0 mt -69.74 138.81 53.13 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 -175.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 4.5 pp -64.04 153.46 84.93 Favored Pre-proline 0 CA--C 1.55 0.965 0 C-N-CA 124.72 1.208 . . . . 0.0 112.059 169.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -75.08 149.68 36.74 Favored 'Trans proline' 0 CA--C 1.543 0.968 0 C-N-CA 123.064 2.51 . . . . 0.0 111.824 -178.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -70.63 157.84 57.53 Favored 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 123.116 2.544 . . . . 0.0 112.091 179.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -66.72 149.88 97.96 Favored Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 123.283 0.633 . . . . 0.0 111.496 171.226 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -68.21 155.19 70.31 Favored 'Trans proline' 0 CA--C 1.54 0.809 0 C-N-CA 122.651 2.234 . . . . 0.0 111.608 176.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -116.24 34.3 5.08 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 125.632 1.573 . . . . 0.0 111.974 -175.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . -65.05 173.43 18.73 Favored Glycine 0 CA--C 1.538 1.472 0 C-N-CA 125.597 1.57 . . . . 0.0 114.275 176.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.252 1.22 0 C-N-CA 126.252 1.821 . . . . 0.0 111.325 -174.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.421 0 N-CA-C 111.851 -0.5 . . . . 0.0 111.851 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 83.7 p -153.53 171.69 18.34 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.075 1.35 . . . . 0.0 112.32 -178.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 45.9 m -157.76 146.81 19.6 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.795 1.638 . . . . 0.0 110.495 171.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 158.04 -161.47 31.56 Favored Glycine 0 CA--C 1.53 1.0 0 C-N-CA 124.889 1.233 . . . . 0.0 112.378 -174.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 34.4 m -154.22 147.72 25.11 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.635 1.174 . . . . 0.0 111.359 170.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 68.2 m -139.84 19.84 2.49 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 126.101 1.761 . . . . 0.0 112.183 177.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -168.93 57.92 0.2 Allowed Glycine 0 CA--C 1.529 0.916 0 C-N-CA 125.7 1.619 . . . . 0.0 111.341 -171.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.7 pm0 -53.33 162.41 0.76 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.393 1.877 . . . . 0.0 114.926 177.14 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 32.2 m -128.16 -16.84 2.47 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.238 0 C-N-CA 124.494 1.117 . . . . 0.0 113.705 -179.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 62.5 p -139.48 167.05 22.96 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 126.61 1.964 . . . . 0.0 111.204 -175.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 14.5 p30 -139.66 154.3 71.03 Favored Pre-proline 0 CA--C 1.545 0.759 0 C-N-CA 124.483 1.113 . . . . 0.0 112.543 -171.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -77.09 -42.3 0.31 Allowed 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 123.339 2.692 . . . . 0.0 112.177 169.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.1 m -153.18 90.93 1.47 Allowed 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.678 1.591 . . . . 0.0 111.792 -173.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 62.3 tttp -152.11 134.58 8.78 Favored Pre-proline 0 N--CA 1.477 0.887 0 C-N-CA 126.09 1.756 . . . . 0.0 109.847 173.259 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -71.07 148.52 56.78 Favored 'Trans proline' 0 CA--C 1.536 0.607 0 C-N-CA 122.519 2.146 . . . . 0.0 112.531 -178.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 168.81 158.12 12.36 Favored Glycine 0 CA--C 1.531 1.038 0 C-N-CA 123.991 0.805 . . . . 0.0 114.474 177.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 -162.9 163.55 26.3 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 127.65 2.38 . . . . 0.0 109.586 170.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.8 ttmm -73.0 142.57 47.74 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 122.907 0.483 . . . . 0.0 111.634 177.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 82.6 p -138.7 165.16 27.68 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.935 1.694 . . . . 0.0 109.51 -179.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 22.2 t30 -51.36 -31.43 22.11 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 114.168 1.173 . . . . 0.0 114.168 174.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 69.3 mt-30 -74.84 -48.79 23.23 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.166 -0.959 . . . . 0.0 112.791 174.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 89.1 mt -61.95 -31.43 71.77 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 120.331 1.423 . . . . 0.0 112.479 173.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.5 tp60 -60.8 -52.67 64.09 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.107 0.963 . . . . 0.0 110.906 170.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 83.5 t80 -55.83 -41.95 75.02 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.088 0.955 . . . . 0.0 112.446 176.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 87.9 mmm -55.21 -53.99 49.0 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 122.685 0.394 . . . . 0.0 111.267 172.066 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -70.67 -22.93 62.43 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 114.833 1.42 . . . . 0.0 114.833 -178.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 18.8 m-80 -108.04 -17.23 14.09 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 115.074 1.509 . . . . 0.0 115.074 -168.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.6 t -138.83 -41.08 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 CA-C-N 119.078 0.854 . . . . 0.0 112.036 -176.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 11.9 t -71.62 -69.96 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 176.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 69.5 t -58.36 -48.63 84.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 126.138 1.775 . . . . 0.0 111.495 177.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 70.2 tttt -56.54 -43.43 79.86 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.491 0.716 . . . . 0.0 112.884 -171.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 60.4 m -85.28 -34.93 21.81 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.327 0.651 . . . . 0.0 112.455 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 68.6 mt -59.65 -32.85 70.83 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 119.629 1.104 . . . . 0.0 111.712 169.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 29.3 t-105 -73.14 -34.41 66.07 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 126.048 1.739 . . . . 0.0 113.162 175.068 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp -76.03 -11.17 59.9 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.554 1.142 . . . . 0.0 113.982 174.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 55.7 t-80 -61.23 150.83 33.36 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.168 1.387 . . . . 0.0 113.181 -178.188 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -60.37 -20.94 61.41 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.014 1.326 . . . . 0.0 113.727 178.357 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -116.06 16.81 16.01 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.535 1.534 . . . . 0.0 113.643 -178.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.67 -29.85 65.06 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 113.979 1.103 . . . . 0.0 113.979 177.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 68.1 p-90 -57.67 -34.05 22.65 Favored Pre-proline 0 CA--C 1.548 0.9 0 N-CA-C 118.019 2.6 . . . . 0.0 118.019 -170.334 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -75.51 -4.78 15.75 Favored 'Trans proline' 0 CA--C 1.543 0.966 0 CA-C-N 123.598 2.321 . . . . 0.0 113.408 174.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -108.16 -4.52 17.59 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.38 1.472 . . . . 0.0 112.968 178.195 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.7 m-30 -64.47 -17.89 64.27 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 114.011 1.115 . . . . 0.0 114.011 179.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 7.7 mp0 -139.36 155.06 72.31 Favored Pre-proline 0 CA--C 1.544 0.747 0 C-N-CA 125.726 1.611 . . . . 0.0 110.203 -176.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -65.68 141.56 66.77 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 122.252 1.968 . . . . 0.0 111.888 174.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 50.7 t -56.93 145.54 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 124.561 1.144 . . . . 0.0 111.627 172.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -121.64 120.57 35.13 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 124.55 1.14 . . . . 0.0 110.049 169.708 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.55 -31.28 70.39 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 123.2 0.6 . . . . 0.0 112.59 178.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 81.8 mt -67.37 -49.69 69.38 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 C-N-CA 124.525 1.13 . . . . 0.0 110.923 173.552 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm -64.34 -39.35 93.72 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.219 1.408 . . . . 0.0 113.445 -176.296 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.4 mp -90.93 0.57 57.48 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.249 1.02 . . . . 0.0 113.058 177.233 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 65.9 t30 54.18 53.91 10.33 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 126.001 1.721 . . . . 0.0 113.636 -179.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 52.6 mt -111.51 95.31 26.39 Favored Pre-proline 0 CA--C 1.546 0.797 0 C-N-CA 126.415 1.886 . . . . 0.0 110.212 -174.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -68.92 -8.37 23.33 Favored 'Trans proline' 0 CA--C 1.544 1.022 0 C-N-CA 123.455 2.77 . . . . 0.0 114.632 -174.001 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -138.41 21.39 2.75 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 125.569 1.548 . . . . 0.0 112.881 -174.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 47.5 t80 -50.61 -55.13 17.73 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 120.44 -1.413 . . . . 0.0 113.484 -174.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -76.7 -10.56 59.47 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.692 1.197 . . . . 0.0 114.208 -179.154 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.3 mmmm -72.93 -44.33 61.32 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.404 1.082 . . . . 0.0 110.117 176.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.4 mp -81.41 -52.4 13.97 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 123.963 0.905 . . . . 0.0 110.075 172.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 20.5 mm -81.43 104.89 10.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 CA-C-O 122.183 0.992 . . . . 0.0 111.629 -176.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 69.8 mmtt -69.7 -35.09 74.78 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.856 1.662 . . . . 0.0 113.603 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 70.5 m-80 -143.1 94.34 6.35 Favored Pre-proline 0 CA--C 1.545 0.776 0 C-N-CA 125.79 1.636 . . . . 0.0 110.013 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -70.67 149.21 60.71 Favored 'Trans proline' 0 CA--C 1.538 0.721 0 C-N-CA 123.141 2.561 . . . . 0.0 111.103 178.161 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -153.93 136.06 14.77 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.434 1.094 . . . . 0.0 110.182 -174.596 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -143.82 148.98 36.32 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.56 1.944 . . . . 0.0 110.815 177.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.6 ttp -57.94 -34.31 69.76 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.797 1.239 . . . . 0.0 113.043 -171.469 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -56.87 -27.6 56.53 Favored Glycine 0 CA--C 1.532 1.145 0 C-N-CA 125.375 1.464 . . . . 0.0 114.394 173.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 43.7 m -78.38 -45.92 21.23 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 118.032 0.916 . . . . 0.0 110.878 169.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.9 mt -55.82 -53.76 34.01 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 C-N-CA 125.076 1.35 . . . . 0.0 111.754 -175.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 4.8 ptpt -54.15 -38.2 65.26 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 174.069 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.503 ' HE2' ' HA ' ' A' ' 88' ' ' LYS . 0.2 OUTLIER -71.03 -39.31 72.41 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.156 0.982 . . . . 0.0 113.179 -176.996 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 12.4 ptp180 -72.43 -32.34 66.23 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 113.683 0.994 . . . . 0.0 113.683 172.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 53.2 mt -61.19 -43.54 98.71 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.416 0.686 . . . . 0.0 112.821 169.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -59.63 -39.37 84.1 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 -176.138 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -108.55 17.21 22.26 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 -171.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 27.1 m-20 54.79 59.72 3.92 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.467 1.907 . . . . 0.0 114.159 174.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 76.6 t80 -63.55 -20.5 65.69 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.401 1.08 . . . . 0.0 113.588 178.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -145.06 177.48 8.74 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 129.483 3.113 . . . . 0.0 110.768 -173.62 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.7 t-105 -104.47 -27.5 11.88 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.264 1.026 . . . . 0.0 112.843 174.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 20.2 m -126.15 138.62 53.68 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.078 0.951 . . . . 0.0 113.273 -168.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -65.52 -19.74 66.05 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 115.939 1.829 . . . . 0.0 115.939 -175.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 16.8 m -56.55 -28.0 59.05 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.179 0.9 . . . . 0.0 112.826 173.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 56.5 mm-40 -70.35 -43.72 69.61 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.629 0.771 . . . . 0.0 112.03 173.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 42.8 t -62.51 -36.41 82.46 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 121.437 -0.789 . . . . 0.0 112.46 172.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 79.0 mtp -63.64 -40.04 95.87 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 121.392 -0.818 . . . . 0.0 112.36 175.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.06 -32.01 73.28 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.262 0.625 . . . . 0.0 112.144 174.923 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -72.85 -42.45 63.71 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.505 0.722 . . . . 0.0 111.554 178.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 -59.49 -46.28 89.26 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 118.546 0.612 . . . . 0.0 112.148 169.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 24.5 t30 -56.84 -44.51 82.17 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.02 0.528 . . . . 0.0 112.054 174.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 36.8 m -66.54 -36.41 82.6 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.852 0.861 . . . . 0.0 112.265 178.174 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 48.5 ttp -61.62 -55.47 30.25 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.27 -0.894 . . . . 0.0 112.083 174.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -65.72 -38.66 89.79 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 122.039 -0.413 . . . . 0.0 111.845 -179.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 91.8 m -66.0 -46.3 78.47 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 121.572 -0.705 . . . . 0.0 112.46 178.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.1 p30 -63.79 -31.64 72.88 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 120.117 1.326 . . . . 0.0 112.315 178.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 33.4 m -59.78 -47.51 85.39 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 118.917 -0.563 . . . . 0.0 112.047 169.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -68.51 -31.06 70.04 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 114.048 1.129 . . . . 0.0 114.048 179.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 88.2 mt -67.78 -59.3 3.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 123.304 0.642 . . . . 0.0 110.607 175.195 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 32.2 t80 -71.79 -35.15 69.9 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 114.023 1.119 . . . . 0.0 114.023 -171.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -105.8 155.09 19.64 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.334 1.053 . . . . 0.0 111.64 -172.308 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -72.91 154.04 91.0 Favored Pre-proline 0 N--CA 1.471 0.609 0 C-N-CA 124.304 1.041 . . . . 0.0 110.429 178.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -64.78 -0.82 3.45 Favored 'Trans proline' 0 CA--C 1.545 1.05 0 C-N-CA 123.748 2.965 . . . . 0.0 114.883 -179.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 64.5 p -116.31 -2.58 12.08 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 126.999 2.12 . . . . 0.0 113.134 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 62.4 m-20 -71.51 143.21 50.06 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 119.08 0.854 . . . . 0.0 110.449 171.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -56.05 -47.34 78.09 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 121.538 -0.726 . . . . 0.0 112.373 -175.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.5 tp -52.34 -30.91 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 125.201 1.4 . . . . 0.0 114.332 177.029 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 52.4 t -74.05 -47.19 43.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 O-C-N 121.569 -0.707 . . . . 0.0 110.809 174.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 76.1 mt -61.48 -37.35 83.32 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 119.237 0.926 . . . . 0.0 111.66 177.105 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 7.8 mtp -60.13 -50.77 72.36 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.506 1.523 . . . . 0.0 111.999 170.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.91 -39.68 90.27 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.55 0.74 . . . . 0.0 112.824 175.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 88.9 mt-30 -60.83 -48.53 81.4 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 119.413 1.006 . . . . 0.0 111.823 173.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -61.19 -42.64 98.94 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.512 0.725 . . . . 0.0 112.671 178.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 86.7 mt -66.02 -45.84 80.04 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.607 0.763 . . . . 0.0 112.067 173.381 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -64.43 -39.65 94.24 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 121.054 -1.028 . . . . 0.0 112.621 -176.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 5.2 mtpm? -56.3 -36.98 69.27 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 121.529 -0.732 . . . . 0.0 112.041 175.038 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 68.4 mt -75.24 -46.65 38.15 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 123.627 0.771 . . . . 0.0 111.073 173.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 43.9 t80 -49.25 -48.22 45.92 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 119.933 1.242 . . . . 0.0 111.771 174.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.3 mt -65.43 -38.89 91.25 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.32 -0.862 . . . . 0.0 113.046 178.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -67.6 -29.37 68.69 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 119.97 1.259 . . . . 0.0 112.376 176.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 28.7 mmtp -75.53 -49.98 17.05 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.25 1.42 . . . . 0.0 112.577 178.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 7.1 m -69.84 -25.41 28.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 119.289 0.949 . . . . 0.0 111.736 178.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -61.65 -29.81 70.31 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.665 -0.647 . . . . 0.0 112.453 170.157 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -96.96 1.26 50.14 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.595 1.558 . . . . 0.0 112.626 177.268 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 8.4 ttm -54.13 139.67 54.51 Favored Pre-proline 0 CA--C 1.544 0.725 0 C-N-CA 124.271 1.028 . . . . 0.0 111.306 172.226 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -66.51 117.95 5.14 Favored 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 122.463 2.109 . . . . 0.0 108.568 169.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 -65.64 -28.49 69.15 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 -173.044 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -83.75 164.4 19.61 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.135 1.774 . . . . 0.0 111.953 172.138 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -132.24 143.22 49.77 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.111 0.964 . . . . 0.0 111.731 -175.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 55.0 t -130.69 133.29 63.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 125.504 1.521 . . . . 0.0 110.371 -176.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -68.07 117.05 9.41 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.68 1.592 . . . . 0.0 111.221 170.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 80.6 mt -71.23 144.87 49.93 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 113.245 0.831 . . . . 0.0 113.245 -178.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 93.3 mt -76.99 155.17 82.84 Favored Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 124.596 1.158 . . . . 0.0 111.191 169.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -73.9 155.68 48.27 Favored 'Trans proline' 0 CA--C 1.547 1.144 0 C-N-CA 122.991 2.46 . . . . 0.0 112.503 178.616 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -73.53 163.26 38.0 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 123.712 2.941 . . . . 0.0 112.589 176.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -65.33 152.56 91.71 Favored Pre-proline 0 CA--C 1.553 1.066 0 C-N-CA 124.0 0.92 . . . . 0.0 112.485 172.081 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -70.82 161.56 45.66 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 123.341 2.694 . . . . 0.0 112.628 176.006 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 3.1 mptp? -70.73 164.04 25.92 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.861 1.264 . . . . 0.0 111.905 176.014 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . -143.33 22.67 2.23 Favored Glycine 0 CA--C 1.536 1.404 0 C-N-CA 125.027 1.299 . . . . 0.0 114.913 -176.31 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 62.4 tttp . . . . . 0 C--O 1.254 1.304 0 C-N-CA 126.367 1.867 . . . . 0.0 111.311 178.967 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.395 0 N-CA-C 111.617 -0.593 . . . . 0.0 111.617 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 58.7 p -60.51 -15.86 31.34 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 115.395 1.628 . . . . 0.0 115.395 -176.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.454 ' HG ' ' CG ' ' A' ' 74' ' ' HIS . 17.8 m -60.27 -24.17 64.7 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 125.436 1.494 . . . . 0.0 114.026 173.483 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 66.93 18.87 69.18 Favored Glycine 0 CA--C 1.538 1.529 0 C-N-CA 124.382 0.992 . . . . 0.0 114.762 -178.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 16.8 m -60.55 152.97 24.69 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.676 1.59 . . . . 0.0 113.153 -177.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.5 t -63.12 151.68 39.42 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.529 0.732 . . . . 0.0 112.172 174.075 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -169.83 35.58 0.18 Allowed Glycine 0 CA--C 1.534 1.238 0 C-N-CA 124.635 1.112 . . . . 0.0 113.556 -175.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -62.34 166.56 4.92 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 114.387 1.254 . . . . 0.0 114.387 178.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 30.8 m -138.26 -23.37 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.243 0 C-N-CA 125.198 1.399 . . . . 0.0 113.996 172.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.9 m -148.75 149.83 32.08 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 126.497 1.919 . . . . 0.0 111.411 171.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 22.2 m120 -148.62 135.67 10.57 Favored Pre-proline 0 CA--C 1.545 0.784 0 C-N-CA 126.092 1.757 . . . . 0.0 109.412 174.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -75.16 -19.93 17.04 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 123.367 2.711 . . . . 0.0 113.906 -178.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.8 t -72.45 -38.67 68.22 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.018 0.927 . . . . 0.0 113.212 -177.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt -75.27 143.28 76.42 Favored Pre-proline 0 N--CA 1.476 0.874 0 C-N-CA 123.611 0.765 . . . . 0.0 111.574 175.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -73.32 155.07 51.44 Favored 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 122.666 2.244 . . . . 0.0 111.281 169.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -178.09 158.71 23.79 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 123.893 0.759 . . . . 0.0 113.24 175.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 37.8 ptt180 -159.17 160.47 35.53 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.91 1.684 . . . . 0.0 110.982 175.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 22.5 ptmt -70.87 132.85 45.89 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.584 0.753 . . . . 0.0 110.837 169.408 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 77.4 p -140.62 161.59 37.39 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 125.076 1.35 . . . . 0.0 111.38 -177.087 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 26.5 p-10 -48.99 -38.94 24.71 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 114.066 1.135 . . . . 0.0 114.066 170.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -69.7 -51.22 36.39 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.65 0.78 . . . . 0.0 111.557 178.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.5 mt -65.73 -30.18 70.81 Favored 'General case' 0 CA--C 1.54 0.582 0 O-C-N 121.652 -0.655 . . . . 0.0 112.36 177.423 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 44.7 tt0 -60.8 -52.54 64.66 Favored 'General case' 0 C--O 1.224 -0.268 0 C-N-CA 123.427 0.691 . . . . 0.0 110.237 169.056 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -56.25 -42.18 76.96 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 118.836 0.744 . . . . 0.0 112.15 179.14 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 96.5 mmm -55.98 -50.71 70.06 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 172.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -84.44 -11.5 56.09 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -174.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 66.6 t30 -117.19 -18.86 9.88 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.55 1.54 . . . . 0.0 112.872 -170.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 6.0 t -133.6 -49.67 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 C-N-CA 123.606 0.762 . . . . 0.0 111.869 -177.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 22.3 t -69.28 -64.22 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 CA-C-N 119.095 0.861 . . . . 0.0 110.794 -176.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 45.0 t -53.83 -50.07 54.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 124.864 1.265 . . . . 0.0 109.841 171.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.3 tppt? -60.74 -26.35 67.13 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 -174.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 21.0 m -98.66 -39.65 8.57 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-N 118.948 0.795 . . . . 0.0 112.429 177.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 80.7 mt -59.0 -30.14 67.77 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.485 -0.759 . . . . 0.0 112.121 171.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . 0.429 ' CE3' ' HD3' ' A' ' 87' ' ' LYS . 27.5 t-105 -75.56 -39.22 58.47 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 114.826 1.417 . . . . 0.0 114.826 179.061 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 8.9 ptpp? -76.62 -10.42 59.38 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 177.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 60.3 t-80 -54.74 152.5 7.03 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.073 1.749 . . . . 0.0 113.456 -178.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 58.9 mt-30 -54.37 -25.57 25.11 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.813 1.645 . . . . 0.0 114.437 177.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -125.19 18.62 8.33 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.041 1.337 . . . . 0.0 113.705 -172.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.13 -24.85 63.25 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.391 1.476 . . . . 0.0 114.177 176.17 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 64.6 p-90 -58.14 -33.42 17.74 Favored Pre-proline 0 CA--C 1.547 0.851 0 N-CA-C 117.592 2.441 . . . . 0.0 117.592 -170.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -81.27 2.29 8.68 Favored 'Trans proline' 0 CA--C 1.547 1.133 0 CA-C-N 123.041 2.122 . . . . 0.0 113.237 175.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -113.38 -5.29 13.55 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.493 1.517 . . . . 0.0 113.572 178.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 23.4 m-30 -64.19 -17.99 64.06 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 119.848 1.204 . . . . 0.0 113.952 177.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -144.03 158.31 55.8 Favored Pre-proline 0 CA--C 1.546 0.819 0 C-N-CA 126.55 1.94 . . . . 0.0 110.625 -176.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -67.48 159.5 52.18 Favored 'Trans proline' 0 CA--C 1.537 0.635 0 C-N-CA 123.061 2.507 . . . . 0.0 112.476 172.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 60.1 t -70.86 107.08 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 123.85 0.86 . . . . 0.0 109.458 170.066 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 -72.39 79.95 1.03 Allowed 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.282 1.033 . . . . 0.0 110.517 169.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -51.16 -27.72 9.35 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.917 1.287 . . . . 0.0 114.348 -177.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 85.2 mt -64.0 -48.38 86.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 125.592 1.557 . . . . 0.0 111.566 172.136 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -75.96 -39.83 55.23 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.57 1.548 . . . . 0.0 112.899 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -74.74 -9.65 58.77 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.874 1.67 . . . . 0.0 113.094 176.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 57.75 55.0 5.77 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.426 1.891 . . . . 0.0 112.527 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 55.8 mt -116.1 78.96 8.07 Favored Pre-proline 0 CA--C 1.543 0.706 0 C-N-CA 126.241 1.816 . . . . 0.0 110.703 -178.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -66.87 -16.67 50.56 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 123.302 2.668 . . . . 0.0 112.999 -179.166 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 -100.96 7.54 43.5 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.903 1.681 . . . . 0.0 113.103 175.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 79.0 t80 -52.75 -56.48 15.34 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 120.462 -1.399 . . . . 0.0 112.398 -176.506 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . 0.454 ' CG ' ' HG ' ' A' ' 20' ' ' SER . 93.2 m-70 -74.07 -15.08 61.08 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.776 1.23 . . . . 0.0 114.128 179.667 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 9.9 mptt -69.92 -31.88 69.88 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.042 0.937 . . . . 0.0 111.592 177.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.4 mp -102.05 -45.2 10.81 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 125.688 1.595 . . . . 0.0 111.27 176.077 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 34.4 mm -76.42 101.68 2.86 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 121.929 0.871 . . . . 0.0 111.151 179.006 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.68 -40.72 95.89 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.747 1.619 . . . . 0.0 112.983 172.026 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -144.22 98.77 5.05 Favored Pre-proline 0 CA--C 1.545 0.766 0 C-N-CA 125.347 1.459 . . . . 0.0 110.575 -176.362 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -74.49 147.31 36.16 Favored 'Trans proline' 0 CA--C 1.539 0.773 0 C-N-CA 123.206 2.604 . . . . 0.0 111.083 175.361 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.3 tpt -155.68 148.26 23.98 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.832 1.253 . . . . 0.0 110.557 178.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -147.46 154.45 40.81 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 125.686 1.595 . . . . 0.0 111.368 179.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.5 ttp -62.03 -36.96 83.14 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 123.856 0.862 . . . . 0.0 112.563 -171.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -56.11 -49.11 69.5 Favored Glycine 0 CA--C 1.532 1.142 0 C-N-CA 124.242 0.925 . . . . 0.0 112.615 177.198 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 85.2 m -69.67 -33.71 72.96 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 117.661 -1.161 . . . . 0.0 112.648 174.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 97.7 mt -56.56 -49.54 77.2 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 CA-C-N 120.663 1.574 . . . . 0.0 110.826 172.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.429 ' HD3' ' CE3' ' A' ' 51' ' ' TRP . 0.4 OUTLIER -60.35 -35.36 75.5 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 118.698 0.681 . . . . 0.0 112.511 174.941 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.424 ' HA ' ' HE3' ' A' ' 88' ' ' LYS . 1.4 tpmt? -65.73 -41.9 91.69 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 -179.874 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 13.3 ptp180 -67.68 -24.08 65.38 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 173.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 74.8 mt -75.66 -39.06 58.24 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 167.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -63.05 -27.26 69.28 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 114.845 1.424 . . . . 0.0 114.845 -176.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -137.04 136.28 38.27 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.907 1.683 . . . . 0.0 110.642 -179.312 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 -51.99 134.4 32.0 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.227 1.411 . . . . 0.0 113.81 -169.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 44.1 t80 -155.54 -34.48 0.09 Allowed 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.588 1.555 . . . . 0.0 112.981 179.109 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -134.86 176.79 8.33 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.234 1.414 . . . . 0.0 112.045 179.127 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 12.0 t-105 -115.16 -21.1 10.13 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.114 1.365 . . . . 0.0 113.31 -169.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 44.3 t -144.63 151.53 39.14 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 125.489 1.516 . . . . 0.0 111.207 -178.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -58.56 -22.55 56.13 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 115.572 1.693 . . . . 0.0 115.572 -177.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 39.5 m -54.8 -31.52 59.11 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 -179.044 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -68.87 -46.07 69.37 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 121.374 -0.829 . . . . 0.0 112.17 173.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 46.4 t -63.75 -36.34 83.54 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.515 1.126 . . . . 0.0 112.354 177.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 81.6 mtp -58.67 -40.56 83.89 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 123.93 0.892 . . . . 0.0 112.535 174.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -66.68 -32.57 73.98 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 174.314 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 -69.36 -39.29 78.17 Favored 'General case' 0 CA--C 1.541 0.634 0 O-C-N 120.98 -1.075 . . . . 0.0 111.759 173.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -60.35 -47.13 87.36 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.446 -0.784 . . . . 0.0 112.145 169.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -60.19 -41.08 92.16 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 121.665 -0.647 . . . . 0.0 111.429 175.4 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 86.0 m -62.31 -40.14 95.35 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.764 0.826 . . . . 0.0 111.756 177.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 48.0 ttp -59.64 -50.75 72.67 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.481 0.713 . . . . 0.0 112.305 175.431 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -71.08 -41.67 70.38 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -179.532 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 41.7 m -64.97 -46.75 80.17 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 121.358 -0.839 . . . . 0.0 112.09 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -63.23 -32.83 74.33 Favored 'General case' 0 CA--C 1.547 0.854 0 CA-C-N 119.585 1.084 . . . . 0.0 112.004 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 67.4 m -61.06 -43.23 99.2 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.904 0.882 . . . . 0.0 113.136 170.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 17.9 m-85 -67.52 -31.91 72.35 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 177.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 87.3 mt -68.18 -56.06 14.11 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.825 0 C-N-CA 123.266 0.626 . . . . 0.0 110.785 177.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 34.5 t80 -69.41 -36.79 77.06 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 114.389 1.255 . . . . 0.0 114.389 -172.296 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 60.1 m-80 -101.01 158.71 15.8 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.245 1.018 . . . . 0.0 111.872 -172.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 3.7 mptp? -70.35 151.07 95.81 Favored Pre-proline 0 N--CA 1.47 0.568 0 C-N-CA 123.822 0.849 . . . . 0.0 109.671 174.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -65.45 -1.03 4.14 Favored 'Trans proline' 0 CA--C 1.546 1.076 0 C-N-CA 123.714 2.943 . . . . 0.0 114.725 -179.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 52.6 p -119.96 -2.19 10.32 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 127.266 2.226 . . . . 0.0 113.207 -179.431 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -67.44 145.54 54.91 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 118.837 0.744 . . . . 0.0 110.545 169.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -58.01 -40.89 81.93 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 121.561 -0.712 . . . . 0.0 112.386 -173.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 9.9 tp -55.59 -35.73 39.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 125.517 1.527 . . . . 0.0 113.877 178.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 46.4 t -67.35 -44.79 86.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 123.216 0.606 . . . . 0.0 110.456 174.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 53.0 mt -62.66 -36.17 82.0 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 118.588 0.631 . . . . 0.0 111.774 177.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 1.1 mmt -58.93 -52.16 66.94 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 122.765 0.426 . . . . 0.0 111.27 170.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -62.06 -38.82 90.21 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.459 0.703 . . . . 0.0 112.307 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -60.17 -47.48 85.75 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 119.227 0.921 . . . . 0.0 112.2 173.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -63.83 -44.56 92.84 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.437 0.695 . . . . 0.0 112.617 178.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 92.5 mt -65.91 -44.86 83.96 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.927 0.891 . . . . 0.0 112.135 176.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -63.26 -39.17 93.84 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 119.374 0.988 . . . . 0.0 112.615 -176.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -58.82 -40.86 85.39 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 121.381 -0.824 . . . . 0.0 112.107 175.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 85.0 mt -72.7 -41.78 62.29 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 123.624 0.77 . . . . 0.0 111.209 175.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -51.96 -51.39 57.42 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.891 0.768 . . . . 0.0 110.68 173.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 99.0 mt -62.58 -40.89 98.3 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.327 0.651 . . . . 0.0 112.665 177.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.73 -35.38 80.87 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 119.634 1.106 . . . . 0.0 112.729 176.498 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 71.0 mmtt -70.47 -52.87 19.0 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.748 1.219 . . . . 0.0 111.885 177.209 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 6.4 m -66.53 -24.12 32.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 CA-C-N 120.09 1.314 . . . . 0.0 112.313 179.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -64.79 -35.11 80.05 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.769 -0.582 . . . . 0.0 112.364 170.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -81.8 -16.72 50.01 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.372 1.069 . . . . 0.0 112.904 173.027 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 49.3 ttp -63.68 137.73 97.18 Favored Pre-proline 0 CA--C 1.546 0.818 0 CA-C-N 119.266 0.939 . . . . 0.0 110.937 174.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -68.48 136.23 35.98 Favored 'Trans proline' 0 CA--C 1.536 0.605 0 C-N-CA 122.786 2.324 . . . . 0.0 111.73 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -74.6 -22.95 58.68 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.216 1.006 . . . . 0.0 112.797 175.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -77.16 156.37 31.65 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.251 1.42 . . . . 0.0 111.783 173.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -126.58 135.78 51.69 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.377 1.471 . . . . 0.0 110.795 -174.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 12.7 p -148.22 140.32 18.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 C-N-CA 124.668 1.187 . . . . 0.0 110.946 174.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -70.15 132.32 45.62 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.5 1.12 . . . . 0.0 111.045 174.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 77.6 mt -72.57 158.15 36.23 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 -175.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 4.5 pp -61.79 153.93 69.46 Favored Pre-proline 0 CA--C 1.552 1.025 0 C-N-CA 124.882 1.273 . . . . 0.0 112.331 169.465 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -76.15 149.97 32.81 Favored 'Trans proline' 0 CA--C 1.545 1.04 0 C-N-CA 123.202 2.601 . . . . 0.0 112.252 -177.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -72.61 160.67 45.98 Favored 'Trans proline' 0 CA--C 1.539 0.765 0 C-N-CA 123.354 2.702 . . . . 0.0 112.497 178.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -64.62 150.31 94.17 Favored Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 123.657 0.783 . . . . 0.0 111.785 170.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -69.97 115.02 3.93 Favored 'Trans proline' 0 CA--C 1.54 0.777 0 C-N-CA 123.248 2.632 . . . . 0.0 111.62 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 8.3 mtpm? -81.61 -2.98 52.15 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 125.081 1.352 . . . . 0.0 113.756 177.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . -167.92 -112.19 0.26 Allowed Glycine 0 CA--C 1.533 1.181 0 C-N-CA 125.751 1.643 . . . . 0.0 111.353 -179.525 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 22.9 ptmt . . . . . 0 C--O 1.252 1.228 0 C-N-CA 124.949 1.3 . . . . 0.0 113.851 172.562 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.416 0 N-CA-C 111.11 -0.796 . . . . 0.0 111.11 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 75.5 p -68.58 166.25 17.5 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.801 1.24 . . . . 0.0 113.282 174.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 79.4 p -139.55 -4.67 1.42 Allowed 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 115.378 1.621 . . . . 0.0 115.378 -177.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 178.46 34.13 0.06 OUTLIER Glycine 0 CA--C 1.535 1.327 0 O-C-N 121.255 -0.903 . . . . 0.0 114.845 -178.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 20.1 t -69.99 -31.67 69.48 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.233 1.013 . . . . 0.0 113.504 -175.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 66.0 p -74.46 159.95 31.6 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.923 1.289 . . . . 0.0 113.577 -179.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -94.64 88.36 1.14 Allowed Glycine 0 CA--C 1.531 1.072 0 C-N-CA 125.523 1.535 . . . . 0.0 111.891 178.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -58.14 154.25 13.33 Favored 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 113.803 1.038 . . . . 0.0 113.803 174.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 32.6 m -134.97 -9.96 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.466 0 C-N-CA 124.971 1.309 . . . . 0.0 114.414 -169.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 55.4 p -152.18 117.05 5.13 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 125.852 1.661 . . . . 0.0 110.036 -178.338 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 60.5 t-20 -149.35 114.68 3.58 Favored Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 124.193 0.997 . . . . 0.0 110.636 -174.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -72.7 -12.21 26.51 Favored 'Trans proline' 0 CA--C 1.542 0.896 0 C-N-CA 123.813 3.009 . . . . 0.0 113.973 -177.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.1 m -81.11 -5.5 57.73 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.147 0.979 . . . . 0.0 113.639 177.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -110.7 140.38 22.56 Favored Pre-proline 0 N--CA 1.472 0.669 0 C-N-CA 125.297 1.439 . . . . 0.0 111.395 -178.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -73.01 150.54 48.74 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.592 2.195 . . . . 0.0 111.487 173.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 163.71 168.49 25.8 Favored Glycine 0 CA--C 1.528 0.85 0 CA-C-O 122.252 0.918 . . . . 0.0 115.094 177.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 8.8 ptp180 -164.33 162.87 22.56 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 128.403 2.681 . . . . 0.0 108.724 173.566 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 50.5 tttt -73.51 124.38 25.75 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 168.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 62.6 p -122.26 165.76 15.7 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 125.043 1.337 . . . . 0.0 110.743 -176.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -50.33 -35.19 26.6 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.424 1.09 . . . . 0.0 113.589 171.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -70.76 -49.38 47.4 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 121.512 -0.743 . . . . 0.0 112.11 176.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.5 mt -64.2 -32.58 74.22 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 121.676 -0.64 . . . . 0.0 112.275 175.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 8.6 tp60 -60.51 -50.83 72.0 Favored 'General case' 0 C--O 1.223 -0.335 0 CA-C-O 118.47 -0.776 . . . . 0.0 110.434 170.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 60.9 t80 -56.83 -43.87 81.49 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.809 1.186 . . . . 0.0 112.269 177.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 93.3 mmm -55.08 -52.2 63.96 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 122.946 0.498 . . . . 0.0 112.083 172.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 -72.48 -30.95 64.99 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 -177.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -91.56 -25.87 19.01 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.429 1.492 . . . . 0.0 113.271 -168.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 34.3 t -128.4 -52.18 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 C-N-CA 123.224 0.61 . . . . 0.0 111.443 -176.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 16.3 t -69.85 -65.87 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 C-N-CA 123.624 0.769 . . . . 0.0 110.468 -171.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 48.8 t -54.21 -49.74 60.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 C-N-CA 125.624 1.57 . . . . 0.0 110.13 173.067 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -53.33 -52.65 58.5 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 118.824 -0.608 . . . . 0.0 111.63 -177.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 25.4 m -70.91 -40.16 72.32 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 118.576 0.625 . . . . 0.0 112.407 -178.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 62.7 mt -59.67 -29.59 68.16 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 118.682 0.674 . . . . 0.0 112.141 172.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . 0.47 ' CZ3' ' HE3' ' A' ' 87' ' ' LYS . 26.8 t-105 -79.83 -33.88 39.89 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.902 1.681 . . . . 0.0 114.234 179.209 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 15.4 ptmt -80.05 -9.51 59.7 Favored 'General case' 0 N--CA 1.483 1.193 0 CA-C-N 119.968 1.258 . . . . 0.0 114.166 174.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 50.1 t-80 -55.42 151.57 9.96 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.771 1.628 . . . . 0.0 113.519 177.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.62 -17.38 21.63 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.765 1.626 . . . . 0.0 114.442 176.76 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -125.85 17.04 8.01 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.48 1.512 . . . . 0.0 114.043 -173.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.32 -29.97 65.65 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 177.263 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 41.5 p-90 -54.84 -36.98 50.77 Favored Pre-proline 0 CA--C 1.549 0.919 0 N-CA-C 117.543 2.423 . . . . 0.0 117.543 -171.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -70.53 -3.03 11.69 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 CA-C-N 123.187 2.174 . . . . 0.0 114.7 173.136 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 -115.78 -3.25 12.24 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.345 1.458 . . . . 0.0 113.363 178.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -63.64 -27.45 69.24 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 119.511 1.051 . . . . 0.0 113.435 178.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -138.16 153.83 73.54 Favored Pre-proline 0 CA--C 1.542 0.652 0 C-N-CA 126.138 1.775 . . . . 0.0 110.003 -173.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -66.3 141.21 61.5 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 C-N-CA 122.416 2.077 . . . . 0.0 113.308 -175.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 54.5 t -57.08 136.23 20.28 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 124.716 1.206 . . . . 0.0 110.432 169.42 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -127.95 101.48 6.34 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 125.304 1.442 . . . . 0.0 109.983 178.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.0 -30.06 61.26 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.499 1.12 . . . . 0.0 113.924 -179.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 83.6 mt -67.77 -48.84 74.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 125.02 1.328 . . . . 0.0 111.109 175.085 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -66.21 -37.54 85.82 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.945 1.298 . . . . 0.0 112.96 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 72.3 mt -95.24 0.55 54.03 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.335 1.854 . . . . 0.0 113.103 -174.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 51.6 57.5 6.5 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.914 1.686 . . . . 0.0 113.036 -179.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 36.8 mt -113.92 78.24 4.06 Favored Pre-proline 0 CA--C 1.546 0.815 0 C-N-CA 126.042 1.737 . . . . 0.0 110.021 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -66.56 -7.34 17.62 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 124.387 3.392 . . . . 0.0 115.292 -169.421 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -130.71 17.79 5.22 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.942 1.697 . . . . 0.0 112.204 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 69.8 t80 -46.55 -54.61 9.03 Favored 'General case' 0 N--CA 1.476 0.849 0 O-C-N 120.997 -1.064 . . . . 0.0 113.486 -174.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -76.24 -8.88 58.03 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.013 1.325 . . . . 0.0 114.477 -179.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.1 mmmp? -77.86 -39.13 44.36 Favored 'General case' 0 N--CA 1.476 0.857 0 O-C-N 121.214 -0.929 . . . . 0.0 110.866 173.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.3 mp -82.61 -50.38 15.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 124.219 1.007 . . . . 0.0 110.565 174.026 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 34.4 mm -76.87 109.08 10.88 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.625 0 C-N-CA 123.642 0.777 . . . . 0.0 111.319 -178.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.22 -40.24 93.24 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.506 1.123 . . . . 0.0 112.464 171.364 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -154.44 106.18 2.39 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 125.98 1.712 . . . . 0.0 110.905 -172.677 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -76.71 163.26 31.81 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 123.6 2.867 . . . . 0.0 111.934 178.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -158.19 153.14 25.24 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.954 0.901 . . . . 0.0 111.981 175.025 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -153.19 132.32 12.65 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 126.906 2.082 . . . . 0.0 110.566 -171.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 7.2 ttp -59.82 -36.2 76.29 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.254 1.022 . . . . 0.0 113.37 -172.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -58.15 -24.85 56.0 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 124.662 1.125 . . . . 0.0 114.503 175.06 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 91.2 m -94.25 -17.44 22.66 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.267 1.427 . . . . 0.0 112.524 178.158 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.454 ' CG2' ' HG ' ' A' ' 101' ' ' CYS . 50.5 mt -72.43 -52.86 21.51 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 O-C-N 120.803 -1.185 . . . . 0.0 110.302 170.577 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.47 ' HE3' ' CZ3' ' A' ' 51' ' ' TRP . 16.6 ptpt -57.8 -29.0 64.54 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -178.56 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 3.0 tppp? -66.8 -45.35 78.65 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.98 1.312 . . . . 0.0 112.697 -177.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 1.4 ptt180 -77.55 -27.7 51.62 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.169 0.987 . . . . 0.0 113.009 178.25 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 64.6 mt -60.98 -34.15 74.33 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 168.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -73.12 -38.85 66.17 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 118.864 0.756 . . . . 0.0 112.362 173.809 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -69.8 178.13 2.76 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 125.261 1.425 . . . . 0.0 112.896 171.071 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 41.5 p-10 -99.12 34.2 2.19 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.832 2.053 . . . . 0.0 111.936 174.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 65.5 t80 -63.87 -36.32 83.54 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.409 1.084 . . . . 0.0 113.696 -169.232 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -136.63 -177.99 4.98 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 128.184 2.594 . . . . 0.0 110.78 177.551 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 7.4 t-105 -115.0 -29.91 6.54 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.984 1.314 . . . . 0.0 112.464 -178.13 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 54.3 m -132.17 141.24 49.02 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.062 0.945 . . . . 0.0 112.665 -168.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -63.45 -16.63 61.15 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 115.943 1.831 . . . . 0.0 115.943 -173.52 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 14.7 m -55.32 -30.85 61.01 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.969 0.907 . . . . 0.0 112.989 175.012 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -65.49 -50.52 65.01 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 121.544 -0.723 . . . . 0.0 111.332 173.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . 0.454 ' HG ' ' CG2' ' A' ' 86' ' ' ILE . 53.2 t -59.96 -37.74 80.44 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.25 1.02 . . . . 0.0 112.567 175.396 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 85.5 mtp -62.01 -42.68 99.42 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 121.184 -0.947 . . . . 0.0 112.393 173.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -64.95 -35.93 82.76 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 112.702 0.63 . . . . 0.0 112.702 173.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 55.8 m-20 -61.37 -48.02 83.17 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.487 1.039 . . . . 0.0 112.084 172.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -60.79 -43.71 97.76 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.622 -0.674 . . . . 0.0 112.767 174.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 18.1 t30 -55.2 -52.11 64.4 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.113 0.565 . . . . 0.0 111.526 173.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 96.5 m -61.01 -35.99 78.31 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.748 0.819 . . . . 0.0 112.737 177.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 27.7 ttp -61.3 -49.9 75.17 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 119.421 1.009 . . . . 0.0 112.554 176.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -70.9 -42.29 70.17 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 179.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 62.5 m -63.86 -46.76 83.54 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.764 0.825 . . . . 0.0 112.664 179.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -64.38 -33.78 76.65 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 119.852 1.206 . . . . 0.0 112.108 -179.296 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 19.2 m -59.15 -41.72 89.01 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.76 0.824 . . . . 0.0 112.989 169.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -68.73 -29.39 67.8 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 177.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 87.5 mt -69.12 -56.69 11.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 123.383 0.673 . . . . 0.0 110.986 176.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -67.9 -31.51 71.34 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 114.577 1.325 . . . . 0.0 114.577 -173.167 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 60.8 m-80 -110.18 160.43 16.5 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.474 1.11 . . . . 0.0 112.053 -170.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 49.0 mmtm -72.18 152.14 92.46 Favored Pre-proline 0 N--CA 1.474 0.752 0 O-C-N 121.499 -0.75 . . . . 0.0 110.343 172.363 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -65.74 -1.24 4.68 Favored 'Trans proline' 0 CA--C 1.545 1.042 0 C-N-CA 123.676 2.917 . . . . 0.0 115.043 -177.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 67.7 p -119.01 -0.59 11.11 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.663 1.985 . . . . 0.0 113.126 -179.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -68.45 146.5 53.12 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 118.794 0.724 . . . . 0.0 110.68 170.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -55.39 -49.53 72.09 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 121.681 -0.637 . . . . 0.0 112.209 -175.562 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.5 tp -51.99 -31.12 13.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 125.232 1.413 . . . . 0.0 114.54 177.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 55.2 t -73.84 -48.96 37.23 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 O-C-N 121.541 -0.725 . . . . 0.0 110.719 174.174 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 77.2 mt -61.33 -37.4 83.14 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 119.124 0.875 . . . . 0.0 111.848 177.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 10.6 mtp -57.91 -52.62 64.72 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.869 1.668 . . . . 0.0 111.918 169.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.43 -39.23 90.02 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 113.04 0.755 . . . . 0.0 113.04 176.164 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . 0.42 ' O ' ' HE2' ' A' ' 131' ' ' LYS . 89.4 mt-30 -61.55 -47.79 83.96 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 119.312 0.96 . . . . 0.0 112.012 174.342 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.34 -40.44 96.38 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.698 -0.626 . . . . 0.0 112.514 177.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 82.6 mt -65.37 -44.73 86.7 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.436 0.694 . . . . 0.0 111.904 172.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -59.34 -48.09 82.95 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.343 0.974 . . . . 0.0 113.173 -175.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.42 ' HE2' ' O ' ' A' ' 127' ' ' GLN . 1.1 mppt? -60.45 -32.83 71.76 Favored 'General case' 0 CA--C 1.533 0.31 0 O-C-N 120.947 -1.096 . . . . 0.0 113.693 176.646 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 73.8 mt -76.18 -40.79 36.93 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 CA-C-N 118.803 0.729 . . . . 0.0 111.362 174.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -51.45 -51.61 53.47 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.383 -0.823 . . . . 0.0 109.965 170.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.3 mt -61.3 -43.18 99.3 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.507 0.723 . . . . 0.0 112.939 177.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -64.92 -31.58 72.88 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 120.056 1.298 . . . . 0.0 112.76 -178.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -76.14 -52.0 11.02 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.774 0.83 . . . . 0.0 112.191 175.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.3 m -65.61 -24.79 35.22 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 CA-C-N 120.338 1.426 . . . . 0.0 112.586 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -60.25 -30.69 69.59 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 112.889 0.699 . . . . 0.0 112.889 171.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 80.0 mt-30 -91.71 -9.17 44.75 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.752 1.221 . . . . 0.0 112.925 175.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 46.2 ttp -64.64 142.07 98.42 Favored Pre-proline 0 CA--C 1.549 0.918 0 O-C-N 121.282 -0.886 . . . . 0.0 110.807 173.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_exo -50.25 162.37 0.86 Allowed 'Trans proline' 0 CA--C 1.542 0.908 0 C-N-CA 123.787 2.991 . . . . 0.0 114.728 169.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 -93.65 -11.55 31.38 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.414 1.086 . . . . 0.0 113.53 172.321 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -124.18 163.2 22.05 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 127.097 2.159 . . . . 0.0 111.07 -175.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -124.93 162.42 24.48 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 114.973 1.471 . . . . 0.0 114.973 -177.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 65.3 t -138.48 135.28 43.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 125.999 1.72 . . . . 0.0 109.889 -176.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -65.38 121.38 14.72 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.338 1.455 . . . . 0.0 111.142 170.206 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 84.4 mt -74.71 150.3 39.53 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.615 0.722 . . . . 0.0 112.4 177.324 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -74.49 160.13 81.88 Favored Pre-proline 0 CA--C 1.546 0.813 0 C-N-CA 124.404 1.082 . . . . 0.0 112.638 173.07 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -69.95 157.34 60.36 Favored 'Trans proline' 0 CA--C 1.546 1.115 0 C-N-CA 123.281 2.654 . . . . 0.0 111.472 171.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -71.35 155.32 60.41 Favored 'Trans proline' 0 CA--C 1.54 0.776 0 C-N-CA 123.018 2.478 . . . . 0.0 111.999 177.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -76.11 151.01 83.67 Favored Pre-proline 0 CA--C 1.55 0.964 0 C-N-CA 123.995 0.918 . . . . 0.0 112.039 175.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -72.15 147.88 49.09 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 123.115 2.544 . . . . 0.0 111.826 174.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 54.9 tttp -72.95 158.16 36.01 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.38 1.072 . . . . 0.0 111.668 173.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . -154.93 179.23 31.13 Favored Glycine 0 CA--C 1.535 1.328 0 C-N-CA 125.289 1.424 . . . . 0.0 113.152 177.118 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 9.8 ptpp? . . . . . 0 C--O 1.252 1.223 0 C-N-CA 126.075 1.75 . . . . 0.0 112.906 -177.464 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.475 0 N-CA-C 111.214 -0.755 . . . . 0.0 111.214 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 51.7 p 63.99 -3.74 0.43 Allowed 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 127.998 2.519 . . . . 0.0 117.576 -179.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.8 t -66.47 110.6 3.19 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.333 1.053 . . . . 0.0 110.942 173.495 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 176.1 -169.26 41.82 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 124.74 1.162 . . . . 0.0 113.335 -174.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 59.3 p -61.8 152.68 30.81 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.434 1.094 . . . . 0.0 113.405 176.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 12.6 t -72.14 -29.03 63.64 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.186 0.994 . . . . 0.0 113.606 -178.055 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 178.03 -169.52 41.4 Favored Glycine 0 CA--C 1.534 1.234 0 C-N-CA 124.675 1.131 . . . . 0.0 113.459 -176.039 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -141.58 163.26 33.4 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.638 1.575 . . . . 0.0 112.56 -176.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 25.2 m -131.93 -13.51 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.336 0 C-N-CA 125.228 1.411 . . . . 0.0 114.14 -169.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 14.2 t -151.03 135.6 17.09 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 125.714 1.605 . . . . 0.0 110.09 178.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 38.2 t-20 -155.21 122.96 2.84 Favored Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 124.54 1.136 . . . . 0.0 110.182 -175.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -77.35 -9.88 17.54 Favored 'Trans proline' 0 CA--C 1.544 1.005 0 C-N-CA 123.776 2.984 . . . . 0.0 114.775 -176.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 62.1 m -113.19 -25.1 9.05 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.757 1.223 . . . . 0.0 113.713 -176.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -64.67 131.27 95.08 Favored Pre-proline 0 CA--C 1.545 0.766 0 C-N-CA 124.863 1.265 . . . . 0.0 110.759 172.425 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -73.06 148.2 44.42 Favored 'Trans proline' 0 CA--C 1.536 0.622 0 C-N-CA 122.696 2.264 . . . . 0.0 112.368 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 162.14 161.48 12.09 Favored Glycine 0 CA--C 1.532 1.12 0 C-N-CA 124.793 1.187 . . . . 0.0 112.855 179.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 33.1 ptt180 -154.91 156.84 36.83 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 126.026 1.73 . . . . 0.0 111.038 177.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.8 tttt -73.38 140.04 46.35 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.444 0.698 . . . . 0.0 110.758 170.107 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 70.0 p -142.13 168.3 20.08 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 126.373 1.869 . . . . 0.0 109.695 -177.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 24.9 p-10 -49.87 -32.87 15.42 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 169.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.3 mm-40 -67.59 -57.04 7.15 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.01 0.924 . . . . 0.0 111.351 178.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 89.6 mt -65.37 -33.32 75.67 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.527 -0.733 . . . . 0.0 112.689 178.167 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -58.45 -50.24 74.44 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.98 0.912 . . . . 0.0 111.318 170.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -59.6 -40.09 86.31 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.543 0.737 . . . . 0.0 112.603 177.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 90.4 mmm -56.38 -49.14 75.29 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 121.86 -0.525 . . . . 0.0 112.331 173.459 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -77.9 -18.38 56.22 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 114.772 1.397 . . . . 0.0 114.772 178.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 56.7 m-20 -102.96 -21.3 13.97 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 -171.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 59.0 t -131.84 -48.61 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 123.989 0.916 . . . . 0.0 111.645 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.4 t -72.31 -66.57 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 CA-C-N 118.863 0.756 . . . . 0.0 110.86 -170.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 89.8 t -58.76 -40.8 80.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 124.157 0.983 . . . . 0.0 110.362 172.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.5 tppp? -54.63 -47.64 73.21 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.892 0.877 . . . . 0.0 112.427 178.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 62.4 m -73.06 -44.33 60.78 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 122.923 0.489 . . . . 0.0 111.624 178.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 55.3 mt -62.86 -32.54 73.79 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.471 0.708 . . . . 0.0 112.426 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 18.0 t-105 -75.26 -30.09 60.36 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.319 1.447 . . . . 0.0 113.192 174.164 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 54.2 mtmt -79.03 -9.14 59.45 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.514 0.931 . . . . 0.0 113.514 175.105 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 35.6 t-80 -62.89 154.53 29.88 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.754 1.222 . . . . 0.0 113.494 -178.106 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -58.11 -24.48 58.86 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.475 1.51 . . . . 0.0 113.815 174.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -123.36 22.23 9.34 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.158 1.383 . . . . 0.0 113.657 -172.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.57 -26.08 63.38 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.725 1.21 . . . . 0.0 113.843 173.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 64.6 p-90 -59.14 -33.9 20.02 Favored Pre-proline 0 CA--C 1.546 0.804 0 N-CA-C 117.735 2.494 . . . . 0.0 117.735 -170.155 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -73.84 -2.61 12.48 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 CA-C-N 123.216 2.184 . . . . 0.0 113.781 173.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -115.75 -2.11 12.49 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.547 1.539 . . . . 0.0 113.474 179.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -63.06 -24.99 68.17 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 120.913 -1.117 . . . . 0.0 113.565 177.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -139.69 153.94 70.62 Favored Pre-proline 0 CA--C 1.543 0.681 0 C-N-CA 126.134 1.774 . . . . 0.0 110.377 -174.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -66.28 142.02 64.94 Favored 'Trans proline' 0 CA--C 1.537 0.652 0 C-N-CA 122.774 2.316 . . . . 0.0 112.569 179.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 49.5 t -59.13 142.31 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 124.452 1.101 . . . . 0.0 111.491 171.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -120.52 95.65 4.81 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.482 1.513 . . . . 0.0 109.536 171.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.25 -27.31 45.55 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.653 1.181 . . . . 0.0 113.877 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 77.9 mt -63.44 -53.46 45.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 124.437 1.095 . . . . 0.0 110.59 173.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 4.3 mptp? -66.16 -35.76 81.33 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.401 1.48 . . . . 0.0 112.707 -179.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 47.1 mt -81.08 -3.3 51.5 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 114.039 1.125 . . . . 0.0 114.039 174.318 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 62.7 t30 54.56 52.93 11.44 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.937 1.695 . . . . 0.0 113.677 -178.318 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 45.9 mt -115.47 80.61 8.02 Favored Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 126.644 1.978 . . . . 0.0 110.431 -177.06 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -67.47 -10.42 28.66 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 123.806 3.004 . . . . 0.0 113.917 -175.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -126.05 22.41 7.31 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.153 1.781 . . . . 0.0 112.397 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 71.6 t80 -51.04 -57.81 7.69 Favored 'General case' 0 N--CA 1.474 0.741 0 O-C-N 120.844 -1.16 . . . . 0.0 112.476 177.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -74.02 -12.7 60.7 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.973 1.309 . . . . 0.0 114.499 -178.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -71.61 -32.97 68.57 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.053 0.941 . . . . 0.0 111.645 177.725 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.9 mp -103.01 -43.51 9.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 125.82 1.648 . . . . 0.0 111.667 -178.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 22.6 mm -61.17 114.82 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 124.231 1.013 . . . . 0.0 110.244 173.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -63.41 -46.1 87.96 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.452 1.101 . . . . 0.0 111.756 179.011 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -156.19 127.94 3.85 Favored Pre-proline 0 CA--C 1.545 0.757 0 C-N-CA 125.606 1.562 . . . . 0.0 110.847 169.389 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -76.45 155.48 36.33 Favored 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 123.564 2.842 . . . . 0.0 112.232 -177.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 33.5 tpp -163.12 140.94 7.9 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.629 1.571 . . . . 0.0 110.115 174.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 25.8 m-20 -139.12 134.97 33.59 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 126.574 1.949 . . . . 0.0 108.42 169.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.5 ttp -46.96 -30.86 2.8 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 127.348 2.259 . . . . 0.0 116.24 -168.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.3 -30.41 40.13 Favored Glycine 0 CA--C 1.54 1.631 0 CA-C-N 119.08 0.854 . . . . 0.0 114.141 172.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 2.2 m -70.89 -35.63 72.41 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 125.259 1.424 . . . . 0.0 112.363 175.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 46.6 mt -67.94 -52.25 41.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.552 1.141 . . . . 0.0 110.008 -176.106 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.49 -40.12 77.94 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 174.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 3.2 tppp? -59.83 -39.85 86.48 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.014 0.926 . . . . 0.0 112.797 179.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 1.5 ptm180 -87.24 -28.35 22.4 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 39.6 mt -61.85 -34.88 76.77 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.127 0.971 . . . . 0.0 112.833 167.052 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -74.31 9.59 1.61 Allowed 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 124.962 1.305 . . . . 0.0 113.758 174.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 46.0 m-80 -129.29 161.02 31.19 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 127.36 2.264 . . . . 0.0 110.015 173.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 10.3 p-10 -78.34 36.89 0.25 Allowed 'General case' 0 CA--C 1.551 1.006 0 O-C-N 120.767 -1.208 . . . . 0.0 112.177 169.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -62.6 -34.18 76.47 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.073 1.349 . . . . 0.0 113.235 -169.604 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -134.54 -179.38 5.55 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 127.089 2.156 . . . . 0.0 111.296 174.851 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 4.3 t-105 -110.97 -26.24 9.38 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.217 1.407 . . . . 0.0 112.789 -177.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 62.1 m -134.29 143.74 47.92 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.664 1.186 . . . . 0.0 112.632 -170.091 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -65.3 -16.18 63.3 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 115.232 1.567 . . . . 0.0 115.232 -177.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 11.4 p -51.83 -36.21 47.3 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.497 1.119 . . . . 0.0 113.476 172.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -69.65 -42.0 74.82 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.764 0.825 . . . . 0.0 112.227 176.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 49.4 t -64.81 -35.33 80.75 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.162 0.985 . . . . 0.0 112.459 172.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 89.4 mtp -66.84 -42.32 85.96 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 121.323 -0.861 . . . . 0.0 111.817 173.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -63.73 -29.62 70.81 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 173.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -66.81 -45.95 76.73 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 119.341 0.973 . . . . 0.0 112.301 171.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -63.37 -41.28 98.8 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 121.322 -0.861 . . . . 0.0 112.687 173.091 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 22.7 t30 -57.66 -46.15 84.6 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.831 -0.543 . . . . 0.0 111.578 172.202 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 81.4 m -56.02 -49.82 72.61 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.19 0.996 . . . . 0.0 111.417 175.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 27.3 ttm -56.72 -61.29 2.53 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.224 1.01 . . . . 0.0 112.313 179.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -63.16 -40.79 98.56 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -175.107 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 66.5 m -66.72 -45.79 77.55 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.442 -0.786 . . . . 0.0 112.167 176.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -63.19 -30.84 71.91 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 120.102 1.319 . . . . 0.0 112.586 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 82.7 m -60.58 -45.17 94.92 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.266 1.026 . . . . 0.0 112.217 170.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -69.71 -29.56 66.99 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 179.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 88.6 mt -71.21 -55.83 12.56 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 CA-C-N 118.41 0.55 . . . . 0.0 110.126 178.027 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -71.3 -30.45 66.26 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 114.567 1.321 . . . . 0.0 114.567 -172.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 44.4 m-80 -113.61 158.25 21.06 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.012 0.925 . . . . 0.0 112.654 -171.011 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -66.16 147.89 98.66 Favored Pre-proline 0 N--CA 1.472 0.672 0 C-N-CA 124.61 1.164 . . . . 0.0 110.834 176.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -65.72 -6.94 15.06 Favored 'Trans proline' 0 CA--C 1.543 0.954 0 C-N-CA 123.828 3.019 . . . . 0.0 114.973 -175.161 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 70.7 p -116.46 1.18 12.93 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 126.265 1.826 . . . . 0.0 113.096 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -67.53 146.04 54.33 Favored 'General case' 0 CA--C 1.541 0.633 0 O-C-N 121.451 -0.781 . . . . 0.0 110.941 174.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -51.97 -46.25 64.74 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.7 0.8 . . . . 0.0 112.808 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 9.6 tp -57.43 -34.56 46.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 124.488 1.115 . . . . 0.0 113.747 179.39 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 45.4 t -69.95 -43.55 79.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 123.428 0.691 . . . . 0.0 110.67 174.203 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 69.5 mt -63.25 -35.8 81.53 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 119.003 0.819 . . . . 0.0 111.94 176.416 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -57.79 -53.4 58.62 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 118.26 0.482 . . . . 0.0 110.738 170.381 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.87 -39.99 91.26 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.483 0.713 . . . . 0.0 112.611 179.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -60.72 -50.12 74.77 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.07 0.85 . . . . 0.0 112.036 174.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.87 -41.33 99.36 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.427 0.691 . . . . 0.0 112.41 -179.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 85.4 mt -65.48 -45.74 82.47 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.635 0.774 . . . . 0.0 111.848 173.472 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -60.37 -43.24 96.74 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.566 1.075 . . . . 0.0 113.165 -176.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 66.1 mttt -58.23 -38.24 76.46 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.53 0.732 . . . . 0.0 111.857 178.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 70.1 mt -78.16 -41.62 26.84 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 123.406 0.682 . . . . 0.0 111.729 176.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 29.2 t80 -50.42 -51.57 45.26 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 119.131 0.878 . . . . 0.0 110.413 172.448 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 99.4 mt -62.04 -42.48 99.22 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.891 0.7 . . . . 0.0 112.891 178.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -67.89 -30.65 70.05 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 120.009 1.277 . . . . 0.0 112.755 179.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 69.2 mmtt -75.52 -48.39 22.76 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 117.616 -1.183 . . . . 0.0 112.435 175.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.7 m -68.43 -25.98 32.51 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 CA-C-N 121.094 1.77 . . . . 0.0 112.362 177.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -59.85 -31.12 69.46 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.748 -0.595 . . . . 0.0 112.431 171.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 21.6 mm100 -89.97 -5.85 56.26 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.125 1.37 . . . . 0.0 113.027 176.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 40.8 ttp -63.43 137.26 97.03 Favored Pre-proline 0 CA--C 1.546 0.819 0 C-N-CA 123.802 0.841 . . . . 0.0 110.418 171.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_endo -61.63 148.7 92.42 Favored 'Trans proline' 0 CA--C 1.534 0.514 0 C-N-CA 122.601 2.201 . . . . 0.0 111.023 174.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 -92.09 -13.46 30.77 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -174.487 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 9.5 mp0 -100.01 150.54 22.33 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 126.184 1.794 . . . . 0.0 111.862 176.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -98.84 140.93 32.28 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.04 1.336 . . . . 0.0 110.315 177.237 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 8.5 p -146.29 138.04 19.34 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 CA-C-O 122.299 1.047 . . . . 0.0 111.162 169.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -65.51 131.84 47.39 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.452 1.901 . . . . 0.0 111.64 176.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 98.6 mt -78.0 150.36 33.91 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 114.068 1.136 . . . . 0.0 114.068 -177.095 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 4.4 pp -73.43 154.88 89.89 Favored Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 124.738 1.215 . . . . 0.0 111.118 168.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -76.78 145.61 25.75 Favored 'Trans proline' 0 CA--C 1.547 1.139 0 C-N-CA 122.882 2.388 . . . . 0.0 112.529 -177.157 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -73.19 170.21 20.4 Favored 'Trans proline' 0 CA--C 1.543 0.929 0 C-N-CA 123.733 2.956 . . . . 0.0 112.574 175.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -145.97 150.94 43.99 Favored Pre-proline 0 CA--C 1.55 0.959 0 C-N-CA 124.83 1.252 . . . . 0.0 112.072 177.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -76.97 75.02 4.74 Favored 'Trans proline' 0 CA--C 1.545 1.041 0 C-N-CA 124.663 3.575 . . . . 0.0 112.231 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -54.46 -35.21 62.78 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 125.465 1.506 . . . . 0.0 113.744 179.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . 172.84 170.32 36.41 Favored Glycine 0 CA--C 1.536 1.357 0 C-N-CA 124.966 1.27 . . . . 0.0 113.55 174.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.253 1.266 0 C-N-CA 125.118 1.367 . . . . 0.0 113.864 173.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.463 0 N-CA-C 111.138 -0.785 . . . . 0.0 111.138 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 19.4 m -68.32 -16.64 64.02 Favored 'General case' 0 N--CA 1.479 1.007 0 N-CA-C 114.876 1.435 . . . . 0.0 114.876 -176.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.4 t -152.98 159.95 42.97 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.52 1.528 . . . . 0.0 111.269 176.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 70.51 -171.88 43.18 Favored Glycine 0 CA--C 1.536 1.394 0 C-N-CA 124.544 1.068 . . . . 0.0 114.22 -176.041 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 25.0 m -135.96 -14.6 1.82 Allowed 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 114.772 1.397 . . . . 0.0 114.772 -177.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.3 t -71.6 127.08 31.42 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 119.574 1.079 . . . . 0.0 110.996 173.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 153.51 -32.05 0.77 Allowed Glycine 0 CA--C 1.533 1.16 0 C-N-CA 126.488 1.994 . . . . 0.0 110.923 -175.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 26.4 pt-20 -64.58 162.84 14.75 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.475 1.51 . . . . 0.0 112.691 168.602 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.6 m -133.96 5.38 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 C-N-CA 125.71 1.604 . . . . 0.0 113.107 -177.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 12.7 t -149.9 168.69 23.06 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 127.414 2.286 . . . . 0.0 110.055 176.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -140.11 143.78 35.27 Favored Pre-proline 0 CA--C 1.548 0.872 0 C-N-CA 124.707 1.203 . . . . 0.0 113.342 -171.523 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -80.26 -20.25 8.61 Favored 'Trans proline' 0 CA--C 1.542 0.878 0 C-N-CA 123.829 3.019 . . . . 0.0 114.332 -179.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 18.7 t -156.48 -32.63 0.09 Allowed 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 114.656 1.354 . . . . 0.0 114.656 -173.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 21.3 ttpp -54.31 136.99 59.91 Favored Pre-proline 0 N--CA 1.478 0.97 0 C-N-CA 124.831 1.252 . . . . 0.0 112.292 -178.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -71.95 161.24 45.46 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 C-N-CA 122.786 2.324 . . . . 0.0 113.731 179.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 174.68 156.66 14.43 Favored Glycine 0 CA--C 1.536 1.394 0 C-N-CA 126.874 2.178 . . . . 0.0 111.766 172.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 34.6 ptt180 -153.02 152.57 31.52 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.471 1.508 . . . . 0.0 110.675 172.169 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 74.0 tttt -71.75 139.24 48.99 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.362 0.665 . . . . 0.0 110.4 169.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 61.9 p -140.41 168.56 19.52 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.864 1.666 . . . . 0.0 110.421 -176.468 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 26.2 p-10 -48.94 -37.36 19.75 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 114.29 1.219 . . . . 0.0 114.29 172.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -72.11 -46.17 57.7 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 121.521 -0.737 . . . . 0.0 111.767 178.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 79.4 mt -65.44 -32.62 74.34 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 121.805 -0.559 . . . . 0.0 112.222 175.097 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 44.3 tt0 -59.6 -52.48 65.36 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 123.292 0.637 . . . . 0.0 109.863 168.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -56.4 -41.38 76.2 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.503 0.721 . . . . 0.0 112.516 179.179 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 89.9 mmm -57.15 -56.03 27.08 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 118.303 0.502 . . . . 0.0 112.017 171.496 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.2 pt20 -77.46 -11.53 59.86 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.952 1.464 . . . . 0.0 114.952 -175.243 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -115.48 -21.14 9.92 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.771 1.228 . . . . 0.0 113.334 -169.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 16.0 t -129.2 -51.4 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 C-N-CA 123.225 0.61 . . . . 0.0 111.229 -179.243 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.5 t -68.04 -63.01 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 123.246 0.618 . . . . 0.0 110.469 -176.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 69.0 t -57.79 -48.36 83.86 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 124.518 1.127 . . . . 0.0 110.523 174.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm -58.22 -44.34 88.16 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 118.482 0.583 . . . . 0.0 112.24 -175.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 40.5 m -71.01 -43.05 68.75 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 177.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 75.7 mt -63.16 -33.83 76.31 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.291 0.636 . . . . 0.0 112.355 176.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . 0.469 ' CZ3' ' HE3' ' A' ' 87' ' ' LYS . 19.3 t-105 -70.75 -28.33 64.61 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.741 1.616 . . . . 0.0 113.353 175.056 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.4 mtmp? -83.92 -4.13 58.47 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.291 1.036 . . . . 0.0 113.533 176.122 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 36.1 t-80 -65.99 158.91 27.01 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.902 1.281 . . . . 0.0 113.301 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -58.84 -24.53 62.15 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.518 1.527 . . . . 0.0 113.88 175.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 -125.4 22.1 7.79 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.802 1.241 . . . . 0.0 114.057 -171.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.72 -28.27 65.68 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 176.211 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . 0.401 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 45.0 p-90 -56.69 -37.6 59.41 Favored Pre-proline 0 CA--C 1.547 0.855 0 N-CA-C 117.324 2.342 . . . . 0.0 117.324 -170.911 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.401 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 64.0 Cg_endo -70.22 -5.53 16.72 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 CA-C-N 123.042 2.122 . . . . 0.0 114.592 172.325 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 80.7 m-85 -113.19 -1.06 14.45 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.345 1.458 . . . . 0.0 113.302 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -64.02 -17.83 63.72 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 113.914 1.079 . . . . 0.0 113.914 175.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 -142.88 157.06 62.01 Favored Pre-proline 0 CA--C 1.546 0.797 0 C-N-CA 125.958 1.703 . . . . 0.0 111.047 -172.311 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -65.42 152.48 81.85 Favored 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 122.998 2.465 . . . . 0.0 112.34 173.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 36.5 t -71.85 144.75 12.92 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 124.485 1.114 . . . . 0.0 110.56 177.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -128.97 97.07 4.52 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.197 1.399 . . . . 0.0 110.604 178.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.0 -28.46 57.35 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.563 1.145 . . . . 0.0 113.858 178.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 82.6 mt -66.72 -49.34 75.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 125.071 1.348 . . . . 0.0 111.021 174.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 9.6 mtpm? -67.75 -37.73 82.54 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.636 1.174 . . . . 0.0 112.745 -179.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 85.0 mt -90.63 -1.2 57.88 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.952 1.701 . . . . 0.0 113.513 -177.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 51.96 57.43 6.51 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 125.754 1.622 . . . . 0.0 113.296 -178.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 53.9 mt -113.6 83.59 7.25 Favored Pre-proline 0 CA--C 1.547 0.854 0 C-N-CA 125.9 1.68 . . . . 0.0 110.655 -177.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -67.66 -11.6 32.68 Favored 'Trans proline' 0 CA--C 1.541 0.858 0 C-N-CA 123.975 3.117 . . . . 0.0 114.61 -170.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.4 ' HA ' ' HE3' ' A' ' 75' ' ' LYS . 40.9 m-20 -125.8 21.53 7.61 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.416 1.486 . . . . 0.0 113.048 177.878 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -48.28 -55.39 10.7 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 121.212 -0.93 . . . . 0.0 113.009 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -77.39 -16.25 58.94 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 114.672 1.36 . . . . 0.0 114.672 -177.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.4 ' HE3' ' HA ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -68.66 -39.64 80.54 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.141 -0.975 . . . . 0.0 111.714 172.656 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.3 mp -88.65 -46.2 15.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 124.35 1.06 . . . . 0.0 111.189 175.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 32.3 mm -80.34 104.51 8.78 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-O 121.685 0.755 . . . . 0.0 111.189 178.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -69.34 -36.65 77.11 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.84 1.256 . . . . 0.0 112.578 174.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -146.35 103.46 4.04 Favored Pre-proline 0 CA--C 1.547 0.83 0 C-N-CA 125.69 1.596 . . . . 0.0 110.686 -178.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -76.32 149.17 31.16 Favored 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 123.403 2.735 . . . . 0.0 111.232 174.191 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 6.8 tpt -157.83 148.66 21.02 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.726 1.211 . . . . 0.0 111.105 177.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -150.56 154.85 38.33 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.771 1.628 . . . . 0.0 111.533 -178.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 4.5 ttp -64.07 -33.23 75.28 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.911 0.885 . . . . 0.0 113.369 -174.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.67 -44.97 97.26 Favored Glycine 0 CA--C 1.532 1.138 0 C-N-CA 124.697 1.141 . . . . 0.0 112.899 173.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 57.7 m -68.56 -39.78 80.91 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 121.789 -0.83 . . . . 0.0 111.827 172.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 95.3 mt -55.56 -53.23 38.82 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 CA-C-N 120.104 1.32 . . . . 0.0 111.22 176.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.469 ' HE3' ' CZ3' ' A' ' 51' ' ' TRP . 16.3 ptpt -59.74 -30.52 68.89 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 177.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm -66.83 -44.9 79.91 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.814 0.846 . . . . 0.0 112.867 177.037 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 6.9 ptp180 -75.17 -19.6 59.77 Favored 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 172.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 46.3 mt -70.76 -51.55 26.41 Favored 'General case' 0 CA--C 1.543 0.673 0 CA-C-N 119.152 0.887 . . . . 0.0 111.328 167.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -71.46 -41.53 69.29 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 113.461 0.912 . . . . 0.0 113.461 -176.315 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -86.34 110.75 19.89 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 169.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 46.2 t30 -48.79 115.63 1.33 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.54 1.136 . . . . 0.0 112.915 -175.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 54.7 t80 -137.0 -26.76 1.02 Allowed 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 114.365 1.246 . . . . 0.0 114.365 -172.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -138.56 170.79 15.38 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.801 1.24 . . . . 0.0 112.708 178.196 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 8.8 t-105 -99.92 -21.45 15.67 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.136 1.375 . . . . 0.0 112.657 -176.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.7 p -141.42 148.29 39.32 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.452 1.501 . . . . 0.0 113.105 -169.53 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -72.19 -17.18 61.95 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 115.221 1.563 . . . . 0.0 115.221 -176.359 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 5.7 p -52.88 -37.03 60.02 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.033 0.933 . . . . 0.0 113.004 174.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -67.45 -43.72 80.4 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.705 -0.622 . . . . 0.0 112.474 178.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 45.4 t -60.17 -40.77 91.1 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.119 0.968 . . . . 0.0 112.617 170.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 83.9 mtp -62.35 -42.61 99.53 Favored 'General case' 0 N--CA 1.473 0.679 0 O-C-N 121.303 -0.873 . . . . 0.0 112.579 176.136 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 58.0 mm-40 -66.45 -32.99 74.7 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 173.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -66.46 -41.27 89.33 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 120.736 -1.227 . . . . 0.0 111.922 171.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -60.67 -45.49 93.95 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.264 -0.898 . . . . 0.0 112.47 170.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.91 -42.62 94.3 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.434 -0.791 . . . . 0.0 110.924 173.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 88.0 m -60.26 -40.23 89.59 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.976 0.91 . . . . 0.0 111.883 178.312 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 17.2 ttm -57.31 -59.61 4.87 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 119.001 0.819 . . . . 0.0 111.534 173.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -64.17 -43.46 95.08 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -176.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 97.5 m -63.71 -47.44 81.13 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.973 0.909 . . . . 0.0 112.054 179.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -64.2 -34.25 77.66 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-N 119.711 1.142 . . . . 0.0 112.224 -179.079 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 24.6 m -58.4 -43.8 88.71 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 113.232 0.827 . . . . 0.0 113.232 170.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 14.9 m-85 -68.45 -29.1 67.67 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.861 1.06 . . . . 0.0 113.861 178.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 86.8 mt -70.08 -56.57 10.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 123.27 0.628 . . . . 0.0 110.647 176.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -69.33 -35.3 75.78 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 114.371 1.248 . . . . 0.0 114.371 -173.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 55.6 m-80 -105.58 154.96 19.68 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.25 1.02 . . . . 0.0 111.535 -172.423 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 53.3 mttm -68.3 151.58 97.12 Favored Pre-proline 0 N--CA 1.471 0.577 0 C-N-CA 123.988 0.915 . . . . 0.0 111.037 175.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -65.24 -1.03 3.97 Favored 'Trans proline' 0 CA--C 1.547 1.168 0 C-N-CA 123.601 2.868 . . . . 0.0 114.763 -179.238 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 52.0 p -117.67 -2.41 11.43 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 127.123 2.169 . . . . 0.0 113.151 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 -69.31 144.38 53.55 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 118.966 0.803 . . . . 0.0 110.648 171.106 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -56.29 -46.27 79.83 Favored 'General case' 0 N--CA 1.471 0.616 0 O-C-N 121.649 -0.657 . . . . 0.0 112.514 -175.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.4 tp -54.42 -30.29 21.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 125.118 1.367 . . . . 0.0 114.209 177.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 45.5 t -72.81 -47.18 50.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 O-C-N 121.422 -0.798 . . . . 0.0 110.555 174.015 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 71.8 mt -61.46 -37.08 82.27 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 118.93 0.786 . . . . 0.0 111.599 176.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 7.7 mtt -59.01 -51.91 68.01 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.921 1.288 . . . . 0.0 111.971 169.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.28 -39.65 87.63 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.353 0.661 . . . . 0.0 112.72 176.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 89.3 mt-30 -62.41 -45.36 93.45 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 119.24 0.927 . . . . 0.0 111.902 174.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -67.41 -29.69 69.26 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.246 1.018 . . . . 0.0 113.615 179.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 81.5 mt -76.14 -48.52 20.3 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.832 0.853 . . . . 0.0 111.49 169.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -62.05 -37.81 86.39 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 113.376 0.88 . . . . 0.0 113.376 -173.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 59.5 pttt -58.9 -44.21 91.15 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 121.593 -0.692 . . . . 0.0 111.679 176.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 65.9 mt -70.99 -39.97 75.71 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 124.413 1.085 . . . . 0.0 110.91 176.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -51.11 -49.5 60.64 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.903 1.229 . . . . 0.0 110.808 171.43 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.7 mt -63.9 -39.68 94.75 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 176.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -57.3 -41.09 79.17 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-N 119.688 1.131 . . . . 0.0 112.652 172.184 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 36.7 mmtm -75.69 -48.83 20.32 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.961 1.304 . . . . 0.0 111.786 -175.309 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.8 m -68.78 -25.96 31.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 CA-C-N 120.121 1.328 . . . . 0.0 112.218 176.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -61.59 -28.3 69.25 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 121.495 -0.753 . . . . 0.0 112.449 171.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -96.51 1.73 51.73 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.399 1.48 . . . . 0.0 112.687 177.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 8.9 ttm -54.28 141.53 51.71 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 124.951 1.3 . . . . 0.0 112.482 174.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -67.6 114.84 3.44 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 123.076 2.517 . . . . 0.0 109.233 168.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -71.44 -20.58 62.08 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 -169.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -84.41 160.24 20.65 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.74 1.616 . . . . 0.0 112.056 177.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -116.43 133.07 56.44 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.116 1.367 . . . . 0.0 110.986 178.04 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 13.0 p -149.28 142.94 18.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 C-N-CA 124.848 1.259 . . . . 0.0 111.286 173.027 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -70.77 137.75 49.86 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.656 1.182 . . . . 0.0 111.636 176.066 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 95.9 mt -79.19 152.53 30.63 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 114.058 1.133 . . . . 0.0 114.058 -175.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 4.4 pp -76.79 154.98 83.3 Favored Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 124.715 1.206 . . . . 0.0 110.875 168.032 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.94 142.23 24.87 Favored 'Trans proline' 0 CA--C 1.547 1.136 0 C-N-CA 122.889 2.393 . . . . 0.0 112.207 -177.497 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -73.44 161.47 42.4 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 123.389 2.726 . . . . 0.0 112.669 178.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -65.98 153.13 92.29 Favored Pre-proline 0 CA--C 1.553 1.066 0 C-N-CA 124.097 0.959 . . . . 0.0 112.446 173.205 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -77.38 36.94 0.57 Allowed 'Trans proline' 0 CA--C 1.551 1.363 0 C-N-CA 124.949 3.766 . . . . 0.0 113.21 177.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -58.14 128.12 35.52 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.657 1.583 . . . . 0.0 111.519 -177.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . 78.65 -41.85 2.17 Favored Glycine 0 CA--C 1.539 1.538 0 C-N-CA 125.585 1.564 . . . . 0.0 115.115 176.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 64.6 tttm . . . . . 0 C--O 1.252 1.231 0 C-N-CA 126.085 1.754 . . . . 0.0 111.723 178.716 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.45 0 N-CA-C 110.718 -0.953 . . . . 0.0 110.718 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 20.9 m -145.91 36.92 1.05 Allowed 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 124.836 1.254 . . . . 0.0 112.37 -170.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.6 t -139.36 178.9 6.86 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 125.088 1.355 . . . . 0.0 112.885 -173.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -166.67 -166.42 25.71 Favored Glycine 0 CA--C 1.535 1.338 0 C-N-CA 125.923 1.725 . . . . 0.0 113.276 -173.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 82.9 p -145.48 168.64 20.07 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 124.98 1.312 . . . . 0.0 113.428 -173.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.4 t -67.71 164.67 18.85 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.034 1.334 . . . . 0.0 113.391 179.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 159.4 -0.24 0.08 OUTLIER Glycine 0 CA--C 1.538 1.486 0 N-CA-C 116.868 1.507 . . . . 0.0 116.868 175.556 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -61.64 140.35 58.17 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 119.26 1.53 . . . . 0.0 114.089 -177.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 29.8 m -148.46 -27.57 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.438 0 C-N-CA 125.768 1.627 . . . . 0.0 114.452 179.269 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 49.9 m -146.53 130.16 16.96 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.267 1.427 . . . . 0.0 111.549 -177.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 58.3 t30 -159.35 124.86 2.3 Favored Pre-proline 0 CA--C 1.546 0.8 0 C-N-CA 125.558 1.543 . . . . 0.0 109.606 176.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -75.16 -170.44 0.79 Allowed 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 123.706 2.937 . . . . 0.0 110.658 171.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 31.9 m 51.9 22.17 1.68 Allowed 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 126.621 1.969 . . . . 0.0 115.13 -173.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 28.0 ttpp -139.41 131.39 15.1 Favored Pre-proline 0 N--CA 1.476 0.841 0 C-N-CA 126.688 1.995 . . . . 0.0 110.423 -175.16 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_endo -75.35 156.56 41.45 Favored 'Trans proline' 0 CA--C 1.539 0.751 0 C-N-CA 123.078 2.519 . . . . 0.0 113.496 -174.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 174.45 166.33 32.29 Favored Glycine 0 CA--C 1.533 1.207 0 C-N-CA 126.329 1.919 . . . . 0.0 111.753 174.066 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 34.9 ptt180 -162.83 161.2 25.92 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.918 1.687 . . . . 0.0 110.693 179.317 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 46.6 mttp -76.93 141.23 40.57 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 121.398 0.618 . . . . 0.0 110.425 167.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 81.0 p -141.04 164.16 31.02 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 125.585 1.554 . . . . 0.0 110.004 176.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -52.68 -30.97 34.82 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 170.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.4 mm-40 -67.9 -54.74 16.45 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.884 0.874 . . . . 0.0 111.188 177.144 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.3 mt -65.03 -32.88 74.82 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 121.489 -0.757 . . . . 0.0 112.52 176.326 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 53.4 tt0 -57.16 -52.81 63.8 Favored 'General case' 0 C--O 1.224 -0.26 0 C-N-CA 123.977 0.911 . . . . 0.0 110.92 170.065 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -60.21 -41.18 92.49 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.453 0.701 . . . . 0.0 112.596 179.197 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 93.9 mmm -55.85 -48.35 75.67 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 121.747 -0.595 . . . . 0.0 111.794 171.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -86.42 -5.57 59.13 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 115.114 1.524 . . . . 0.0 115.114 -175.739 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 30.6 m-20 -117.0 -18.36 10.12 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 125.157 1.383 . . . . 0.0 113.481 -176.117 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 46.9 t -133.85 -50.66 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 123.934 0.894 . . . . 0.0 111.686 179.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.0 t -71.54 -67.48 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-N 119.407 1.003 . . . . 0.0 110.802 -171.468 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 59.1 t -57.61 -41.85 80.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 123.655 0.782 . . . . 0.0 109.965 171.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.74 -45.02 86.44 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 118.87 0.759 . . . . 0.0 113.005 -177.604 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 62.4 m -71.76 -44.46 64.0 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 122.925 0.49 . . . . 0.0 111.364 176.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 66.6 mt -62.0 -32.49 72.97 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.572 0.749 . . . . 0.0 112.277 178.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 16.9 t-105 -73.17 -29.53 62.92 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.022 1.729 . . . . 0.0 112.955 176.066 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 56.5 mtmt -84.25 -5.28 59.24 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.256 1.022 . . . . 0.0 113.462 176.568 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 37.3 t-80 -65.02 156.18 32.23 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.695 1.198 . . . . 0.0 113.564 -178.439 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 18.4 tp60 -58.74 -20.82 52.62 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.604 1.562 . . . . 0.0 114.057 174.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -125.12 19.97 8.26 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.399 1.479 . . . . 0.0 113.791 -174.44 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.3 -30.01 65.73 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 177.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . 0.415 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 39.4 p-90 -54.57 -37.84 59.34 Favored Pre-proline 0 CA--C 1.547 0.863 0 N-CA-C 117.094 2.257 . . . . 0.0 117.094 -172.517 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.415 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 56.9 Cg_endo -67.99 -7.28 19.29 Favored 'Trans proline' 0 C--N 1.354 0.866 0 CA-C-N 122.959 2.092 . . . . 0.0 115.012 172.785 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 72.7 m-85 -114.5 -1.45 13.43 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.132 1.373 . . . . 0.0 113.284 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 20.1 m-30 -65.18 -22.53 66.92 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 113.458 0.91 . . . . 0.0 113.458 176.212 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -138.4 155.46 73.89 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 126.515 1.926 . . . . 0.0 110.005 -176.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -67.24 147.63 78.95 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 122.571 2.18 . . . . 0.0 112.4 178.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 76.6 t -59.75 142.34 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 123.903 0.881 . . . . 0.0 111.258 170.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -122.97 101.24 7.31 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 125.689 1.596 . . . . 0.0 109.497 171.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.27 -27.23 61.91 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 -179.26 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 84.3 mt -64.81 -49.61 79.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 124.855 1.262 . . . . 0.0 110.846 172.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -68.36 -42.31 79.37 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.97 1.308 . . . . 0.0 112.788 -178.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.4 mp -80.74 -4.32 54.04 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.358 1.063 . . . . 0.0 113.329 176.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 61.7 t30 55.02 56.28 6.76 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 126.266 1.826 . . . . 0.0 113.501 -179.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 51.5 mt -115.28 84.05 11.04 Favored Pre-proline 0 CA--C 1.545 0.77 0 C-N-CA 126.312 1.845 . . . . 0.0 110.741 -175.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -68.3 -3.88 11.71 Favored 'Trans proline' 0 CA--C 1.544 1.009 0 C-N-CA 123.945 3.097 . . . . 0.0 114.633 -174.368 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -131.24 14.78 5.11 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 126.051 1.74 . . . . 0.0 112.528 -178.681 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 40.9 t80 -51.13 -55.05 19.75 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 120.729 -1.232 . . . . 0.0 113.364 -173.212 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -79.44 -9.44 59.6 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.346 1.059 . . . . 0.0 113.854 178.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -70.65 -47.27 60.88 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.006 0.922 . . . . 0.0 110.337 177.325 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.9 mp -77.11 -50.39 20.85 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 C-N-CA 124.137 0.975 . . . . 0.0 109.84 172.096 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 40.9 mm -91.4 103.04 14.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 CA-C-O 122.48 1.134 . . . . 0.0 112.097 -171.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt -68.06 -32.26 72.48 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.936 1.694 . . . . 0.0 113.487 179.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -147.59 91.67 4.94 Favored Pre-proline 0 CA--C 1.545 0.761 0 C-N-CA 125.715 1.606 . . . . 0.0 110.209 -178.044 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -78.76 159.61 27.97 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 123.499 2.799 . . . . 0.0 111.356 174.522 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 40.8 mmm -147.05 160.87 41.88 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.522 1.129 . . . . 0.0 112.751 168.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -146.81 146.79 30.36 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 127.099 2.159 . . . . 0.0 110.228 175.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.2 ttp -61.84 -35.19 77.55 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.163 0.985 . . . . 0.0 113.63 -170.362 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -57.87 -42.4 94.65 Favored Glycine 0 CA--C 1.531 1.075 0 C-N-CA 123.831 0.729 . . . . 0.0 113.219 177.448 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 19.7 m -67.13 -41.58 85.9 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.826 0.85 . . . . 0.0 111.602 176.147 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 95.0 mt -60.02 -52.06 65.58 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 124.257 1.023 . . . . 0.0 110.493 177.444 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 25.2 ttpp -57.75 -37.4 73.56 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 125.417 1.487 . . . . 0.0 112.888 176.391 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 34.0 ttmt -62.69 -41.88 99.34 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 113.458 0.91 . . . . 0.0 113.458 178.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -74.03 -27.09 60.77 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 114.537 1.31 . . . . 0.0 114.537 172.777 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 62.5 mt -61.8 -48.62 79.78 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 118.675 0.67 . . . . 0.0 111.29 168.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -59.29 -42.01 90.28 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.054 0.942 . . . . 0.0 111.977 176.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 -83.51 2.56 36.34 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 125.086 1.354 . . . . 0.0 113.987 179.371 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 34.86 56.72 0.74 Allowed 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 127.579 2.352 . . . . 0.0 115.091 -171.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 71.2 t80 -58.83 -24.37 61.91 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 127.358 2.263 . . . . 0.0 114.948 -176.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -133.22 -175.48 3.81 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 129.043 2.937 . . . . 0.0 111.568 -169.852 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 14.4 t-105 -110.45 -27.45 9.01 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.382 1.073 . . . . 0.0 113.142 -171.511 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 16.9 m -145.95 151.69 38.22 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.724 1.21 . . . . 0.0 112.703 -171.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -66.0 -21.23 66.39 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 116.502 2.038 . . . . 0.0 116.502 -172.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 47.0 t -53.85 -36.7 62.88 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 119.282 0.946 . . . . 0.0 112.552 178.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -65.86 -44.78 84.39 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 121.088 -1.008 . . . . 0.0 112.015 179.087 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 53.1 t -57.92 -41.91 83.68 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.088 0.955 . . . . 0.0 112.37 171.123 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 79.9 mtp -61.86 -40.33 94.99 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.999 0.92 . . . . 0.0 112.975 175.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 65.0 mt-30 -62.57 -37.32 85.72 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.093 0.957 . . . . 0.0 112.682 175.269 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -71.96 -33.91 68.55 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.0 -1.063 . . . . 0.0 113.281 174.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -64.25 -45.0 90.07 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 119.346 0.975 . . . . 0.0 112.212 169.538 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 24.1 t30 -56.27 -42.12 76.95 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.866 -0.521 . . . . 0.0 111.534 171.502 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 60.4 m -64.98 -39.57 93.68 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.128 0.971 . . . . 0.0 112.491 176.357 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 21.1 ttm -58.98 -61.09 2.9 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.941 0.897 . . . . 0.0 111.352 174.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -62.91 -39.79 95.63 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 -176.351 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 90.5 m -65.11 -47.33 77.53 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.195 0.598 . . . . 0.0 112.07 178.424 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -64.71 -32.53 74.25 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 119.615 1.098 . . . . 0.0 112.549 -179.227 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 55.9 m -59.8 -45.15 93.2 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.717 0.807 . . . . 0.0 112.543 169.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 14.3 m-85 -67.84 -32.55 73.15 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 177.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 85.6 mt -69.41 -58.19 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 123.576 0.75 . . . . 0.0 111.05 176.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 43.2 t80 -68.31 -34.61 76.45 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 114.246 1.202 . . . . 0.0 114.246 -170.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 60.5 m-80 -101.03 164.7 11.68 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.51 1.124 . . . . 0.0 111.987 -173.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -72.61 150.84 91.32 Favored Pre-proline 0 N--CA 1.476 0.836 0 O-C-N 121.368 -0.833 . . . . 0.0 109.921 170.25 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -66.08 -1.65 5.62 Favored 'Trans proline' 0 CA--C 1.546 1.108 0 C-N-CA 123.393 2.728 . . . . 0.0 114.68 -178.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 50.7 p -118.24 -1.34 11.35 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.994 2.118 . . . . 0.0 113.113 -179.056 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 54.4 m-20 -67.46 145.9 54.53 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.535 -0.728 . . . . 0.0 110.822 170.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -56.22 -46.69 79.4 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.619 -0.675 . . . . 0.0 112.406 -176.068 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.5 tp -54.73 -29.13 20.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 125.227 1.411 . . . . 0.0 114.442 177.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 38.6 t -73.17 -45.57 53.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 O-C-N 121.281 -0.887 . . . . 0.0 110.517 173.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 73.5 mt -63.31 -36.87 85.12 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 118.977 0.808 . . . . 0.0 111.405 176.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 7.6 mtt -59.17 -52.11 67.12 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.019 1.328 . . . . 0.0 111.648 169.541 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.54 -38.8 85.64 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.483 0.713 . . . . 0.0 112.707 176.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -62.74 -49.41 75.15 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.955 0.798 . . . . 0.0 112.146 174.049 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -61.25 -39.51 90.62 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.493 0.717 . . . . 0.0 112.295 179.595 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 80.5 mt -66.08 -48.42 71.02 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.487 0.715 . . . . 0.0 111.872 170.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -62.27 -39.72 93.85 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 120.78 -1.2 . . . . 0.0 113.53 -175.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 14.2 mttm -60.02 -29.33 68.42 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.672 0.789 . . . . 0.0 112.595 174.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 59.4 mt -86.61 -39.98 13.79 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 C-N-CA 123.615 0.766 . . . . 0.0 112.055 174.134 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 35.6 t80 -50.43 -53.17 31.49 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.366 0.985 . . . . 0.0 110.455 172.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.2 mt -62.97 -40.24 97.1 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 112.951 0.723 . . . . 0.0 112.951 -179.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.5 pt20 -71.33 -29.67 65.28 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 119.694 1.134 . . . . 0.0 112.847 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -75.69 -48.44 21.97 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 117.638 -1.173 . . . . 0.0 112.439 174.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 6.1 m -66.97 -26.28 36.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 CA-C-N 121.031 1.741 . . . . 0.0 112.075 177.033 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -60.64 -29.99 69.6 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 172.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -89.99 -6.25 55.83 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 124.712 1.205 . . . . 0.0 112.838 175.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 39.7 ttp -63.77 139.45 97.63 Favored Pre-proline 0 CA--C 1.547 0.847 0 O-C-N 121.251 -0.906 . . . . 0.0 110.278 170.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -63.75 154.62 68.34 Favored 'Trans proline' 0 CA--C 1.538 0.699 0 C-N-CA 122.758 2.305 . . . . 0.0 111.907 175.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 20.1 mm100 -84.54 -18.07 36.89 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 176.055 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -96.35 155.22 16.86 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.357 1.463 . . . . 0.0 112.934 -179.441 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -122.32 138.25 54.57 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.652 1.181 . . . . 0.0 111.065 -175.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 9.7 p -145.16 140.08 22.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 C-N-CA 125.289 1.436 . . . . 0.0 110.672 176.121 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -70.24 135.78 49.32 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.67 1.188 . . . . 0.0 111.354 176.385 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 84.1 mt -72.25 132.27 43.85 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 -173.04 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 4.4 pp -67.5 154.63 92.78 Favored Pre-proline 0 CA--C 1.551 0.997 0 C-N-CA 124.687 1.195 . . . . 0.0 111.08 169.044 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -72.17 140.95 35.1 Favored 'Trans proline' 0 CA--C 1.544 0.979 0 C-N-CA 122.578 2.185 . . . . 0.0 111.922 -175.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -72.13 159.99 48.48 Favored 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 123.225 2.617 . . . . 0.0 112.774 -178.381 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -66.41 153.78 92.12 Favored Pre-proline 0 CA--C 1.552 1.056 0 C-N-CA 124.205 1.002 . . . . 0.0 112.619 174.244 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -70.25 168.92 20.81 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 123.431 2.754 . . . . 0.0 112.301 172.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 14.9 ptmm? -143.74 157.5 44.34 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.136 1.374 . . . . 0.0 112.82 -178.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . 165.8 174.59 35.46 Favored Glycine 0 CA--C 1.537 1.423 0 C-N-CA 125.548 1.547 . . . . 0.0 112.937 179.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 19.8 ptpt . . . . . 0 C--O 1.252 1.221 0 C-N-CA 124.754 1.222 . . . . 0.0 113.612 173.722 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.525 0 N-CA-C 111.51 -0.636 . . . . 0.0 111.51 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 33.6 t -63.8 145.33 55.99 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.923 0.889 . . . . 0.0 113.098 178.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 67.7 p -72.79 172.72 10.26 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.177 0.991 . . . . 0.0 110.341 166.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 73.75 21.83 78.9 Favored Glycine 0 CA--C 1.535 1.331 0 O-C-N 121.512 -0.743 . . . . 0.0 114.673 177.606 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 8.1 t -58.06 -19.05 28.81 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.263 1.425 . . . . 0.0 113.763 177.356 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 64.8 p -57.78 -26.84 62.47 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.874 1.669 . . . . 0.0 114.219 169.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 57.57 28.37 59.67 Favored Glycine 0 CA--C 1.538 1.492 0 C-N-CA 124.478 1.037 . . . . 0.0 113.835 -172.399 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -62.22 151.48 36.05 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 -169.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 20.9 m -137.42 -4.57 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 C-N-CA 125.8 1.64 . . . . 0.0 113.944 -170.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 43.3 p -149.12 140.44 23.21 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 126.236 1.814 . . . . 0.0 110.302 179.001 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.411 ' HB2' ' HE3' ' A' ' 31' ' ' LYS . 51.4 p30 -144.94 74.14 14.63 Favored Pre-proline 0 CA--C 1.551 0.995 0 N-CA-C 115.704 1.742 . . . . 0.0 115.704 -168.647 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -61.12 -14.79 35.55 Favored 'Trans proline' 0 CA--C 1.549 1.226 0 C-N-CA 123.196 2.597 . . . . 0.0 114.607 176.611 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.0 t -85.64 -4.81 59.27 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.634 1.573 . . . . 0.0 114.256 174.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.411 ' HE3' ' HB2' ' A' ' 28' ' ' ASN . 38.4 mtmt -129.2 155.84 79.27 Favored Pre-proline 0 N--CA 1.48 1.06 0 C-N-CA 126.385 1.874 . . . . 0.0 111.584 -175.774 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -73.27 153.2 50.87 Favored 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 122.94 2.427 . . . . 0.0 112.691 178.739 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 163.62 161.08 12.26 Favored Glycine 0 CA--C 1.533 1.191 0 C-N-CA 124.828 1.204 . . . . 0.0 113.367 175.642 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.5 ptt180 -158.4 152.46 23.93 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 126.55 1.94 . . . . 0.0 109.858 168.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 26.2 ttpt -82.63 141.64 32.36 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 121.455 0.645 . . . . 0.0 111.127 174.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 59.3 p -135.74 166.63 22.81 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 125.562 1.545 . . . . 0.0 111.143 -169.24 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 27.3 p-10 -47.54 -38.34 13.95 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.288 1.035 . . . . 0.0 113.767 172.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 15.0 tt0 -72.72 -42.12 64.49 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.424 1.09 . . . . 0.0 112.323 -179.344 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 73.3 mt -67.18 -31.65 72.2 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.566 0.746 . . . . 0.0 112.137 171.262 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -60.96 -48.46 81.7 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 118.539 0.609 . . . . 0.0 110.413 169.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -55.76 -41.07 73.44 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.466 0.706 . . . . 0.0 112.415 177.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 90.3 mmm -57.0 -52.87 63.55 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 119.004 -0.522 . . . . 0.0 112.401 172.468 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -77.87 -17.26 57.55 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 114.772 1.397 . . . . 0.0 114.772 -178.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -106.27 -22.35 12.85 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.002 0.921 . . . . 0.0 113.317 -169.122 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 33.7 t -127.96 -51.68 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 C-N-CA 123.234 0.614 . . . . 0.0 111.207 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.7 t -67.72 -62.34 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.206 0.602 . . . . 0.0 110.566 -174.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 55.6 t -57.19 -50.62 76.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 124.375 1.07 . . . . 0.0 110.222 173.138 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm -57.03 -43.49 81.98 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 118.658 0.663 . . . . 0.0 112.407 -174.261 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 56.4 m -69.4 -47.62 63.6 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 117.956 0.344 . . . . 0.0 111.901 176.576 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 70.9 mt -61.43 -33.85 74.41 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.43 0.692 . . . . 0.0 112.313 178.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . 0.449 ' CZ3' ' HE3' ' A' ' 87' ' ' LYS . 22.2 t-105 -70.07 -29.64 66.69 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.828 1.651 . . . . 0.0 113.413 176.218 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.4 mtmp? -82.7 -7.1 59.67 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.012 0.925 . . . . 0.0 113.403 177.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 41.0 t-80 -64.76 152.86 41.53 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.707 1.203 . . . . 0.0 113.018 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 26.8 mp0 -60.85 -19.29 59.73 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.578 1.551 . . . . 0.0 113.948 175.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -119.78 15.24 12.64 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.56 1.544 . . . . 0.0 113.672 -175.162 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.93 -26.21 63.09 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.184 1.394 . . . . 0.0 114.345 178.245 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 68.1 p-90 -57.54 -33.89 21.62 Favored Pre-proline 0 CA--C 1.549 0.938 0 N-CA-C 117.967 2.58 . . . . 0.0 117.967 -170.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -77.24 -1.28 11.44 Favored 'Trans proline' 0 CA--C 1.543 0.972 0 CA-C-N 123.437 2.263 . . . . 0.0 113.281 174.755 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 88.4 m-85 -112.03 -4.87 14.37 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.576 1.55 . . . . 0.0 113.411 179.372 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -65.02 -14.76 61.22 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 176.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 69.8 mt-30 -142.91 157.7 60.68 Favored Pre-proline 0 CA--C 1.547 0.861 0 C-N-CA 126.252 1.821 . . . . 0.0 111.069 -176.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -65.65 157.06 60.58 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 123.336 2.691 . . . . 0.0 113.309 176.082 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 21.8 t -77.09 85.8 0.84 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 125.085 1.354 . . . . 0.0 110.015 178.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -71.31 86.11 0.8 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.025 1.33 . . . . 0.0 111.303 177.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.37 -27.88 26.23 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 124.893 1.277 . . . . 0.0 114.395 -178.492 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 82.0 mt -65.77 -49.96 73.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 124.831 1.252 . . . . 0.0 111.109 173.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 85.5 mttt -67.3 -40.37 86.03 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.932 1.293 . . . . 0.0 112.4 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.9 mp -82.65 -3.59 56.51 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.869 1.667 . . . . 0.0 112.7 -179.44 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 51.76 56.35 7.97 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.977 1.711 . . . . 0.0 113.123 -178.258 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 28.0 mt -112.76 81.87 4.66 Favored Pre-proline 0 CA--C 1.545 0.751 0 C-N-CA 126.179 1.792 . . . . 0.0 109.926 179.221 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -67.38 -7.82 20.25 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 124.026 3.151 . . . . 0.0 114.827 -170.095 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -132.17 17.49 4.54 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.926 1.691 . . . . 0.0 112.515 -179.156 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -48.12 -51.99 22.38 Favored 'General case' 0 N--CA 1.477 0.911 0 O-C-N 120.86 -1.15 . . . . 0.0 112.985 -175.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -76.19 -6.14 49.95 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.633 1.573 . . . . 0.0 114.496 -179.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.4 mmmp? -84.4 -37.04 21.97 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.979 0.912 . . . . 0.0 111.269 174.757 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.3 mp -81.31 -48.1 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 124.087 0.955 . . . . 0.0 110.099 171.624 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 22.0 mm -86.8 111.67 21.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 123.824 0.85 . . . . 0.0 111.596 -176.518 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 29.6 mmmt -63.14 -32.66 74.1 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.488 1.515 . . . . 0.0 112.878 175.262 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 21.7 p-10 -157.3 96.81 2.04 Favored Pre-proline 0 CA--C 1.551 0.992 0 C-N-CA 126.089 1.756 . . . . 0.0 111.904 -169.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -77.32 149.39 27.78 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 123.557 2.838 . . . . 0.0 111.763 176.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 6.7 tpt -158.42 150.33 21.47 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.663 1.185 . . . . 0.0 111.864 179.358 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -150.21 155.21 39.33 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 126.079 1.751 . . . . 0.0 112.172 -178.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.9 ttp -65.24 -33.68 76.57 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 113.45 0.908 . . . . 0.0 113.45 -174.696 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.93 -44.41 98.17 Favored Glycine 0 CA--C 1.531 1.094 0 C-N-CA 124.594 1.093 . . . . 0.0 112.909 175.242 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 65.0 m -67.2 -42.98 83.25 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 118.382 -0.818 . . . . 0.0 111.597 172.093 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 76.2 mt -52.84 -53.85 19.23 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 CA-C-N 119.801 1.182 . . . . 0.0 111.667 178.15 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.449 ' HE3' ' CZ3' ' A' ' 51' ' ' TRP . 16.0 ptpt -59.95 -29.18 68.23 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 113.891 1.071 . . . . 0.0 113.891 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.6 tpmt? -69.96 -45.59 67.07 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.421 1.089 . . . . 0.0 112.453 177.343 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 5.4 ptp180 -73.07 -27.09 61.53 Favored 'General case' 0 N--CA 1.481 1.095 0 N-CA-C 113.874 1.065 . . . . 0.0 113.874 174.116 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 33.2 mt -67.91 -43.19 79.8 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 113.161 0.8 . . . . 0.0 113.161 168.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -64.67 -46.58 81.81 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 119.006 0.821 . . . . 0.0 112.305 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 64.2 m-80 -75.08 173.91 10.11 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.409 1.484 . . . . 0.0 112.337 174.117 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 60.4 t-20 -87.11 114.17 23.49 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 121.364 -0.835 . . . . 0.0 109.01 168.15 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -137.09 -33.77 0.75 Allowed 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.363 1.065 . . . . 0.0 113.676 179.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -139.45 164.84 28.8 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.765 1.626 . . . . 0.0 111.824 177.416 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 5.6 t-105 -91.63 -22.56 20.22 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.736 1.214 . . . . 0.0 112.829 -179.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 7.5 t -143.9 149.01 36.22 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.561 1.144 . . . . 0.0 113.285 -169.353 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -70.96 -18.59 62.62 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 115.764 1.764 . . . . 0.0 115.764 -172.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 11.4 t -60.51 -25.72 66.31 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.403 1.002 . . . . 0.0 113.004 178.491 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -67.08 -42.25 84.98 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 121.31 -0.869 . . . . 0.0 111.87 173.068 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 42.3 t -65.1 -35.4 81.03 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.819 0.847 . . . . 0.0 112.248 172.556 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 80.8 mtp -63.69 -41.43 98.13 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 121.453 -0.78 . . . . 0.0 112.003 173.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -62.17 -39.36 92.39 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 171.373 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 92.4 m-20 -65.0 -42.19 94.7 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 119.414 1.007 . . . . 0.0 112.303 175.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -61.33 -45.79 92.98 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 121.236 -0.915 . . . . 0.0 112.635 172.098 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 31.9 t30 -58.63 -41.11 85.18 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.653 -0.654 . . . . 0.0 111.752 173.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 85.6 m -66.01 -36.56 83.61 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.055 1.342 . . . . 0.0 112.672 178.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 17.3 ttm -58.67 -57.79 11.42 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.025 0.93 . . . . 0.0 111.365 174.179 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 19.3 m-85 -64.86 -38.18 90.11 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 122.831 0.452 . . . . 0.0 112.141 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 92.6 m -64.63 -48.09 76.14 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.502 0.721 . . . . 0.0 112.167 178.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -64.23 -30.14 71.21 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 119.785 1.175 . . . . 0.0 112.578 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 98.8 m -61.39 -43.68 98.45 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.356 0.663 . . . . 0.0 112.66 170.052 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 -68.3 -32.26 72.27 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 177.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 73.5 mt -73.24 -57.51 6.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 123.214 0.606 . . . . 0.0 111.091 179.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -68.59 -27.18 65.82 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 114.111 1.152 . . . . 0.0 114.111 -172.242 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 -113.74 164.61 13.49 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.479 1.112 . . . . 0.0 112.506 -171.373 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -71.06 146.02 92.16 Favored Pre-proline 0 N--CA 1.474 0.741 0 C-N-CA 123.918 0.887 . . . . 0.0 110.513 175.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -66.87 -5.25 12.89 Favored 'Trans proline' 0 CA--C 1.543 0.97 0 C-N-CA 123.839 3.026 . . . . 0.0 114.659 -176.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 45.3 p -112.98 -3.55 14.03 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 126.999 2.12 . . . . 0.0 113.169 -179.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 37.1 t0 -68.91 152.38 45.35 Favored 'General case' 0 CA--C 1.542 0.658 0 O-C-N 121.462 -0.774 . . . . 0.0 111.319 174.099 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -54.65 -48.28 72.49 Favored 'General case' 0 N--CA 1.47 0.546 0 O-C-N 121.625 -0.672 . . . . 0.0 111.927 -179.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.5 tp -55.94 -31.98 31.9 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 -177.011 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 49.0 t -71.05 -51.21 36.89 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 C-N-CA 123.362 0.665 . . . . 0.0 110.647 173.406 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 75.5 mt -61.13 -37.46 82.92 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 119.082 0.856 . . . . 0.0 112.005 179.715 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 37.3 mtp -60.59 -49.52 77.21 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 126.183 1.793 . . . . 0.0 111.672 171.416 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -62.1 -39.61 93.07 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 175.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 90.6 mt-30 -61.88 -44.47 96.75 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 119.209 0.913 . . . . 0.0 111.98 175.465 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.62 -42.76 95.29 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.656 0.782 . . . . 0.0 112.785 176.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 85.3 mt -63.26 -44.89 93.84 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.282 0.633 . . . . 0.0 111.634 172.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -60.85 -41.43 95.86 Favored 'General case' 0 CA--C 1.538 0.483 0 O-C-N 121.145 -0.972 . . . . 0.0 112.744 -177.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 55.5 mtmt -60.06 -28.49 67.84 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 175.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 58.5 mt -84.9 -39.89 14.56 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 C-N-CA 123.481 0.712 . . . . 0.0 111.901 173.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -51.88 -51.34 57.49 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.134 -0.978 . . . . 0.0 110.554 172.034 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 99.3 mt -62.35 -40.88 97.84 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.596 0.758 . . . . 0.0 113.006 179.229 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -70.83 -28.4 64.59 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.663 1.119 . . . . 0.0 112.996 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 70.8 mmtt -76.14 -47.09 25.61 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 117.925 -1.036 . . . . 0.0 112.74 173.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 9.1 m -68.41 -24.92 30.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 CA-C-N 121.024 1.738 . . . . 0.0 112.187 176.024 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -60.19 -28.08 67.66 Favored 'General case' 0 CA--C 1.541 0.633 0 O-C-N 121.523 -0.736 . . . . 0.0 112.682 171.058 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 93.7 mt-30 -98.58 2.75 47.69 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.358 1.463 . . . . 0.0 112.769 177.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 8.1 ttm -53.45 141.76 42.48 Favored Pre-proline 0 CA--C 1.545 0.769 0 C-N-CA 124.863 1.265 . . . . 0.0 112.78 175.265 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -68.95 111.34 2.62 Favored 'Trans proline' 0 CA--C 1.537 0.666 0 C-N-CA 123.111 2.541 . . . . 0.0 109.02 168.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 -69.3 -22.1 63.82 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 -172.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -84.81 156.77 21.2 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.649 1.579 . . . . 0.0 111.662 175.355 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -131.09 128.84 41.01 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.739 1.216 . . . . 0.0 112.547 -168.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 7.7 p -150.46 146.0 16.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 125.134 1.374 . . . . 0.0 111.88 -178.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -63.22 140.66 58.9 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.008 1.323 . . . . 0.0 112.383 175.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 83.3 mt -77.09 153.54 34.22 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 114.202 1.186 . . . . 0.0 114.202 -177.633 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 95.3 mt -78.03 157.85 78.2 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 125.254 1.421 . . . . 0.0 111.899 169.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_endo -72.82 161.35 43.98 Favored 'Trans proline' 0 CA--C 1.548 1.224 0 C-N-CA 123.267 2.645 . . . . 0.0 112.725 177.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -69.81 162.73 40.97 Favored 'Trans proline' 0 CA--C 1.541 0.838 0 C-N-CA 123.591 2.86 . . . . 0.0 112.871 176.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -64.81 148.37 97.35 Favored Pre-proline 0 CA--C 1.553 1.063 0 C-N-CA 124.227 1.011 . . . . 0.0 113.433 -179.444 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo -77.27 71.3 6.41 Favored 'Trans proline' 0 CA--C 1.545 1.053 0 C-N-CA 124.908 3.739 . . . . 0.0 111.874 176.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 65.5 pttt -52.82 148.6 7.28 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 125.468 1.507 . . . . 0.0 113.992 -178.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . 134.8 -25.55 3.37 Favored Glycine 0 CA--C 1.536 1.37 0 C-N-CA 125.498 1.523 . . . . 0.0 114.296 174.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 4.3 mppt? . . . . . 0 C--O 1.253 1.261 0 C-N-CA 126.687 1.995 . . . . 0.0 110.948 178.779 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.41 0 N-CA-C 111.376 -0.69 . . . . 0.0 111.376 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 48.9 m -142.98 176.15 9.3 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 125.686 1.595 . . . . 0.0 111.839 -174.317 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 56.8 m -153.33 155.31 36.23 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.194 1.398 . . . . 0.0 111.494 172.398 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -68.84 158.3 53.01 Favored Glycine 0 CA--C 1.536 1.372 0 C-N-CA 123.927 0.775 . . . . 0.0 114.071 -178.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 89.4 p 40.49 42.04 1.22 Allowed 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 126.843 2.057 . . . . 0.0 115.22 -179.269 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.4 t -59.83 147.17 39.21 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.529 1.132 . . . . 0.0 112.639 -179.786 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 176.33 79.14 0.05 OUTLIER Glycine 0 CA--C 1.532 1.108 0 C-N-CA 124.485 1.04 . . . . 0.0 112.116 -172.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -55.99 155.64 6.11 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 114.209 1.189 . . . . 0.0 114.209 -178.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 19.5 m -127.0 -9.35 4.48 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.267 0 C-N-CA 124.547 1.139 . . . . 0.0 113.985 -170.643 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.3 t -154.18 147.19 24.54 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 125.304 1.442 . . . . 0.0 110.763 175.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -151.3 122.68 3.83 Favored Pre-proline 0 CA--C 1.548 0.871 0 C-N-CA 124.271 1.028 . . . . 0.0 110.778 -175.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_endo -81.48 -10.37 12.13 Favored 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 123.77 2.98 . . . . 0.0 114.365 -177.248 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.2 t -104.66 -41.27 5.73 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.649 1.18 . . . . 0.0 112.673 -172.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.6 ttpm? -68.02 131.64 92.25 Favored Pre-proline 0 CA--C 1.547 0.841 0 C-N-CA 124.043 0.937 . . . . 0.0 110.577 174.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -71.47 156.78 57.7 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 122.76 2.306 . . . . 0.0 113.041 -177.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 176.38 159.46 22.0 Favored Glycine 0 CA--C 1.533 1.164 0 C-N-CA 125.224 1.392 . . . . 0.0 112.621 178.389 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 36.0 ptt180 -144.86 154.43 42.63 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.198 1.399 . . . . 0.0 110.58 169.44 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.6 tptm -81.93 130.73 35.16 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.365 1.066 . . . . 0.0 110.279 177.438 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 65.3 p -135.24 165.22 25.93 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.972 1.309 . . . . 0.0 111.936 -169.459 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -50.31 -35.43 27.41 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 112.354 0.502 . . . . 0.0 112.354 174.617 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 14.2 mp0 -57.91 -65.1 0.69 Allowed 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.137 1.375 . . . . 0.0 111.263 173.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 76.1 mt -63.37 -32.71 74.21 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -175.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 -62.22 -54.65 37.81 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 118.473 0.578 . . . . 0.0 110.77 169.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 65.4 t80 -56.86 -38.26 72.46 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.881 0.872 . . . . 0.0 112.632 -179.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 86.1 mmm -55.07 -49.39 71.77 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 172.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -82.92 -18.03 41.57 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 120.385 1.448 . . . . 0.0 114.524 179.206 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 59.5 t30 -99.09 -24.56 14.85 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.77 1.228 . . . . 0.0 112.767 -170.405 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 39.9 t -130.38 -49.83 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 C-N-CA 123.945 0.898 . . . . 0.0 111.576 -179.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 17.1 t -72.17 -68.14 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 CA-C-N 118.943 0.792 . . . . 0.0 111.058 -170.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 60.4 t -58.54 -40.57 79.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 124.578 1.151 . . . . 0.0 110.199 172.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.4 tppt? -52.84 -51.03 62.49 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 118.837 0.744 . . . . 0.0 112.262 177.151 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 72.5 m -70.52 -43.42 69.64 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.191 0.596 . . . . 0.0 111.82 179.253 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 46.5 mt -63.71 -32.04 73.41 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.396 0.679 . . . . 0.0 112.333 179.216 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 14.3 t-105 -74.33 -30.73 62.16 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.887 1.675 . . . . 0.0 113.058 173.038 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp -79.12 -8.8 59.28 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.135 0.974 . . . . 0.0 113.402 175.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 38.6 t-80 -63.02 156.05 25.84 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.278 1.431 . . . . 0.0 113.436 -178.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 19.1 mm100 -60.34 -22.16 62.92 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.052 1.341 . . . . 0.0 114.039 174.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -124.31 21.24 8.76 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.155 1.382 . . . . 0.0 113.666 -172.577 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.01 -24.77 62.44 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.093 1.357 . . . . 0.0 113.95 174.377 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 64.4 p-90 -59.38 -33.88 19.39 Favored Pre-proline 0 CA--C 1.547 0.827 0 N-CA-C 117.538 2.421 . . . . 0.0 117.538 -170.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -79.31 2.47 8.3 Favored 'Trans proline' 0 CA--C 1.547 1.132 0 CA-C-N 122.985 2.102 . . . . 0.0 113.058 172.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -117.9 9.89 13.0 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.273 1.829 . . . . 0.0 113.206 178.077 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 22.5 m-30 -74.6 -17.02 60.78 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 120.396 -1.44 . . . . 0.0 113.538 174.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 31.4 mm-40 -149.21 148.58 27.15 Favored Pre-proline 0 CA--C 1.546 0.805 0 C-N-CA 126.495 1.918 . . . . 0.0 110.753 -178.685 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -68.05 163.26 36.54 Favored 'Trans proline' 0 CA--C 1.537 0.627 0 C-N-CA 124.085 3.19 . . . . 0.0 113.572 -177.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 46.9 t -72.59 89.12 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 124.685 1.194 . . . . 0.0 110.012 173.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -69.57 78.77 0.41 Allowed 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.824 1.25 . . . . 0.0 109.96 169.165 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -52.28 -24.92 8.22 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.677 1.362 . . . . 0.0 114.677 -174.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 84.9 mt -62.94 -48.89 85.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 125.204 1.401 . . . . 0.0 111.32 170.651 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 56.5 mttm -76.01 -40.97 52.44 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 125.912 1.685 . . . . 0.0 112.836 -179.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -72.12 -11.03 60.56 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.244 1.018 . . . . 0.0 113.555 172.43 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.5 t30 58.46 54.07 5.8 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 126.697 1.999 . . . . 0.0 112.71 178.652 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 37.2 mt -114.61 81.29 6.91 Favored Pre-proline 0 CA--C 1.543 0.691 0 C-N-CA 126.289 1.836 . . . . 0.0 110.17 -178.274 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -66.15 -12.66 36.44 Favored 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 123.325 2.683 . . . . 0.0 113.296 -177.383 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 35.0 m-20 -111.42 6.01 20.02 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 126.074 1.75 . . . . 0.0 113.365 177.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -54.26 -52.22 62.07 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 120.472 1.487 . . . . 0.0 112.15 -178.335 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -76.75 -15.26 59.81 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.692 1.197 . . . . 0.0 114.121 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 9.5 mptt -69.41 -44.52 71.21 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 121.304 -0.873 . . . . 0.0 110.731 174.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.4 mp -81.87 -51.67 14.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 C-N-CA 123.524 0.73 . . . . 0.0 110.151 173.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 22.7 mm -83.41 101.79 8.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 CA-C-O 122.328 1.061 . . . . 0.0 111.599 -177.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -65.7 -30.88 71.62 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 126.046 1.738 . . . . 0.0 113.473 178.063 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -148.6 111.72 3.66 Favored Pre-proline 0 CA--C 1.546 0.819 0 C-N-CA 125.996 1.719 . . . . 0.0 110.488 174.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -87.84 160.23 7.55 Favored 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 124.306 3.337 . . . . 0.0 112.016 172.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.5 tpt -159.3 155.71 27.36 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.84 1.256 . . . . 0.0 111.88 175.578 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -149.65 151.16 33.28 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.103 1.361 . . . . 0.0 113.42 -175.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 4.3 ttp -65.67 -33.24 75.42 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.244 1.017 . . . . 0.0 112.804 -174.396 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -58.53 -45.65 94.24 Favored Glycine 0 CA--C 1.528 0.875 0 C-N-CA 124.327 0.965 . . . . 0.0 112.163 176.012 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 25.4 m -70.13 -43.68 70.47 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.104 0.962 . . . . 0.0 111.885 176.308 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 83.3 mt -52.97 -52.71 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.182 0 CA-C-N 119.428 1.013 . . . . 0.0 111.413 177.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 6.5 ttpm? -56.43 -32.59 65.03 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.424 1.489 . . . . 0.0 113.201 177.548 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.1 tpmt? -72.72 -45.33 59.29 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.936 1.294 . . . . 0.0 113.275 177.394 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 3.1 ptp180 -69.04 -31.09 69.63 Favored 'General case' 0 N--CA 1.483 1.218 0 CA-C-N 119.49 1.041 . . . . 0.0 113.421 174.448 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 55.4 mt -64.94 -41.31 95.62 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 113.774 1.027 . . . . 0.0 113.774 169.255 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -62.3 -33.44 74.66 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 118.809 0.731 . . . . 0.0 112.756 176.709 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 52.5 m-80 -79.52 -176.49 5.31 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 125.624 1.569 . . . . 0.0 112.511 171.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -105.39 42.54 1.22 Allowed 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 125.555 1.542 . . . . 0.0 110.394 174.08 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 45.5 t80 -66.61 -32.99 74.67 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 114.046 1.128 . . . . 0.0 114.046 -168.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -139.04 -177.26 4.81 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.531 1.932 . . . . 0.0 112.755 -177.269 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 4.5 t-105 -107.57 -25.73 11.22 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.41 1.484 . . . . 0.0 112.848 -177.013 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 47.0 t -136.55 143.08 43.49 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.709 1.204 . . . . 0.0 112.162 -170.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -57.56 -19.3 24.5 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.625 1.17 . . . . 0.0 113.839 169.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 10.4 m -53.17 -36.57 61.04 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 119.098 0.863 . . . . 0.0 112.65 177.416 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -71.85 -40.92 68.67 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 123.75 0.82 . . . . 0.0 112.731 176.384 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 43.0 t -61.06 -36.51 79.8 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 123.912 0.885 . . . . 0.0 112.572 170.301 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 78.8 mtp -68.33 -39.8 81.81 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.335 1.054 . . . . 0.0 111.95 175.641 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -61.0 -40.82 95.01 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 123.236 0.614 . . . . 0.0 112.006 169.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -64.03 -43.11 96.55 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 121.535 -0.728 . . . . 0.0 112.245 175.53 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -61.0 -41.72 97.06 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 121.301 -0.874 . . . . 0.0 112.912 172.375 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 13.9 t30 -57.53 -50.47 72.98 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 118.398 0.544 . . . . 0.0 111.193 172.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 53.7 m -57.84 -38.59 75.92 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 176.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 19.3 ttm -59.96 -62.4 1.9 Allowed 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.515 1.052 . . . . 0.0 111.611 176.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -63.02 -39.82 95.91 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -176.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 60.8 m -66.25 -44.39 83.83 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 118.272 -0.871 . . . . 0.0 112.572 178.176 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -64.29 -32.63 74.31 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 120.921 1.691 . . . . 0.0 112.398 178.126 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 57.5 m -60.82 -43.98 97.51 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.229 0.612 . . . . 0.0 112.433 169.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -67.66 -32.99 74.05 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 176.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 80.0 mt -72.58 -58.01 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 123.613 0.765 . . . . 0.0 111.038 178.25 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -69.71 -19.53 63.56 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 114.381 1.252 . . . . 0.0 114.381 -170.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 36.5 m-80 -123.25 160.15 27.24 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.724 1.21 . . . . 0.0 112.144 -173.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.85 148.72 96.51 Favored Pre-proline 0 N--CA 1.472 0.642 0 C-N-CA 124.242 1.017 . . . . 0.0 110.641 176.918 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -65.32 -8.52 19.02 Favored 'Trans proline' 0 CA--C 1.543 0.947 0 C-N-CA 123.67 2.913 . . . . 0.0 114.723 -175.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 44.8 p -107.92 -4.08 18.28 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.745 2.018 . . . . 0.0 113.471 179.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -67.09 145.99 54.75 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 118.909 0.777 . . . . 0.0 111.11 175.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -52.68 -45.32 66.76 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.682 0.793 . . . . 0.0 112.736 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 9.1 tp -57.37 -35.19 48.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 124.387 1.075 . . . . 0.0 113.785 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 48.0 t -68.51 -44.38 83.07 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 C-N-CA 123.393 0.677 . . . . 0.0 110.534 174.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 68.9 mt -62.7 -36.43 82.92 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 118.848 0.749 . . . . 0.0 112.094 176.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 1.1 mmt -57.61 -52.27 66.12 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 118.241 0.473 . . . . 0.0 111.004 170.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -63.17 -37.37 86.95 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.582 0.753 . . . . 0.0 112.758 179.322 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 83.2 mt-30 -62.08 -40.61 96.4 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 119.607 1.094 . . . . 0.0 112.861 173.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -69.81 -45.46 67.83 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.545 -0.722 . . . . 0.0 112.107 176.502 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 83.1 mt -64.54 -43.97 92.31 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.622 0.769 . . . . 0.0 112.234 177.193 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -63.27 -40.95 98.83 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 119.81 1.186 . . . . 0.0 112.874 -175.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 36.0 mtmm -59.77 -39.62 85.49 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 121.528 -0.733 . . . . 0.0 111.954 175.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 77.0 mt -72.75 -41.11 61.91 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 C-N-CA 122.947 0.499 . . . . 0.0 111.424 176.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 16.7 t80 -51.06 -51.24 55.19 Favored 'General case' 0 CA--C 1.538 0.511 0 O-C-N 121.491 -0.756 . . . . 0.0 110.53 172.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 98.1 mt -65.14 -41.28 94.91 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 178.301 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -65.53 -32.16 73.61 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 120.118 1.327 . . . . 0.0 112.293 179.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 70.3 mmtt -75.5 -48.67 21.53 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 117.536 -1.221 . . . . 0.0 112.146 177.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 6.1 m -67.06 -26.76 37.42 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 CA-C-N 121.13 1.786 . . . . 0.0 112.3 177.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -61.22 -30.96 70.75 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 172.041 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 99.5 mt-30 -89.58 -7.92 53.76 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.992 1.317 . . . . 0.0 112.955 175.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 46.2 ttp -65.49 144.32 98.91 Favored Pre-proline 0 CA--C 1.547 0.84 0 CA-C-N 119.141 0.882 . . . . 0.0 111.301 173.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -53.69 142.94 60.0 Favored 'Trans proline' 0 CA--C 1.539 0.738 0 C-N-CA 122.548 2.165 . . . . 0.0 111.904 168.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -91.29 -24.0 19.97 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 112.581 0.586 . . . . 0.0 112.581 176.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -86.74 155.33 20.39 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.662 1.185 . . . . 0.0 111.508 172.562 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -103.09 138.56 39.77 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.196 1.398 . . . . 0.0 111.558 -174.151 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 69.2 t -137.85 124.65 28.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 125.529 1.532 . . . . 0.0 109.129 177.51 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -69.84 128.73 37.41 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.52 1.128 . . . . 0.0 111.084 169.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 49.8 mt -83.09 161.94 21.5 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -176.126 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 99.3 mt -68.28 155.47 92.3 Favored Pre-proline 0 CA--C 1.549 0.919 0 C-N-CA 124.441 1.096 . . . . 0.0 111.322 169.023 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -72.13 155.85 56.25 Favored 'Trans proline' 0 CA--C 1.547 1.132 0 C-N-CA 122.871 2.38 . . . . 0.0 111.957 177.144 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -72.42 156.41 54.45 Favored 'Trans proline' 0 CA--C 1.539 0.75 0 C-N-CA 123.191 2.594 . . . . 0.0 112.3 177.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -82.14 152.28 67.87 Favored Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 124.265 1.026 . . . . 0.0 112.146 175.533 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -71.11 154.16 62.38 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 123.184 2.589 . . . . 0.0 111.953 173.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -87.95 165.93 14.87 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.918 1.287 . . . . 0.0 111.654 178.102 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . -171.16 -174.72 39.14 Favored Glycine 0 CA--C 1.536 1.345 0 C-N-CA 124.915 1.245 . . . . 0.0 113.545 -178.632 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.166 0 C-N-CA 126.28 1.832 . . . . 0.0 112.971 -179.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.396 0 N-CA-C 110.594 -1.002 . . . . 0.0 110.594 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 23.5 m -139.97 26.58 2.24 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 124.778 1.231 . . . . 0.0 112.972 -169.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 65.4 p -141.38 167.17 22.82 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.587 1.555 . . . . 0.0 113.06 -172.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -79.1 -166.76 32.09 Favored Glycine 0 CA--C 1.537 1.423 0 C-N-CA 125.179 1.371 . . . . 0.0 113.917 177.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 25.1 m -52.26 133.93 33.93 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.245 1.018 . . . . 0.0 112.444 177.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 40.2 m -60.79 155.06 20.28 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.49 1.116 . . . . 0.0 113.7 -176.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -153.06 42.83 0.65 Allowed Glycine 0 CA--C 1.533 1.173 0 C-N-CA 125.362 1.458 . . . . 0.0 112.345 -176.309 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -59.11 153.63 17.58 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.344 1.458 . . . . 0.0 113.799 -178.027 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 23.5 m -138.93 -22.37 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 N-CA-C 115.673 1.731 . . . . 0.0 115.673 -170.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 47.5 t -148.53 105.62 3.61 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.402 1.081 . . . . 0.0 110.992 -172.11 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -146.07 117.13 4.88 Favored Pre-proline 0 CA--C 1.548 0.872 0 C-N-CA 124.354 1.062 . . . . 0.0 111.361 -170.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -76.17 -10.51 19.37 Favored 'Trans proline' 0 CA--C 1.544 0.984 0 C-N-CA 124.032 3.155 . . . . 0.0 113.416 177.119 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 64.3 p -67.04 -13.75 62.22 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.756 1.623 . . . . 0.0 114.671 176.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 36.0 mtmm -125.19 143.28 43.84 Favored Pre-proline 0 CA--C 1.541 0.615 0 C-N-CA 126.596 1.958 . . . . 0.0 110.798 179.172 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -70.77 146.88 55.08 Favored 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.591 2.194 . . . . 0.0 112.282 -179.121 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 172.61 162.33 24.56 Favored Glycine 0 CA--C 1.529 0.935 0 C-N-CA 124.431 1.015 . . . . 0.0 113.311 177.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -173.49 165.12 4.64 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 127.289 2.236 . . . . 0.0 110.983 175.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 5.5 mmtp -64.64 136.22 56.75 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.609 1.164 . . . . 0.0 111.959 173.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 71.0 p -142.0 161.84 36.97 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 126.307 1.843 . . . . 0.0 109.899 177.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 16.0 t30 -52.7 -33.61 48.38 Favored 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 114.622 1.341 . . . . 0.0 114.622 177.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -72.25 -47.15 52.45 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.084 -1.01 . . . . 0.0 112.208 174.002 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 86.1 mt -62.56 -30.88 71.63 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 121.223 -0.923 . . . . 0.0 112.33 174.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -58.98 -54.33 48.3 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.816 1.247 . . . . 0.0 109.947 169.126 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 63.3 t80 -58.49 -41.61 85.72 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.966 0.907 . . . . 0.0 112.909 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 96.2 mmm -54.78 -52.33 62.93 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 118.348 0.522 . . . . 0.0 111.834 173.333 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -71.09 -31.79 68.24 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 113.793 1.034 . . . . 0.0 113.793 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 42.9 t30 -98.89 -16.27 18.88 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 114.658 1.355 . . . . 0.0 114.658 -166.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 17.2 t -132.81 -50.26 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 122.8 0.44 . . . . 0.0 111.271 -179.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 17.9 t -69.86 -66.41 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 123.645 0.778 . . . . 0.0 110.423 -174.291 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 48.7 t -55.1 -47.74 76.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 125.836 1.654 . . . . 0.0 110.303 173.266 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 52.0 tttt -59.8 -37.94 80.55 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.89 0.876 . . . . 0.0 113.176 -175.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 22.2 m -83.52 -38.54 21.61 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 118.542 0.61 . . . . 0.0 112.37 177.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 67.9 mt -60.86 -35.49 76.73 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 121.585 -0.697 . . . . 0.0 112.343 172.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 20.2 t-105 -70.55 -29.69 66.21 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.201 1.4 . . . . 0.0 113.543 176.507 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 55.0 mttm -71.15 -17.59 62.54 Favored 'General case' 0 N--CA 1.484 1.261 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 172.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 44.5 t-80 -62.37 151.15 37.64 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.58 1.152 . . . . 0.0 113.596 -171.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 26.4 mp0 -59.28 -16.77 23.62 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.018 1.727 . . . . 0.0 114.167 176.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 -124.63 17.85 8.78 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.721 1.608 . . . . 0.0 113.747 -177.403 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.24 -28.57 66.46 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 176.139 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 42.9 p-90 -57.42 -38.05 63.63 Favored Pre-proline 0 CA--C 1.547 0.86 0 N-CA-C 117.613 2.449 . . . . 0.0 117.613 -170.201 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -70.97 -6.26 18.8 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 CA-C-N 123.115 2.148 . . . . 0.0 114.225 173.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 56.6 m-85 -109.61 -4.32 16.28 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.343 1.457 . . . . 0.0 112.921 178.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 21.0 m-30 -62.43 -18.26 61.28 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 114.343 1.238 . . . . 0.0 114.343 178.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 86.5 mt-30 -143.79 155.75 59.46 Favored Pre-proline 0 CA--C 1.544 0.727 0 C-N-CA 125.787 1.635 . . . . 0.0 110.559 -175.165 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -64.84 146.36 87.96 Favored 'Trans proline' 0 CA--C 1.539 0.773 0 C-N-CA 122.733 2.289 . . . . 0.0 111.862 173.436 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 95.9 t -62.13 120.54 8.6 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 123.932 0.893 . . . . 0.0 111.732 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 38.2 m-20 -89.02 89.45 7.99 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.505 1.122 . . . . 0.0 109.952 169.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.95 -28.11 48.85 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 113.603 0.964 . . . . 0.0 113.603 178.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 81.8 mt -64.86 -50.08 76.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 124.876 1.27 . . . . 0.0 111.039 172.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -66.86 -41.17 87.76 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.039 1.336 . . . . 0.0 112.807 -179.223 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.4 mp -80.2 -3.78 50.44 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.124 0.969 . . . . 0.0 113.21 176.359 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 61.8 t30 54.89 55.73 7.45 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 126.259 1.824 . . . . 0.0 113.448 -179.422 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 44.1 mt -115.2 80.43 7.26 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 126.587 1.955 . . . . 0.0 110.594 -176.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -68.88 -4.7 13.91 Favored 'Trans proline' 0 CA--C 1.544 1.023 0 C-N-CA 123.992 3.128 . . . . 0.0 114.418 -175.203 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -124.54 15.11 8.84 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.524 1.929 . . . . 0.0 111.951 179.195 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -51.12 -57.12 9.54 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 120.727 -1.233 . . . . 0.0 112.788 -176.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -73.54 -2.41 22.63 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.962 1.305 . . . . 0.0 114.194 178.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -84.52 -43.23 14.74 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.395 1.078 . . . . 0.0 110.611 176.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.3 mp -82.14 -47.57 19.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 C-N-CA 124.397 1.079 . . . . 0.0 110.423 172.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 34.4 mm -78.6 113.7 18.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 123.549 0.74 . . . . 0.0 111.254 -179.04 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -77.01 -31.05 56.14 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.947 1.299 . . . . 0.0 112.575 174.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 18.4 p30 -149.88 83.29 6.29 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 125.609 1.564 . . . . 0.0 112.215 -168.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -70.34 138.42 35.93 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 123.179 2.586 . . . . 0.0 110.932 178.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 8.5 tpt -156.32 137.58 13.81 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.863 1.265 . . . . 0.0 110.017 -174.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -146.17 148.31 32.41 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 125.316 1.446 . . . . 0.0 111.364 -175.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 9.4 ttp -57.54 -36.98 72.33 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.173 1.389 . . . . 0.0 113.181 -171.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.56 -27.05 65.45 Favored Glycine 0 CA--C 1.533 1.206 0 C-N-CA 124.989 1.28 . . . . 0.0 114.366 173.584 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 26.0 m -87.36 -37.28 17.23 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.457 1.103 . . . . 0.0 111.215 172.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 66.5 mt -56.43 -51.14 68.08 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 CA-C-N 119.61 1.096 . . . . 0.0 110.892 176.184 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 15.0 ptmm? -59.39 -37.07 77.04 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 175.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.71 -36.41 80.85 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.473 1.109 . . . . 0.0 112.842 -178.634 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 5.7 ptp180 -80.59 -30.62 36.89 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 114.114 1.153 . . . . 0.0 114.114 172.289 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 76.2 mt -63.74 -30.9 71.94 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-N 119.759 1.163 . . . . 0.0 113.794 168.588 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -66.16 -15.0 62.76 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 114.618 1.34 . . . . 0.0 114.618 -178.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -138.56 177.85 7.58 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 125.397 1.479 . . . . 0.0 113.592 -174.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 4.0 p30 -78.34 97.65 5.68 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 124.431 1.092 . . . . 0.0 111.78 173.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 78.7 t80 -131.24 -37.78 1.24 Allowed 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.54 1.136 . . . . 0.0 113.023 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -132.9 173.44 11.4 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.896 1.678 . . . . 0.0 111.098 169.831 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.6 t-105 -106.78 -19.07 13.76 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.306 1.042 . . . . 0.0 112.544 -177.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 78.6 p -137.63 145.71 43.05 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.487 1.115 . . . . 0.0 114.009 -170.251 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -63.53 -22.22 66.77 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 114.847 1.425 . . . . 0.0 114.847 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 15.3 p -51.54 -35.29 40.18 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.273 1.029 . . . . 0.0 113.452 174.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -70.01 -43.52 71.2 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.117 0.967 . . . . 0.0 112.105 176.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 51.0 t -63.32 -39.33 94.25 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.245 1.018 . . . . 0.0 112.298 173.04 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 86.7 mtp -61.75 -42.14 98.58 Favored 'General case' 0 N--CA 1.47 0.546 0 O-C-N 121.291 -0.881 . . . . 0.0 112.279 174.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 90.8 mm-40 -62.93 -38.57 91.51 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 172.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -63.77 -42.45 97.78 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 119.347 0.976 . . . . 0.0 112.421 174.503 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -59.66 -45.28 92.51 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.21 -0.931 . . . . 0.0 112.356 171.313 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -57.97 -46.03 85.8 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.82 -0.55 . . . . 0.0 112.222 174.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 84.0 m -63.75 -38.31 90.64 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.177 0.991 . . . . 0.0 112.669 176.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 51.0 ttp -59.13 -53.07 62.55 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 119.385 0.993 . . . . 0.0 112.03 176.214 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -68.33 -39.53 81.91 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 121.996 -0.44 . . . . 0.0 112.081 179.367 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 86.4 m -64.24 -48.26 76.5 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.65 0.78 . . . . 0.0 112.063 -179.719 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -64.06 -32.18 73.64 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 119.055 0.843 . . . . 0.0 112.067 -179.7 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 88.7 m -61.16 -44.24 97.63 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.731 0.812 . . . . 0.0 112.885 170.406 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 17.0 m-85 -67.63 -29.45 68.76 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 114.031 1.122 . . . . 0.0 114.031 178.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 87.5 mt -68.83 -56.91 10.43 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 123.136 0.574 . . . . 0.0 110.648 175.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 25.8 t80 -69.61 -37.83 77.03 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 -173.028 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 52.3 m-80 -103.55 151.88 22.36 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.408 1.083 . . . . 0.0 111.164 -172.468 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.34 153.87 93.97 Favored Pre-proline 0 N--CA 1.469 0.493 0 C-N-CA 123.804 0.842 . . . . 0.0 111.135 178.909 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -64.02 -3.28 5.71 Favored 'Trans proline' 0 CA--C 1.547 1.133 0 C-N-CA 124.288 3.325 . . . . 0.0 114.79 -178.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 62.1 p -122.22 0.02 9.47 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 126.944 2.097 . . . . 0.0 113.256 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 65.5 m-20 -67.93 146.1 53.93 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 118.886 0.766 . . . . 0.0 110.759 170.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -56.45 -46.46 80.31 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 121.537 -0.727 . . . . 0.0 112.36 -176.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.5 tp -55.38 -29.84 24.48 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 125.008 1.323 . . . . 0.0 114.321 177.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 40.3 t -72.31 -47.22 53.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 O-C-N 121.272 -0.893 . . . . 0.0 110.431 173.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 71.0 mt -61.03 -36.97 80.94 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 118.943 0.792 . . . . 0.0 111.617 176.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 9.4 mtt -58.92 -51.88 68.13 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.957 1.303 . . . . 0.0 112.081 169.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.6 -40.08 90.51 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.349 0.659 . . . . 0.0 112.702 176.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 89.1 mt-30 -61.73 -45.92 91.85 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 119.072 0.851 . . . . 0.0 111.975 173.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -67.65 -28.72 67.96 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.55 1.14 . . . . 0.0 113.794 178.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 77.1 mt -76.72 -46.84 23.87 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.513 0.725 . . . . 0.0 111.455 169.517 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -61.4 -40.36 94.1 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.186 0.903 . . . . 0.0 113.084 -174.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -60.52 -33.72 73.05 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 113.187 0.81 . . . . 0.0 113.187 177.254 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 48.1 mt -78.75 -43.21 25.36 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 124.026 0.93 . . . . 0.0 111.415 173.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -49.33 -50.06 41.28 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 120.036 1.289 . . . . 0.0 110.907 172.168 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 99.9 mt -62.99 -42.72 99.92 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 113.126 0.788 . . . . 0.0 113.126 179.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -69.7 -28.44 65.83 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.793 1.179 . . . . 0.0 112.782 178.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 33.9 mmtm -72.8 -52.03 16.6 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 125.423 1.489 . . . . 0.0 111.639 175.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.9 m -68.89 -25.09 29.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 CA-C-N 119.88 1.218 . . . . 0.0 112.382 178.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -59.15 -29.01 67.11 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 173.071 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -92.57 -4.11 53.97 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.637 1.175 . . . . 0.0 112.866 176.371 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 40.7 ttp -65.87 139.14 96.7 Favored Pre-proline 0 CA--C 1.546 0.814 0 O-C-N 121.189 -0.945 . . . . 0.0 110.371 170.557 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -65.74 133.25 33.32 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 122.929 2.419 . . . . 0.0 110.896 176.103 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -69.1 -30.8 69.16 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 178.317 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -76.57 162.04 28.1 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.651 1.58 . . . . 0.0 111.153 169.383 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -134.81 145.19 48.11 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.678 1.191 . . . . 0.0 111.802 -176.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 54.9 t -131.55 134.17 60.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 125.311 1.444 . . . . 0.0 110.622 -174.472 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -69.19 120.61 15.29 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.599 1.559 . . . . 0.0 111.399 171.004 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 91.2 mt -82.58 154.84 24.79 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.115 0.966 . . . . 0.0 112.986 -179.347 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 4.3 pp -66.39 153.87 91.9 Favored Pre-proline 0 CA--C 1.551 1.005 0 C-N-CA 123.955 0.902 . . . . 0.0 111.863 169.216 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -76.24 141.79 23.56 Favored 'Trans proline' 0 CA--C 1.547 1.159 0 C-N-CA 123.04 2.493 . . . . 0.0 111.794 -179.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -73.91 165.45 32.11 Favored 'Trans proline' 0 CA--C 1.54 0.807 0 C-N-CA 123.393 2.728 . . . . 0.0 112.779 179.229 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -61.28 152.81 71.18 Favored Pre-proline 0 CA--C 1.553 1.082 0 C-N-CA 124.089 0.955 . . . . 0.0 111.884 169.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -66.62 147.29 81.53 Favored 'Trans proline' 0 CA--C 1.538 0.713 0 C-N-CA 122.853 2.368 . . . . 0.0 112.548 -179.479 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -150.27 126.92 10.91 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.918 1.687 . . . . 0.0 110.035 -178.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . 159.66 -163.86 33.8 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 124.347 0.975 . . . . 0.0 113.611 -175.067 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.252 1.235 0 C-N-CA 126.308 1.843 . . . . 0.0 109.818 177.227 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.385 0 N-CA-C 111.113 -0.795 . . . . 0.0 111.113 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 39.1 m -60.36 151.25 28.37 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.424 1.09 . . . . 0.0 112.954 177.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.9 m -74.8 -8.2 55.7 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 113.961 1.097 . . . . 0.0 113.961 174.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -175.34 -175.61 42.92 Favored Glycine 0 CA--C 1.534 1.236 0 C-N-CA 126.579 2.038 . . . . 0.0 111.564 178.269 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 32.2 p -61.92 107.08 0.79 Allowed 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.304 1.042 . . . . 0.0 112.018 174.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 56.1 m -63.7 -25.33 68.15 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 115.236 1.569 . . . . 0.0 115.236 -172.083 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 52.32 44.89 58.45 Favored Glycine 0 CA--C 1.537 1.424 0 C-N-CA 125.133 1.349 . . . . 0.0 115.831 169.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -57.81 151.86 16.96 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 114.676 1.362 . . . . 0.0 114.676 -176.436 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 16.5 m -135.12 -10.3 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 C-N-CA 124.879 1.272 . . . . 0.0 113.911 -176.431 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 56.3 p -149.06 135.33 19.25 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 126.265 1.826 . . . . 0.0 110.561 -179.395 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 28.7 p-10 -148.22 141.2 15.24 Favored Pre-proline 0 CA--C 1.551 1.004 0 C-N-CA 124.642 1.177 . . . . 0.0 113.253 -171.475 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -82.58 -20.67 5.57 Favored 'Trans proline' 0 CA--C 1.543 0.95 0 C-N-CA 123.877 3.051 . . . . 0.0 112.976 170.178 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 50.4 p -76.22 -11.18 59.87 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 126.188 1.795 . . . . 0.0 115.22 -174.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -133.76 130.5 20.72 Favored Pre-proline 0 CA--C 1.543 0.706 0 C-N-CA 125.982 1.713 . . . . 0.0 110.56 -176.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -75.11 164.06 33.89 Favored 'Trans proline' 0 CA--C 1.539 0.767 0 C-N-CA 122.93 2.42 . . . . 0.0 111.448 175.564 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -168.67 171.8 42.88 Favored Glycine 0 CA--C 1.527 0.82 0 N-CA-C 115.34 0.896 . . . . 0.0 115.34 178.159 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 47.7 mtm180 -145.75 179.47 7.42 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 127.129 2.172 . . . . 0.0 111.681 -172.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 40.1 tttm -128.49 69.89 1.37 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 127.196 2.198 . . . . 0.0 109.063 172.389 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 50.3 p -82.71 170.54 14.98 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.313 1.445 . . . . 0.0 113.501 -175.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 27.6 p-10 -48.47 -37.43 17.31 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 125.084 1.354 . . . . 0.0 114.503 169.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -72.82 -49.58 29.51 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 121.481 -0.762 . . . . 0.0 111.539 178.761 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 93.5 mt -63.53 -30.98 72.02 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 121.552 -0.717 . . . . 0.0 112.386 175.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 52.3 tt0 -58.79 -53.78 54.47 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 123.635 0.774 . . . . 0.0 110.498 168.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -59.67 -39.76 85.56 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.794 0.838 . . . . 0.0 112.772 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 93.0 mmm -55.89 -49.19 74.08 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 121.559 -0.713 . . . . 0.0 111.668 171.257 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -85.65 -3.79 58.98 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 115.046 1.499 . . . . 0.0 115.046 -175.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 37.1 m-80 -122.08 -16.76 7.42 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.305 1.442 . . . . 0.0 114.46 -176.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 54.8 t -134.07 -50.26 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 123.77 0.828 . . . . 0.0 111.359 -179.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 22.0 t -69.65 -63.19 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 CA-C-N 119.16 0.891 . . . . 0.0 110.594 -174.36 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 85.1 t -58.65 -44.66 90.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 123.946 0.898 . . . . 0.0 110.405 172.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? -56.91 -45.01 82.92 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.949 0.9 . . . . 0.0 112.614 -177.462 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 56.4 m -72.75 -45.04 60.74 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 122.813 0.445 . . . . 0.0 111.679 177.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 69.8 mt -62.97 -33.54 75.6 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.137 0.575 . . . . 0.0 112.237 179.331 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 19.5 t-105 -71.55 -29.85 65.21 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.288 1.435 . . . . 0.0 113.339 174.073 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -80.49 -7.8 59.32 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 176.032 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 40.2 t-80 -64.02 154.28 34.71 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.691 1.196 . . . . 0.0 113.357 -179.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -61.95 -17.59 57.44 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.143 1.377 . . . . 0.0 114.179 175.721 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -122.9 17.33 10.14 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.557 1.543 . . . . 0.0 113.664 -174.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.53 -27.99 65.64 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 114.165 1.172 . . . . 0.0 114.165 177.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 43.3 p-90 -57.65 -37.81 60.44 Favored Pre-proline 0 CA--C 1.548 0.882 0 N-CA-C 117.808 2.521 . . . . 0.0 117.808 -169.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -74.09 -3.46 13.83 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 CA-C-N 123.143 2.158 . . . . 0.0 113.9 173.609 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -109.96 -4.67 15.79 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.475 1.51 . . . . 0.0 112.969 178.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 22.5 m-30 -63.11 -16.39 59.83 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 114.143 1.164 . . . . 0.0 114.143 175.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 90.3 mt-30 -145.73 157.96 50.47 Favored Pre-proline 0 CA--C 1.546 0.817 0 C-N-CA 126.175 1.79 . . . . 0.0 110.837 -175.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -66.53 155.35 70.63 Favored 'Trans proline' 0 C--N 1.35 0.63 0 C-N-CA 122.933 2.422 . . . . 0.0 111.844 171.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 37.1 t -76.61 99.72 2.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 124.202 1.001 . . . . 0.0 109.879 177.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -71.6 88.63 0.95 Allowed 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.319 1.048 . . . . 0.0 111.351 175.193 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.64 -31.16 46.29 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.576 1.15 . . . . 0.0 114.094 -179.154 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 84.3 mt -66.12 -49.33 77.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 124.702 1.201 . . . . 0.0 111.075 174.476 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -65.42 -37.01 85.67 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 125.464 1.505 . . . . 0.0 113.376 -179.026 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.8 mp -88.25 -2.97 58.91 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.431 1.493 . . . . 0.0 112.558 177.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 24.1 m120 52.55 57.97 5.86 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.015 1.726 . . . . 0.0 113.255 -178.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 47.0 mt -114.29 81.75 6.82 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 126.625 1.97 . . . . 0.0 109.992 -179.369 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -67.19 -8.65 22.54 Favored 'Trans proline' 0 CA--C 1.543 0.963 0 C-N-CA 123.969 3.113 . . . . 0.0 113.684 -175.183 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 18.7 p-10 -118.21 8.2 12.27 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 127.988 2.515 . . . . 0.0 113.078 179.781 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 86.3 t80 -52.25 -57.24 10.31 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 120.164 1.347 . . . . 0.0 112.124 -179.215 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 99.8 m-70 -75.89 -5.93 48.39 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.21 1.404 . . . . 0.0 114.104 178.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -78.08 -32.65 50.84 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.974 0.909 . . . . 0.0 111.419 174.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.1 mp -98.26 -44.85 12.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 125.734 1.613 . . . . 0.0 111.296 175.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 21.3 mm -71.48 114.65 10.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 123.552 0.741 . . . . 0.0 110.929 176.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.69 -35.9 51.73 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 124.709 1.204 . . . . 0.0 113.226 172.448 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 15.2 p30 -145.34 83.81 8.9 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 125.213 1.405 . . . . 0.0 112.119 -167.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -68.63 138.58 42.02 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 123.482 2.788 . . . . 0.0 110.927 178.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.9 tpt -159.58 145.55 16.03 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 125.352 1.461 . . . . 0.0 110.116 -175.43 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -149.77 152.42 35.2 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.869 1.267 . . . . 0.0 112.005 -177.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 6.8 ttp -59.72 -33.87 72.18 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.524 1.129 . . . . 0.0 112.564 -177.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.51 -23.45 60.5 Favored Glycine 0 CA--C 1.536 1.366 0 C-N-CA 125.86 1.695 . . . . 0.0 114.977 172.123 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 89.8 m -97.11 -37.04 10.28 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.393 1.077 . . . . 0.0 111.372 173.178 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 98.7 mt -53.45 -49.75 52.59 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 CA-C-N 119.877 1.217 . . . . 0.0 111.088 175.368 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.7 -30.3 65.4 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 113.828 1.048 . . . . 0.0 113.828 175.846 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.421 ' HA ' ' HE3' ' A' ' 88' ' ' LYS . 1.2 tpmt? -80.17 -35.61 36.21 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.099 0.96 . . . . 0.0 112.992 -175.811 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 9.4 ptp180 -70.27 -29.84 66.73 Favored 'General case' 0 N--CA 1.482 1.138 0 CA-C-N 119.399 0.999 . . . . 0.0 113.03 169.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 70.3 mt -63.58 -43.32 97.32 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.664 0.786 . . . . 0.0 112.341 169.213 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -71.93 -2.22 17.25 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 114.662 1.356 . . . . 0.0 114.662 175.082 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 39.4 m-80 -124.77 15.05 8.67 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.667 1.587 . . . . 0.0 113.565 -177.539 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 40.62 47.83 2.45 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 126.247 1.819 . . . . 0.0 114.287 -179.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 85.8 t80 -63.17 -20.64 65.59 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 126.243 1.817 . . . . 0.0 114.179 -170.318 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -143.18 164.82 29.14 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 128.158 2.583 . . . . 0.0 111.729 -171.009 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 23.9 t-105 -87.6 -25.38 23.61 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.804 1.242 . . . . 0.0 112.703 -179.184 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 6.4 t -145.68 152.52 39.76 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 125.418 1.487 . . . . 0.0 111.981 -169.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -67.38 -15.76 63.86 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 115.248 1.574 . . . . 0.0 115.248 -176.622 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 32.0 p -54.06 -34.93 61.37 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 177.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -72.36 -41.36 66.49 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.669 0.787 . . . . 0.0 111.989 176.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 48.0 t -62.71 -40.48 97.27 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 123.914 0.886 . . . . 0.0 111.838 172.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 88.2 mtp -60.63 -41.69 95.38 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.9 0.88 . . . . 0.0 112.075 172.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 43.2 mm-40 -66.82 -30.32 70.48 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 173.617 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 80.3 m-20 -69.8 -39.95 76.24 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 119.702 1.137 . . . . 0.0 112.075 172.601 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -60.98 -47.99 83.89 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 121.631 -0.668 . . . . 0.0 111.959 169.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 33.0 t30 -55.45 -44.54 76.45 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.616 0.766 . . . . 0.0 111.805 173.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 96.0 m -61.49 -46.8 88.48 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.207 1.003 . . . . 0.0 111.884 177.358 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 50.7 ttp -56.75 -52.91 63.18 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.1 0.96 . . . . 0.0 112.439 177.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -67.16 -39.48 86.5 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.744 -0.597 . . . . 0.0 112.139 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 96.8 m -64.32 -47.89 77.69 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.951 0.9 . . . . 0.0 112.013 178.769 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.3 p30 -63.72 -30.66 71.73 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 118.814 0.734 . . . . 0.0 112.382 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 67.4 m -64.25 -42.24 96.59 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.279 1.031 . . . . 0.0 112.54 172.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 15.0 m-85 -68.23 -29.75 68.64 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 177.704 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 88.1 mt -69.73 -56.34 11.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 123.331 0.652 . . . . 0.0 110.557 176.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 57.4 t80 -70.49 -38.43 74.37 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 114.595 1.332 . . . . 0.0 114.595 -172.004 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 59.9 m-80 -97.36 159.26 15.02 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.262 1.025 . . . . 0.0 111.939 -175.103 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -68.85 150.55 97.59 Favored Pre-proline 0 N--CA 1.473 0.676 0 O-C-N 121.299 -0.875 . . . . 0.0 109.721 173.282 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -65.66 -1.75 5.35 Favored 'Trans proline' 0 CA--C 1.546 1.115 0 C-N-CA 123.854 3.036 . . . . 0.0 114.722 -179.119 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 56.2 p -120.88 -0.33 10.13 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 126.947 2.099 . . . . 0.0 113.198 -179.301 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -66.75 145.77 55.17 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.601 -0.687 . . . . 0.0 110.805 170.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -56.45 -45.42 80.85 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.445 -0.784 . . . . 0.0 112.441 -176.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.6 tp -55.7 -29.93 26.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 124.955 1.302 . . . . 0.0 114.171 177.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 42.3 t -72.81 -45.97 54.65 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 O-C-N 121.314 -0.866 . . . . 0.0 110.519 173.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 68.5 mt -61.44 -36.76 81.27 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 119.137 0.88 . . . . 0.0 111.675 176.231 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 11.5 mtt -59.39 -52.48 65.42 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.581 1.152 . . . . 0.0 111.994 169.72 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -59.56 -40.26 86.73 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.589 0.755 . . . . 0.0 112.431 177.165 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -61.21 -50.39 73.3 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.977 0.911 . . . . 0.0 111.745 174.437 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -63.07 -40.0 96.38 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.434 0.693 . . . . 0.0 112.823 179.573 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 73.7 mt -65.53 -46.88 77.86 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.485 0.714 . . . . 0.0 111.72 172.167 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -62.78 -37.4 86.5 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.11 -0.994 . . . . 0.0 112.908 -177.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 23.5 mmmt -55.79 -41.82 74.66 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.234 1.014 . . . . 0.0 112.214 172.175 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 78.2 mt -78.18 -39.06 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 C-N-CA 123.921 0.888 . . . . 0.0 111.288 178.386 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 31.9 t80 -50.85 -51.99 45.82 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.53 -0.731 . . . . 0.0 110.302 172.08 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.9 mt -62.53 -41.8 99.11 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 178.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -67.64 -30.15 69.64 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 119.885 1.221 . . . . 0.0 112.664 179.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 69.8 mmtt -76.65 -50.18 14.37 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 117.646 -1.168 . . . . 0.0 112.505 175.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 6.6 m -66.71 -25.34 34.56 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 CA-C-N 121.084 1.765 . . . . 0.0 112.329 178.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -58.93 -28.25 66.05 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 171.284 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 95.0 mm-40 -95.95 -4.73 42.82 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.07 1.348 . . . . 0.0 112.925 177.129 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 41.6 ttp -64.96 137.3 97.11 Favored Pre-proline 0 CA--C 1.545 0.779 0 O-C-N 121.402 -0.811 . . . . 0.0 109.994 169.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -67.85 131.3 23.74 Favored 'Trans proline' 0 CA--C 1.535 0.538 0 C-N-CA 122.642 2.228 . . . . 0.0 110.72 178.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 83.0 mt-30 -70.35 -24.95 63.07 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -76.72 154.82 33.76 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.187 0.995 . . . . 0.0 112.469 169.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -132.4 133.22 43.65 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.363 1.065 . . . . 0.0 110.827 -172.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 7.8 p -150.47 142.73 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 124.678 1.191 . . . . 0.0 111.56 -177.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -65.11 142.3 58.42 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-O 121.554 0.692 . . . . 0.0 111.179 171.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 98.6 mt -73.86 166.47 23.27 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 113.882 1.067 . . . . 0.0 113.882 -178.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 4.3 pp -136.75 153.99 76.11 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 126.823 2.049 . . . . 0.0 111.03 177.026 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_endo -77.16 150.65 29.5 Favored 'Trans proline' 0 CA--C 1.547 1.128 0 C-N-CA 123.005 2.47 . . . . 0.0 112.749 -173.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -72.19 159.68 49.17 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 123.338 2.692 . . . . 0.0 112.335 175.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -153.2 152.27 27.52 Favored Pre-proline 0 CA--C 1.548 0.893 0 C-N-CA 125.304 1.441 . . . . 0.0 111.344 176.44 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -69.92 135.06 29.13 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 123.051 2.501 . . . . 0.0 111.635 177.364 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -156.52 152.37 27.25 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.851 1.66 . . . . 0.0 111.75 178.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . 160.92 34.19 0.02 OUTLIER Glycine 0 CA--C 1.537 1.429 0 N-CA-C 115.298 0.879 . . . . 0.0 115.298 -179.022 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 99.4 mttt . . . . . 0 C--O 1.252 1.229 0 C-N-CA 125.164 1.386 . . . . 0.0 113.031 -179.225 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.532 0 CA-C-O 121.327 0.404 . . . . 0.0 112.165 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 29.9 m -160.43 163.1 33.29 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 126.153 1.781 . . . . 0.0 111.068 174.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.2 t -154.79 170.95 20.41 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.417 1.087 . . . . 0.0 112.601 -178.625 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 77.02 -60.36 3.48 Favored Glycine 0 CA--C 1.533 1.203 0 C-N-CA 126.622 2.058 . . . . 0.0 114.145 177.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 8.4 t -62.41 165.87 5.67 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.844 1.258 . . . . 0.0 112.669 176.61 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.2 t -53.67 140.3 29.66 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.338 1.055 . . . . 0.0 112.092 175.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -171.48 -174.36 39.09 Favored Glycine 0 CA--C 1.533 1.16 0 CA-C-O 121.873 0.707 . . . . 0.0 114.663 -171.657 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -63.0 164.69 7.88 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.958 1.703 . . . . 0.0 115.562 -174.37 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 30.4 m -122.83 -8.25 8.25 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 C-N-CA 126.651 1.98 . . . . 0.0 113.868 -172.38 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 38.8 t -145.34 125.12 13.38 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 126.071 1.748 . . . . 0.0 109.854 178.114 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 23.2 t-20 -151.56 130.04 6.19 Favored Pre-proline 0 CA--C 1.549 0.931 0 C-N-CA 124.619 1.168 . . . . 0.0 110.9 -176.177 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -79.59 -18.91 10.4 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 C-N-CA 123.577 2.851 . . . . 0.0 114.578 -176.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 15.3 t -87.14 -38.76 16.14 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.439 1.096 . . . . 0.0 112.444 -178.183 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.1 ttmp? -60.94 126.68 86.26 Favored Pre-proline 0 CA--C 1.546 0.819 0 C-N-CA 124.817 1.247 . . . . 0.0 110.548 174.426 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -72.84 144.32 38.65 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.795 2.33 . . . . 0.0 112.336 -178.361 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 160.38 164.42 15.39 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 124.288 0.947 . . . . 0.0 113.705 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 12.4 ptm180 -163.34 162.05 24.85 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 126.602 1.961 . . . . 0.0 110.974 172.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 47.8 pttt -61.48 142.4 57.04 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 170.299 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 69.7 p -148.22 165.34 31.23 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 126.763 2.025 . . . . 0.0 110.895 179.661 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 19.7 p-10 -51.41 -35.37 38.8 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 114.561 1.319 . . . . 0.0 114.561 175.781 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -69.37 -50.64 44.3 Favored 'General case' 0 CA--C 1.531 0.243 0 O-C-N 121.899 -0.501 . . . . 0.0 110.531 178.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 86.9 mt -61.44 -34.88 76.16 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.983 0.913 . . . . 0.0 112.052 175.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 7.5 tp60 -59.41 -52.73 64.35 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.253 1.021 . . . . 0.0 111.516 171.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 73.3 t80 -55.04 -42.54 72.8 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.128 0.971 . . . . 0.0 112.269 177.019 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 96.0 mmm -58.27 -51.11 71.15 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.291 0.636 . . . . 0.0 112.615 174.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -79.33 -15.02 58.6 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 114.952 1.464 . . . . 0.0 114.952 179.455 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 35.5 m-20 -103.52 -19.5 14.36 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 119.644 1.111 . . . . 0.0 113.902 -174.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 39.3 t -133.64 -48.55 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 123.926 0.89 . . . . 0.0 111.506 -178.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 19.9 t -72.3 -64.42 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 CA-C-N 119.015 0.825 . . . . 0.0 110.908 -171.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 86.5 t -57.06 -43.3 80.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 124.098 0.959 . . . . 0.0 109.939 171.335 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 12.2 tppt? -58.89 -34.48 71.7 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.195 0.998 . . . . 0.0 113.341 -178.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 78.1 m -84.01 -42.97 15.64 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 118.716 0.689 . . . . 0.0 111.555 175.673 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 67.9 mt -61.85 -33.04 73.44 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.567 0.747 . . . . 0.0 112.313 177.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 19.8 t-105 -74.71 -28.73 60.93 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.782 1.633 . . . . 0.0 113.303 175.335 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 32.5 mtmm -74.71 -13.55 60.63 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 114.001 1.112 . . . . 0.0 114.001 171.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 36.1 t-80 -61.92 154.5 26.11 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.386 1.075 . . . . 0.0 113.507 -175.141 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 65.4 mt-30 -59.87 -18.27 43.13 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.345 1.458 . . . . 0.0 114.148 176.019 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -126.36 20.51 7.38 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.372 1.469 . . . . 0.0 113.882 -174.221 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.1 -28.08 65.11 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 113.774 1.028 . . . . 0.0 113.774 175.177 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 49.7 p-90 -57.89 -37.14 52.56 Favored Pre-proline 0 CA--C 1.548 0.878 0 N-CA-C 117.689 2.477 . . . . 0.0 117.689 -170.171 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -73.02 -5.32 16.99 Favored 'Trans proline' 0 CA--C 1.542 0.924 0 CA-C-N 123.048 2.124 . . . . 0.0 113.925 173.606 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 72.0 m-85 -109.01 -4.87 16.33 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.312 1.445 . . . . 0.0 113.135 178.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -61.97 -18.24 59.73 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 114.327 1.232 . . . . 0.0 114.327 179.388 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -141.44 154.41 66.87 Favored Pre-proline 0 CA--C 1.544 0.718 0 C-N-CA 125.995 1.718 . . . . 0.0 110.348 179.36 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -67.67 150.19 79.37 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 122.755 2.303 . . . . 0.0 112.626 176.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 89.2 t -62.59 142.24 16.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 123.892 0.877 . . . . 0.0 110.904 171.375 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -125.06 96.0 4.7 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.467 1.507 . . . . 0.0 109.767 174.214 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.8 -29.18 59.29 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -178.15 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 85.3 mt -64.88 -49.04 81.8 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 124.652 1.181 . . . . 0.0 110.831 173.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -68.19 -42.05 80.5 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.092 1.357 . . . . 0.0 112.731 -179.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.6 mp -78.79 -5.15 52.61 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 124.418 1.087 . . . . 0.0 113.231 176.274 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 61.5 t30 55.34 53.67 9.63 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.213 1.805 . . . . 0.0 113.647 -179.224 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 25.7 mt -113.43 86.39 10.0 Favored Pre-proline 0 CA--C 1.544 0.715 0 C-N-CA 126.285 1.834 . . . . 0.0 110.094 -177.374 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_endo -67.82 -4.1 11.66 Favored 'Trans proline' 0 CA--C 1.543 0.965 0 C-N-CA 123.548 2.832 . . . . 0.0 113.247 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 16.9 p-10 -123.7 1.25 8.8 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 127.35 2.26 . . . . 0.0 114.277 -178.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -54.42 -51.1 65.97 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 120.288 1.404 . . . . 0.0 112.034 178.056 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 99.7 m-70 -77.26 1.99 16.95 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.607 1.563 . . . . 0.0 114.281 177.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.6 mmtp -95.92 -42.55 8.24 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.835 1.254 . . . . 0.0 110.553 177.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.9 mp -76.59 -48.33 26.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 C-N-CA 124.05 0.94 . . . . 0.0 110.279 171.357 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 36.6 mm -96.3 128.7 47.25 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 124.318 1.047 . . . . 0.0 111.35 -177.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -95.86 -37.86 10.54 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.831 1.252 . . . . 0.0 111.588 -178.597 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 42.2 m-20 -130.13 78.73 74.17 Favored Pre-proline 0 CA--C 1.547 0.863 0 C-N-CA 125.421 1.488 . . . . 0.0 109.963 -173.063 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -71.13 143.96 45.65 Favored 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 123.948 3.099 . . . . 0.0 111.6 -179.514 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 8.5 tpt -156.88 141.09 16.47 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.316 1.046 . . . . 0.0 111.875 -171.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -148.99 150.8 33.45 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 125.765 1.626 . . . . 0.0 112.409 -175.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 7.0 ttp -59.04 -36.84 75.68 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.893 1.277 . . . . 0.0 113.77 -171.355 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -59.99 -21.27 55.62 Favored Glycine 0 CA--C 1.533 1.183 0 C-N-CA 125.591 1.567 . . . . 0.0 114.739 175.025 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 35.1 m -90.18 -42.04 11.27 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.724 0.81 . . . . 0.0 111.196 173.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 66.4 mt -56.15 -48.28 79.43 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 124.215 1.006 . . . . 0.0 111.407 -178.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.78 -33.59 66.78 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 178.531 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 2.5 tppp? -74.31 -41.89 60.41 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.483 1.113 . . . . 0.0 112.362 -178.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 4.6 ptp180 -71.52 -30.9 66.46 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 172.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 23.7 mt -61.31 -39.16 89.47 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.292 0.951 . . . . 0.0 113.404 169.547 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -67.58 -13.13 61.8 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 115.354 1.613 . . . . 0.0 115.354 -174.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -132.67 175.36 9.39 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.426 1.49 . . . . 0.0 113.727 -178.357 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -77.69 80.84 4.14 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 125.0 1.32 . . . . 0.0 111.999 -178.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 49.3 t80 -114.79 -36.5 4.48 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.815 1.246 . . . . 0.0 113.097 -175.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -137.92 169.95 16.9 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 127.431 2.292 . . . . 0.0 110.925 171.769 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.1 t-105 -102.19 -23.84 13.99 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.675 1.19 . . . . 0.0 112.763 -175.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 35.3 t -139.34 146.51 40.36 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.897 1.279 . . . . 0.0 111.003 177.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -59.74 -13.99 12.49 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.789 2.036 . . . . 0.0 115.133 176.14 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 53.5 p -52.23 -33.0 39.33 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 120.564 1.529 . . . . 0.0 113.353 172.503 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -74.86 -39.56 61.49 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.608 1.163 . . . . 0.0 112.479 176.412 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -71.89 -31.05 66.03 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 124.142 0.977 . . . . 0.0 112.391 178.157 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 86.2 mtp -62.18 -40.72 96.98 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 125.114 1.365 . . . . 0.0 111.875 170.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -66.31 -31.08 71.65 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 174.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -67.85 -42.77 80.86 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 119.42 1.009 . . . . 0.0 111.659 170.439 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -59.96 -44.7 94.27 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 121.072 -1.018 . . . . 0.0 112.646 171.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 19.3 t30 -57.45 -44.58 84.87 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 121.57 -0.706 . . . . 0.0 111.656 172.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 63.7 m -65.66 -35.76 81.71 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.333 1.053 . . . . 0.0 112.528 178.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 16.5 ttm -58.89 -60.27 4.13 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.982 0.913 . . . . 0.0 111.475 173.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -63.63 -38.58 91.65 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 122.612 0.365 . . . . 0.0 111.781 -177.684 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 72.9 m -64.8 -47.85 76.58 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.377 0.671 . . . . 0.0 112.133 178.036 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -64.64 -30.98 72.01 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 120.155 1.343 . . . . 0.0 112.406 178.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 85.5 m -62.35 -45.98 90.75 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.356 0.662 . . . . 0.0 112.229 170.072 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -66.12 -34.45 78.08 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 177.126 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 77.4 mt -69.78 -57.6 7.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 C-N-CA 123.407 0.683 . . . . 0.0 110.782 177.583 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 48.7 t80 -69.45 -26.71 64.73 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -171.069 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 46.0 m-80 -114.76 161.04 18.7 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.091 0.956 . . . . 0.0 112.45 -171.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -66.26 146.01 99.01 Favored Pre-proline 0 N--CA 1.473 0.695 0 C-N-CA 124.228 1.011 . . . . 0.0 110.341 176.398 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -65.89 -7.84 17.99 Favored 'Trans proline' 0 CA--C 1.542 0.924 0 C-N-CA 123.659 2.906 . . . . 0.0 114.595 -175.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 56.8 p -115.26 0.96 13.67 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 126.703 2.001 . . . . 0.0 113.175 179.133 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -65.83 148.0 52.47 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 121.476 -0.765 . . . . 0.0 110.844 172.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -51.55 -49.55 61.78 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 123.417 0.687 . . . . 0.0 112.203 178.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 9.7 tp -57.28 -30.14 34.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 -179.221 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 42.7 t -73.15 -47.08 48.76 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 O-C-N 121.515 -0.74 . . . . 0.0 110.588 173.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 80.3 mt -61.29 -37.39 83.01 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 119.11 0.868 . . . . 0.0 111.649 176.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 8.8 mtt -59.12 -51.14 71.32 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.993 1.317 . . . . 0.0 111.915 169.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.09 -39.67 86.93 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 176.196 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -62.49 -45.32 93.54 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 119.502 1.046 . . . . 0.0 111.872 174.094 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -66.57 -29.61 69.72 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.304 1.042 . . . . 0.0 113.724 179.637 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 80.4 mt -78.05 -47.61 17.99 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.976 0.91 . . . . 0.0 111.65 169.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -62.1 -38.65 89.69 Favored 'General case' 0 N--CA 1.468 0.45 0 O-C-N 121.05 -1.032 . . . . 0.0 113.128 -174.486 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 19.7 pttp -58.26 -42.88 87.44 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 118.783 0.72 . . . . 0.0 111.874 176.179 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 77.0 mt -67.74 -46.49 82.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 C-N-CA 124.3 1.04 . . . . 0.0 110.743 176.073 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 44.8 t80 -50.94 -50.63 57.44 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.142 0.883 . . . . 0.0 111.237 173.753 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.1 mt -62.98 -41.21 99.5 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 179.151 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -61.43 -37.96 85.41 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 119.409 1.004 . . . . 0.0 112.955 173.154 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -72.47 -49.5 32.79 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.175 0.99 . . . . 0.0 112.616 179.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 7.1 m -69.21 -25.79 30.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 CA-C-N 119.955 1.252 . . . . 0.0 112.126 177.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -59.37 -31.02 68.83 Favored 'General case' 0 CA--C 1.541 0.596 0 O-C-N 121.607 -0.683 . . . . 0.0 112.208 171.377 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 29.1 mm100 -97.0 3.84 51.79 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.239 1.415 . . . . 0.0 113.106 177.729 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 9.6 ttm -54.26 140.89 53.32 Favored Pre-proline 0 CA--C 1.546 0.826 0 C-N-CA 124.642 1.177 . . . . 0.0 112.164 174.392 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -68.82 112.62 2.95 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 122.901 2.401 . . . . 0.0 109.008 168.184 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -68.81 -20.13 64.31 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 -173.654 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -82.41 157.7 23.59 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.547 1.539 . . . . 0.0 112.269 176.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -117.65 128.22 54.71 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.608 1.563 . . . . 0.0 110.865 -174.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 63.4 t -141.88 135.07 29.1 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 126.472 1.909 . . . . 0.0 109.901 -171.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -70.55 131.29 43.76 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.534 1.534 . . . . 0.0 112.404 175.602 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 93.9 mt -80.61 160.07 25.21 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 177.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 95.8 mt -67.58 159.0 80.77 Favored Pre-proline 0 CA--C 1.549 0.942 0 C-N-CA 125.647 1.579 . . . . 0.0 112.813 172.689 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -71.2 153.97 61.98 Favored 'Trans proline' 0 CA--C 1.548 1.187 0 C-N-CA 123.007 2.471 . . . . 0.0 112.424 176.341 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_endo -76.57 170.34 20.11 Favored 'Trans proline' 0 CA--C 1.54 0.811 0 C-N-CA 123.87 3.047 . . . . 0.0 112.913 179.157 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -61.21 155.62 55.26 Favored Pre-proline 0 CA--C 1.553 1.074 0 C-N-CA 124.384 1.073 . . . . 0.0 112.021 169.383 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -74.73 -9.65 21.26 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 123.254 2.636 . . . . 0.0 115.095 -177.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 28.2 ttpp -77.17 139.44 39.92 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.737 1.615 . . . . 0.0 111.28 175.251 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . 178.51 174.69 44.98 Favored Glycine 0 CA--C 1.535 1.315 0 C-N-CA 124.297 0.951 . . . . 0.0 113.951 176.451 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.254 1.29 0 C-N-CA 127.818 2.447 . . . . 0.0 113.223 -176.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.484 0 N-CA-C 111.263 -0.735 . . . . 0.0 111.263 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.3 t -139.43 17.79 2.56 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.822 1.249 . . . . 0.0 113.296 -178.022 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 40.2 m -156.88 138.35 13.95 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.726 1.61 . . . . 0.0 110.23 171.719 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -110.84 -172.07 19.68 Favored Glycine 0 CA--C 1.533 1.2 0 C-N-CA 125.31 1.433 . . . . 0.0 112.61 177.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 47.4 m -54.77 108.64 0.41 Allowed 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.902 1.281 . . . . 0.0 112.09 178.058 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 9.3 t -154.84 159.49 40.58 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.342 1.457 . . . . 0.0 111.38 -176.095 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 155.17 69.58 0.01 OUTLIER Glycine 0 CA--C 1.529 0.916 0 C-N-CA 124.776 1.179 . . . . 0.0 111.612 -174.07 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.2 pm0 -54.02 153.53 4.87 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 115.28 1.585 . . . . 0.0 115.28 -174.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 27.3 m -141.24 -7.27 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 C-N-CA 125.563 1.545 . . . . 0.0 114.311 -169.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.4 m -142.88 29.26 1.52 Allowed 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.813 1.245 . . . . 0.0 114.113 -172.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -53.45 125.46 44.12 Favored Pre-proline 0 CA--C 1.553 1.061 0 C-N-CA 124.369 1.068 . . . . 0.0 112.718 -175.852 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -79.71 -167.61 0.53 Allowed 'Trans proline' 0 CA--C 1.542 0.913 0 C-N-CA 124.558 3.505 . . . . 0.0 110.959 175.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 32.6 m 49.29 29.29 2.63 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 126.96 2.104 . . . . 0.0 114.799 179.093 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.8 ttpp -147.6 139.05 13.55 Favored Pre-proline 0 CA--C 1.544 0.734 0 C-N-CA 127.276 2.23 . . . . 0.0 110.47 -168.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -73.56 161.02 43.16 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 123.252 2.635 . . . . 0.0 112.744 177.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 155.69 159.2 9.21 Favored Glycine 0 CA--C 1.533 1.164 0 C-N-CA 125.869 1.7 . . . . 0.0 112.165 172.779 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 7.2 ptp180 -160.1 165.46 31.7 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 126.072 1.749 . . . . 0.0 110.44 178.881 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.0 ttpt -75.4 132.52 40.94 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 166.352 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 66.6 p -124.85 170.14 11.35 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 126.115 1.766 . . . . 0.0 108.829 177.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 23.8 p-10 -52.03 -32.09 32.71 Favored 'General case' 0 N--CA 1.475 0.819 0 O-C-N 121.161 -0.962 . . . . 0.0 113.349 173.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.9 mm-40 -70.7 -53.44 15.63 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 123.846 0.859 . . . . 0.0 111.745 177.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.8 mt -64.25 -32.75 74.46 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.067 0.848 . . . . 0.0 112.551 176.657 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 22.8 tt0 -59.65 -50.22 74.71 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.144 0.977 . . . . 0.0 111.146 170.126 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 62.5 t80 -57.83 -40.9 81.13 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.625 0.77 . . . . 0.0 112.376 176.63 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 82.0 mmm -56.64 -52.44 64.86 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 122.765 0.426 . . . . 0.0 112.007 174.106 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -78.24 -18.1 55.82 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 -178.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 42.3 m-20 -99.47 -21.56 15.9 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.594 0.961 . . . . 0.0 113.594 -173.241 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 29.3 t -135.89 -48.45 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 CA-C-O 118.511 -0.757 . . . . 0.0 111.915 -177.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 18.4 t -68.23 -63.67 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 CA-C-N 119.151 0.887 . . . . 0.0 110.669 -173.811 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 81.7 t -57.83 -47.13 86.83 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 C-N-CA 124.454 1.101 . . . . 0.0 110.13 173.348 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -57.41 -44.09 84.32 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 118.682 0.674 . . . . 0.0 112.703 -176.341 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 48.1 m -69.87 -46.72 64.9 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 121.977 -0.452 . . . . 0.0 111.654 176.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 66.7 mt -61.63 -33.46 73.97 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.236 0.614 . . . . 0.0 112.157 178.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 24.0 t-105 -71.29 -29.36 64.96 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.88 1.672 . . . . 0.0 113.413 176.013 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 54.2 mtmt -83.83 -8.34 59.24 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.066 0.947 . . . . 0.0 113.503 177.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 43.2 t-80 -62.69 154.67 28.64 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.719 1.208 . . . . 0.0 113.152 -178.249 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -60.29 -17.14 40.45 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.307 1.443 . . . . 0.0 114.176 174.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -124.14 15.24 9.13 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.735 1.614 . . . . 0.0 113.984 -174.562 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.82 -30.2 67.66 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.802 1.241 . . . . 0.0 114.14 178.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . 0.41 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 38.6 p-90 -56.26 -37.85 61.95 Favored Pre-proline 0 CA--C 1.548 0.9 0 N-CA-C 117.466 2.395 . . . . 0.0 117.466 -170.471 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.41 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 72.1 Cg_endo -72.05 -5.71 17.65 Favored 'Trans proline' 0 CA--C 1.544 0.976 0 CA-C-N 123.164 2.166 . . . . 0.0 114.179 173.434 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -108.91 -4.83 16.46 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.352 1.461 . . . . 0.0 113.057 178.323 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 21.3 m-30 -64.29 -16.17 61.63 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 113.927 1.084 . . . . 0.0 113.927 176.107 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -143.37 158.61 57.42 Favored Pre-proline 0 CA--C 1.546 0.826 0 C-N-CA 126.437 1.895 . . . . 0.0 110.726 -177.123 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -64.81 157.67 55.05 Favored 'Trans proline' 0 CA--C 1.536 0.6 0 C-N-CA 123.052 2.501 . . . . 0.0 112.75 175.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 36.0 t -75.71 87.3 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 C-N-CA 124.679 1.192 . . . . 0.0 109.434 174.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 58.4 m-20 -69.87 85.81 0.5 Allowed 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.837 1.255 . . . . 0.0 111.78 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.3 -28.24 27.19 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.913 1.285 . . . . 0.0 114.128 178.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 82.7 mt -66.44 -49.89 71.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 125.177 1.391 . . . . 0.0 111.152 173.265 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -66.69 -38.63 87.18 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.93 1.292 . . . . 0.0 112.543 178.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 84.7 mt -85.24 -5.29 59.33 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 126.439 1.896 . . . . 0.0 113.205 -178.118 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 51.37 54.88 10.32 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.907 1.683 . . . . 0.0 113.174 -176.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 45.0 mt -114.41 81.5 6.79 Favored Pre-proline 0 N--CA 1.474 0.742 0 C-N-CA 125.803 1.641 . . . . 0.0 110.676 -179.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -66.57 -14.14 42.79 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 123.423 2.748 . . . . 0.0 113.583 -175.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 34.4 m-20 -106.95 5.07 27.89 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.615 1.566 . . . . 0.0 113.269 177.005 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -53.54 -51.65 62.22 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 120.321 1.419 . . . . 0.0 112.788 -175.244 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -76.8 -16.05 59.56 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.857 1.263 . . . . 0.0 113.839 -179.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 9.4 mptt -68.37 -42.22 79.48 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.875 0.87 . . . . 0.0 110.363 174.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.9 mp -81.1 -55.34 8.37 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 C-N-CA 124.534 1.133 . . . . 0.0 110.431 173.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 50.5 mm -85.44 100.69 8.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 CA-C-O 122.322 1.058 . . . . 0.0 111.295 -176.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -66.93 -29.38 69.23 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 126.121 1.769 . . . . 0.0 114.091 179.328 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -145.51 78.34 12.06 Favored Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 125.689 1.596 . . . . 0.0 110.909 -171.349 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -68.66 149.67 73.85 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 124.157 3.238 . . . . 0.0 112.087 -178.441 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 8.7 tpt -158.22 148.83 20.46 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.771 1.228 . . . . 0.0 111.1 -171.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -152.75 152.08 31.24 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.069 1.348 . . . . 0.0 112.278 178.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 6.6 ttp -60.24 -33.73 72.69 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.632 1.173 . . . . 0.0 112.477 -176.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -61.52 -23.52 62.82 Favored Glycine 0 CA--C 1.536 1.397 0 C-N-CA 125.734 1.635 . . . . 0.0 114.769 172.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 93.3 m -93.98 -38.95 10.91 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 118.363 1.081 . . . . 0.0 111.387 172.079 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 89.9 mt -53.07 -50.03 47.27 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 CA-C-N 119.69 1.132 . . . . 0.0 111.108 176.462 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -57.89 -35.78 71.49 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 176.414 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 22.5 ttmm -70.86 -38.51 73.13 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.229 1.012 . . . . 0.0 113.208 -177.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -72.78 -30.48 64.14 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-N 119.122 0.874 . . . . 0.0 113.189 171.062 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 48.8 mt -63.7 -39.09 93.45 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-N 119.744 1.156 . . . . 0.0 113.243 168.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -77.52 14.42 1.0 Allowed 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.88 1.272 . . . . 0.0 113.732 176.685 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 32.6 m-80 -137.08 167.51 21.39 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 127.006 2.122 . . . . 0.0 111.317 177.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -75.94 37.0 0.15 Allowed 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 125.514 1.526 . . . . 0.0 111.952 173.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 30.0 t80 -70.82 -31.03 67.64 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 120.438 -1.413 . . . . 0.0 113.324 -169.254 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -144.12 -178.31 5.88 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 127.127 2.171 . . . . 0.0 110.389 175.196 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 6.6 t-105 -113.99 -25.17 8.68 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.565 1.146 . . . . 0.0 111.485 177.002 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.1 m -130.27 136.45 49.19 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.165 1.386 . . . . 0.0 111.775 -168.493 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -66.24 -16.48 64.04 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 115.669 1.729 . . . . 0.0 115.669 -173.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 16.5 m -53.76 -32.31 51.81 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.381 0.991 . . . . 0.0 112.909 175.089 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -69.87 -44.13 70.44 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.822 0.849 . . . . 0.0 112.442 175.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 43.4 t -61.72 -37.55 84.62 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.165 0.986 . . . . 0.0 112.466 171.277 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 83.2 mtp -65.96 -40.04 90.95 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.037 0.935 . . . . 0.0 112.155 176.395 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -63.44 -36.31 83.32 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 112.716 0.635 . . . . 0.0 112.716 170.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 91.8 m-20 -65.47 -43.67 89.57 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 119.445 1.02 . . . . 0.0 112.12 173.29 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -57.72 -45.78 85.29 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 121.374 -0.829 . . . . 0.0 112.445 171.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 13.6 t30 -55.92 -52.43 64.15 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.385 0.674 . . . . 0.0 111.779 174.293 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 53.5 m -57.86 -43.43 85.96 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.831 0.852 . . . . 0.0 112.476 178.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 53.2 ttp -56.72 -53.42 57.92 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 118.996 0.817 . . . . 0.0 112.9 177.407 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -69.25 -35.54 76.22 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 179.689 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.7 m -58.75 -49.96 75.68 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.372 1.069 . . . . 0.0 111.983 172.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -57.86 -38.72 76.22 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.316 0.646 . . . . 0.0 112.108 -178.335 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 24.0 m -56.1 -42.22 76.46 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.027 0.931 . . . . 0.0 112.707 172.612 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 7.0 m-85 -71.18 -29.34 65.06 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 176.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 79.3 mt -75.26 -57.75 5.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 123.617 0.767 . . . . 0.0 110.654 179.546 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -71.44 -27.06 63.02 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 114.362 1.245 . . . . 0.0 114.362 -171.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 36.6 m-80 -113.1 161.68 16.82 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.591 1.156 . . . . 0.0 111.729 -173.1 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -71.82 151.45 93.19 Favored Pre-proline 0 N--CA 1.471 0.621 0 C-N-CA 123.998 0.919 . . . . 0.0 109.79 176.557 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -65.38 -1.03 4.07 Favored 'Trans proline' 0 CA--C 1.547 1.134 0 C-N-CA 123.763 2.976 . . . . 0.0 114.691 -179.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 53.8 p -118.8 -2.28 10.92 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 127.176 2.191 . . . . 0.0 113.167 -179.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 58.4 m-20 -68.56 145.87 53.59 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 118.929 0.786 . . . . 0.0 110.804 170.598 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -56.74 -45.1 82.2 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.413 -0.805 . . . . 0.0 112.589 -176.318 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.6 tp -55.88 -29.37 25.96 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 124.946 1.298 . . . . 0.0 114.214 178.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 37.3 t -71.07 -48.3 56.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 O-C-N 121.364 -0.835 . . . . 0.0 110.416 172.779 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 66.4 mt -61.41 -36.59 80.72 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 118.829 0.74 . . . . 0.0 111.697 177.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 10.8 mtt -58.93 -51.73 68.8 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 124.854 1.261 . . . . 0.0 112.048 170.153 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.82 -39.35 91.46 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.358 0.663 . . . . 0.0 112.681 176.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 90.1 mt-30 -61.51 -47.06 87.3 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 119.107 0.867 . . . . 0.0 111.817 174.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -63.16 -45.2 92.97 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 123.802 0.841 . . . . 0.0 112.512 178.112 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 81.7 mt -64.96 -45.02 87.43 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.742 0.817 . . . . 0.0 112.084 175.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -63.71 -37.46 87.43 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 121.093 -1.004 . . . . 0.0 112.751 -177.071 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -58.53 -40.03 81.81 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 121.399 -0.813 . . . . 0.0 112.272 172.377 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 78.5 mt -74.3 -40.92 50.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 C-N-CA 123.243 0.617 . . . . 0.0 111.349 177.086 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -51.16 -51.36 54.46 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.456 -0.778 . . . . 0.0 110.364 171.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 96.1 mt -62.92 -41.31 99.43 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 112.904 0.705 . . . . 0.0 112.904 177.581 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -67.16 -29.98 69.82 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 120.199 1.363 . . . . 0.0 112.845 -179.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 71.5 mmtt -74.86 -52.43 11.35 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.953 0.901 . . . . 0.0 112.285 174.34 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.8 m -65.96 -24.81 34.66 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 120.316 1.416 . . . . 0.0 112.151 179.126 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -61.84 -28.54 69.56 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 121.475 -0.765 . . . . 0.0 112.933 171.207 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -96.51 -3.34 43.39 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.462 1.505 . . . . 0.0 112.599 177.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 5.9 ttm -57.24 142.01 76.21 Favored Pre-proline 0 CA--C 1.548 0.898 0 C-N-CA 124.298 1.039 . . . . 0.0 110.727 169.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_endo -63.16 145.96 93.89 Favored 'Trans proline' 0 CA--C 1.537 0.675 0 C-N-CA 122.563 2.175 . . . . 0.0 110.252 169.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -77.75 -17.66 57.32 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 120.827 -1.171 . . . . 0.0 113.344 177.468 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -94.45 154.11 17.6 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.32 1.448 . . . . 0.0 112.605 -177.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -128.91 133.28 47.83 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.247 1.419 . . . . 0.0 111.335 -172.168 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 9.1 p -147.87 145.13 18.98 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 124.184 0.994 . . . . 0.0 112.914 -174.289 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -64.15 132.93 51.88 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.304 1.841 . . . . 0.0 111.684 171.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 92.8 mt -78.01 173.63 11.98 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 178.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 4.4 pp -121.25 153.94 58.53 Favored Pre-proline 0 CA--C 1.547 0.857 0 C-N-CA 126.005 1.722 . . . . 0.0 110.641 173.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -73.51 151.69 47.81 Favored 'Trans proline' 0 CA--C 1.545 1.061 0 C-N-CA 122.654 2.236 . . . . 0.0 113.398 -169.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -72.46 167.78 26.1 Favored 'Trans proline' 0 CA--C 1.54 0.777 0 C-N-CA 123.878 3.052 . . . . 0.0 112.737 177.288 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -61.02 150.53 78.14 Favored Pre-proline 0 CA--C 1.551 1.019 0 C-N-CA 124.238 1.015 . . . . 0.0 112.71 174.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -75.03 76.57 3.37 Favored 'Trans proline' 0 CA--C 1.545 1.051 0 C-N-CA 124.513 3.475 . . . . 0.0 112.086 178.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -134.97 155.64 50.41 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 126.241 1.816 . . . . 0.0 111.562 -178.381 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . -78.13 161.89 49.39 Favored Glycine 0 CA--C 1.536 1.375 0 C-N-CA 124.008 0.813 . . . . 0.0 113.491 176.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt . . . . . 0 C--O 1.252 1.221 0 C-N-CA 125.938 1.695 . . . . 0.0 111.351 -179.912 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.424 0 N-CA-C 110.883 -0.887 . . . . 0.0 110.883 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 23.2 t -53.44 133.53 40.59 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.87 0.868 . . . . 0.0 111.752 177.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 60.2 m -138.11 26.18 2.7 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.957 1.303 . . . . 0.0 113.29 -168.662 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -60.12 155.99 30.15 Favored Glycine 0 CA--C 1.54 1.595 0 C-N-CA 124.266 0.936 . . . . 0.0 114.173 176.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 16.7 m -72.73 -18.8 61.48 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 114.905 1.446 . . . . 0.0 114.905 -173.664 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 35.6 m -67.73 168.77 10.73 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.161 1.385 . . . . 0.0 113.446 179.191 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -141.0 156.58 25.59 Favored Glycine 0 CA--C 1.534 1.276 0 C-N-CA 124.993 1.282 . . . . 0.0 112.755 173.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -78.87 154.93 29.36 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.325 1.05 . . . . 0.0 113.65 -174.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 29.6 m -134.36 -11.59 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 C-N-CA 125.239 1.416 . . . . 0.0 113.614 178.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 81.2 p -145.99 149.77 34.78 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 126.38 1.872 . . . . 0.0 109.995 171.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 40.0 p30 -154.36 145.96 16.82 Favored Pre-proline 0 CA--C 1.55 0.954 0 C-N-CA 123.967 0.907 . . . . 0.0 112.929 -170.631 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -87.92 -27.45 0.54 Allowed 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 123.622 2.881 . . . . 0.0 113.322 174.247 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 24.9 m -83.68 -38.02 22.0 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 -168.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 34.2 ttmt -80.31 134.67 54.9 Favored Pre-proline 0 N--CA 1.476 0.864 0 C-N-CA 123.54 0.736 . . . . 0.0 109.952 176.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_endo -71.37 154.67 60.94 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 122.361 2.04 . . . . 0.0 111.754 174.347 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -173.65 159.81 29.72 Favored Glycine 0 CA--C 1.53 0.974 0 C-N-CA 123.976 0.798 . . . . 0.0 113.314 176.06 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.5 ptt180 -157.53 164.84 36.94 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.39 1.876 . . . . 0.0 110.601 174.019 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 8.3 mmmt -71.48 121.02 17.9 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.878 1.271 . . . . 0.0 111.419 170.259 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 34.3 p -135.02 160.01 39.67 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 125.027 1.331 . . . . 0.0 112.376 -179.254 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 36.1 t30 -53.69 -33.21 54.69 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.808 1.643 . . . . 0.0 114.53 174.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 70.1 mm-40 -62.93 -56.94 12.81 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.041 0.936 . . . . 0.0 111.148 170.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 89.8 mt -65.42 -31.37 72.43 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 179.306 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -58.44 -55.25 37.4 Favored 'General case' 0 C--O 1.223 -0.298 0 C-N-CA 123.332 0.653 . . . . 0.0 110.082 169.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -57.29 -40.61 78.17 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 118.819 0.736 . . . . 0.0 112.305 -178.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 95.3 mmm -56.8 -52.36 65.35 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 121.856 -0.527 . . . . 0.0 112.373 172.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -83.64 -10.31 58.3 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 114.904 1.446 . . . . 0.0 114.904 -174.323 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -116.75 -18.6 10.21 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.477 1.511 . . . . 0.0 112.744 -170.069 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 10.9 t -133.03 -53.08 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 C-N-CA 123.574 0.75 . . . . 0.0 111.628 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.7 t -66.0 -63.99 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 CA-C-N 118.856 0.753 . . . . 0.0 110.599 -175.41 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 82.8 t -57.15 -47.59 83.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 124.022 0.929 . . . . 0.0 109.757 172.021 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.0 tptp -57.34 -43.12 83.16 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 113.442 0.904 . . . . 0.0 113.442 -171.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 91.2 m -77.67 -42.95 32.83 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 118.915 0.78 . . . . 0.0 112.556 174.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 79.7 mt -58.31 -30.85 66.99 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.397 0.998 . . . . 0.0 112.258 175.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 40.9 t-105 -75.77 -35.51 60.1 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 126.521 1.929 . . . . 0.0 114.129 179.171 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 21.6 pttp -88.93 -3.64 58.68 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 114.244 1.202 . . . . 0.0 114.244 178.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 60.1 t-80 -54.31 152.67 6.1 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.99 2.116 . . . . 0.0 113.318 173.088 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 22.8 tp60 -56.8 -21.39 28.44 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 126.158 1.783 . . . . 0.0 114.738 177.308 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -123.19 15.2 9.81 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.43 1.492 . . . . 0.0 114.077 -173.507 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.06 -27.39 62.65 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 114.444 1.276 . . . . 0.0 114.444 179.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 38.0 p-90 -55.64 -37.14 53.72 Favored Pre-proline 0 CA--C 1.55 0.958 0 N-CA-C 117.725 2.491 . . . . 0.0 117.725 -170.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -73.28 -5.49 17.24 Favored 'Trans proline' 0 CA--C 1.543 0.949 0 CA-C-N 123.249 2.196 . . . . 0.0 114.022 174.219 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 62.0 m-85 -107.47 -5.53 17.59 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.479 1.512 . . . . 0.0 112.918 179.086 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -64.29 -14.79 58.04 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.673 1.36 . . . . 0.0 114.673 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -138.87 153.98 72.4 Favored Pre-proline 0 CA--C 1.543 0.688 0 C-N-CA 125.597 1.559 . . . . 0.0 110.146 -179.377 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -65.41 149.11 88.4 Favored 'Trans proline' 0 CA--C 1.537 0.632 0 C-N-CA 122.595 2.197 . . . . 0.0 111.898 174.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 74.0 t -58.58 138.04 20.14 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 123.505 0.722 . . . . 0.0 110.991 171.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -128.7 106.62 9.06 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 125.547 1.539 . . . . 0.0 108.841 171.593 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.08 -28.0 64.16 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.276 1.03 . . . . 0.0 113.576 -178.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 79.7 mt -66.94 -50.91 60.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 124.751 1.22 . . . . 0.0 110.913 172.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 56.6 mttm -66.09 -39.33 89.9 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.771 1.228 . . . . 0.0 112.854 -177.587 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 55.3 mt -91.29 1.0 57.43 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.851 1.26 . . . . 0.0 113.745 179.624 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 65.0 t30 51.42 53.54 12.65 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 126.237 1.815 . . . . 0.0 113.768 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 36.0 mt -107.47 98.26 22.94 Favored Pre-proline 0 CA--C 1.544 0.718 0 C-N-CA 125.802 1.641 . . . . 0.0 109.769 -177.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -69.11 -10.55 29.4 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 122.984 2.456 . . . . 0.0 114.744 -171.318 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -139.95 17.54 2.47 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.261 1.424 . . . . 0.0 113.384 -173.337 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -47.99 -52.01 21.57 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-N 120.025 1.284 . . . . 0.0 113.729 -172.248 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -75.37 -9.62 58.72 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.166 1.387 . . . . 0.0 114.38 -178.7 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 29.4 mmmt -78.7 -44.85 22.63 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 121.229 -0.92 . . . . 0.0 110.59 174.337 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.3 mp -74.14 -45.35 48.13 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 124.111 0.964 . . . . 0.0 110.426 173.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 35.3 mm -101.24 109.97 26.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 CA-C-O 122.252 1.025 . . . . 0.0 111.896 -175.6 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.5 mptp? -79.49 -29.77 41.74 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.754 1.622 . . . . 0.0 113.0 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -138.06 85.1 19.65 Favored Pre-proline 0 CA--C 1.544 0.737 0 C-N-CA 125.207 1.403 . . . . 0.0 110.463 -178.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -73.15 144.89 38.28 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 123.529 2.82 . . . . 0.0 111.058 176.369 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.8 tpt -155.0 142.18 19.38 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.969 1.307 . . . . 0.0 110.508 -178.575 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 20.4 m-20 -146.36 150.44 35.69 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.639 1.576 . . . . 0.0 111.422 -175.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.9 ttp -61.13 -35.73 77.86 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.331 1.052 . . . . 0.0 112.743 -173.169 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -59.93 -21.86 56.5 Favored Glycine 0 CA--C 1.537 1.428 0 C-N-CA 125.625 1.583 . . . . 0.0 114.433 171.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 19.2 m -98.27 -34.08 10.84 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.208 1.403 . . . . 0.0 111.81 174.134 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 90.0 mt -55.36 -50.38 65.75 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 CA-C-N 119.538 1.063 . . . . 0.0 110.655 172.467 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -60.16 -37.04 78.94 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 113.218 0.822 . . . . 0.0 113.218 176.943 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.409 ' HE2' ' HA ' ' A' ' 88' ' ' LYS . 0.5 OUTLIER -62.09 -36.32 81.35 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.319 1.048 . . . . 0.0 113.008 -177.761 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 6.2 ptp180 -80.53 -32.35 36.8 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 173.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 65.0 mt -62.01 -32.1 72.55 Favored 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 114.447 1.277 . . . . 0.0 114.447 169.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -64.38 -12.23 40.64 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 114.745 1.387 . . . . 0.0 114.745 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 6.9 p30 -134.89 176.27 8.81 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.781 1.632 . . . . 0.0 112.851 177.033 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -78.03 44.94 0.5 Allowed 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 125.286 1.435 . . . . 0.0 113.126 -177.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 50.9 t80 -65.18 -30.69 71.62 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 121.278 -0.889 . . . . 0.0 112.977 -174.7 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -141.01 172.16 13.06 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 127.249 2.22 . . . . 0.0 111.479 176.796 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 15.8 t-105 -95.45 -22.25 17.81 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.42 1.088 . . . . 0.0 113.23 177.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 24.2 t -145.07 153.22 41.21 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.581 1.152 . . . . 0.0 113.448 -169.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -65.18 -21.24 66.74 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 116.285 1.957 . . . . 0.0 116.285 -175.442 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 15.2 m -58.84 -32.7 69.65 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 119.485 1.039 . . . . 0.0 113.24 -175.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -63.85 -44.07 94.24 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.408 -0.808 . . . . 0.0 112.17 173.601 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 50.5 t -64.21 -38.07 89.74 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.036 0.935 . . . . 0.0 112.117 175.143 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 78.3 mtp -62.43 -41.12 98.47 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.272 -0.892 . . . . 0.0 112.393 173.581 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -61.39 -39.65 91.46 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 112.27 0.471 . . . . 0.0 112.27 170.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -65.81 -39.85 91.3 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 118.963 0.801 . . . . 0.0 112.713 177.343 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 -60.05 -45.37 93.08 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 121.51 -0.744 . . . . 0.0 112.369 170.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 18.1 t30 -57.72 -46.81 83.9 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 121.875 -0.516 . . . . 0.0 112.023 174.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 93.1 m -65.36 -34.45 78.36 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.888 0.875 . . . . 0.0 112.764 177.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 50.9 ttp -61.21 -55.21 34.77 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 119.608 1.095 . . . . 0.0 111.844 174.495 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 24.0 m-85 -65.18 -38.36 90.24 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 122.004 -0.435 . . . . 0.0 111.977 179.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 88.6 m -64.69 -47.78 77.13 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 123.601 0.761 . . . . 0.0 112.397 179.009 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.1 p30 -64.67 -31.28 72.43 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 119.774 1.17 . . . . 0.0 112.568 -179.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 56.1 m -60.95 -44.24 97.57 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.542 0.737 . . . . 0.0 112.547 169.522 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -67.84 -31.32 71.07 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 113.736 1.013 . . . . 0.0 113.736 177.291 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 80.9 mt -72.17 -56.65 9.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 123.343 0.657 . . . . 0.0 110.617 177.042 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 41.9 t80 -67.31 -30.54 70.41 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 114.152 1.168 . . . . 0.0 114.152 -173.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -113.47 156.35 23.69 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.03 0.932 . . . . 0.0 112.361 -171.577 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 3.0 mppt? -67.43 148.68 98.64 Favored Pre-proline 0 N--CA 1.471 0.576 0 C-N-CA 124.684 1.194 . . . . 0.0 110.666 176.213 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -65.46 -7.23 15.42 Favored 'Trans proline' 0 CA--C 1.544 0.976 0 C-N-CA 123.749 2.966 . . . . 0.0 114.674 -176.243 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 43.5 p -108.55 -4.74 16.94 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 127.123 2.169 . . . . 0.0 113.268 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -67.79 146.55 53.61 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 118.883 0.765 . . . . 0.0 110.821 174.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -53.27 -47.76 68.85 Favored 'General case' 0 N--CA 1.469 0.519 0 O-C-N 121.59 -0.694 . . . . 0.0 112.258 179.097 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.2 tp -57.39 -30.03 34.79 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 C-N-CA 124.298 1.039 . . . . 0.0 113.786 -178.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 42.5 t -71.99 -48.52 49.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 O-C-N 121.535 -0.728 . . . . 0.0 110.442 174.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 79.8 mt -61.13 -36.96 81.16 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 118.978 0.808 . . . . 0.0 111.857 177.508 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 13.5 mtt -58.55 -52.73 64.43 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.919 1.288 . . . . 0.0 111.965 169.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.61 -38.75 88.76 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.464 0.706 . . . . 0.0 112.704 177.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -59.48 -51.11 71.27 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 119.229 0.922 . . . . 0.0 111.687 173.26 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.57 -43.28 99.19 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.752 0.821 . . . . 0.0 112.844 179.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 80.0 mt -62.95 -43.75 97.94 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.718 0.807 . . . . 0.0 111.748 173.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -60.9 -39.13 88.14 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 121.018 -1.051 . . . . 0.0 112.699 -179.111 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 7.2 mmpt? -61.69 -37.99 86.15 Favored 'General case' 0 N--CA 1.476 0.871 0 O-C-N 121.191 -0.943 . . . . 0.0 111.304 178.027 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 77.7 mt -74.41 -39.95 48.79 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 C-N-CA 123.685 0.794 . . . . 0.0 111.312 176.611 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -51.53 -51.36 55.95 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 118.943 0.792 . . . . 0.0 110.411 172.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 93.1 mt -63.67 -40.79 97.71 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 118.532 -0.747 . . . . 0.0 112.819 177.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -67.18 -32.69 73.95 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 120.327 1.421 . . . . 0.0 112.426 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 65.3 mmtt -71.23 -53.4 14.49 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.952 0.901 . . . . 0.0 111.753 175.49 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.4 m -65.48 -25.15 36.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 CA-C-N 120.326 1.421 . . . . 0.0 112.222 179.662 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -64.42 -34.9 79.26 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 171.588 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -84.3 -13.28 52.9 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.475 1.11 . . . . 0.0 113.087 173.532 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 48.0 ttp -61.62 141.97 94.6 Favored Pre-proline 0 CA--C 1.543 0.704 0 CA-C-N 119.262 0.937 . . . . 0.0 110.564 172.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -60.53 152.2 69.87 Favored 'Trans proline' 0 CA--C 1.538 0.705 0 C-N-CA 122.716 2.277 . . . . 0.0 111.205 172.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -88.8 -21.17 23.9 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 121.777 -0.577 . . . . 0.0 112.388 172.23 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -84.75 167.16 16.37 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.835 1.254 . . . . 0.0 112.396 172.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -137.13 146.76 45.42 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.76 1.224 . . . . 0.0 111.175 -176.848 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 8.2 p -144.16 145.18 21.99 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 C-N-CA 124.899 1.279 . . . . 0.0 110.437 176.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -69.38 137.92 53.23 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.429 0.692 . . . . 0.0 111.246 173.12 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 83.4 mt -78.46 173.65 12.14 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 113.886 1.069 . . . . 0.0 113.886 -175.666 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 98.3 mt -119.68 153.99 54.61 Favored Pre-proline 0 CA--C 1.547 0.831 0 C-N-CA 126.479 1.912 . . . . 0.0 110.615 177.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -71.69 155.39 58.79 Favored 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 122.975 2.45 . . . . 0.0 112.661 -176.349 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -71.8 158.6 52.71 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 123.43 2.753 . . . . 0.0 112.322 177.361 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -70.96 152.05 95.0 Favored Pre-proline 0 CA--C 1.553 1.072 0 C-N-CA 123.978 0.911 . . . . 0.0 112.709 176.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -75.68 -176.71 3.13 Favored 'Trans proline' 0 CA--C 1.546 1.103 0 C-N-CA 123.861 3.041 . . . . 0.0 112.018 171.09 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 63.6 tttm -47.99 -44.26 30.51 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 126.114 1.766 . . . . 0.0 114.547 -178.143 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . 167.61 31.13 0.02 OUTLIER Glycine 0 CA--C 1.538 1.472 0 N-CA-C 115.338 0.895 . . . . 0.0 115.338 -179.335 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 4.4 mptp? . . . . . 0 C--O 1.252 1.205 0 C-N-CA 125.237 1.415 . . . . 0.0 112.149 -178.994 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.456 0 N-CA-C 111.763 -0.535 . . . . 0.0 111.763 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 42.2 p -67.83 -19.54 65.07 Favored 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 114.735 1.383 . . . . 0.0 114.735 179.495 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 78.8 p -154.17 169.82 22.68 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 126.0 1.72 . . . . 0.0 111.863 178.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -167.48 26.98 0.15 Allowed Glycine 0 CA--C 1.536 1.402 0 C-N-CA 123.996 0.808 . . . . 0.0 114.783 -178.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 12.5 t -60.97 152.92 26.46 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.458 1.103 . . . . 0.0 112.976 -177.025 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.1 m -161.0 153.44 20.46 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.826 1.25 . . . . 0.0 112.716 174.174 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -177.31 -31.24 0.05 OUTLIER Glycine 0 CA--C 1.538 1.485 0 C-N-CA 125.973 1.749 . . . . 0.0 112.957 174.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.57 166.98 22.74 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 126.182 1.793 . . . . 0.0 112.352 168.023 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 19.6 m -136.28 -6.71 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.294 0 C-N-CA 124.943 1.297 . . . . 0.0 113.811 -177.204 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.3 t -149.09 144.86 26.94 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 125.252 1.421 . . . . 0.0 110.877 179.509 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -90.71 152.47 44.9 Favored Pre-proline 0 CA--C 1.55 0.964 0 N-CA-C 113.234 0.828 . . . . 0.0 113.234 -171.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -83.19 -29.46 1.18 Allowed 'Trans proline' 0 CA--C 1.542 0.917 0 C-N-CA 123.607 2.871 . . . . 0.0 113.303 173.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.5 t -158.24 -13.67 0.07 Allowed 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 115.484 1.661 . . . . 0.0 115.484 -172.519 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.3 mtpm? -58.9 152.99 46.27 Favored Pre-proline 0 N--CA 1.482 1.159 0 C-N-CA 124.389 1.076 . . . . 0.0 112.668 -178.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -67.82 144.14 63.95 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 121.99 1.793 . . . . 0.0 111.547 169.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 162.17 150.39 5.96 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 124.981 1.277 . . . . 0.0 113.251 174.811 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 8.0 ptm180 -164.63 165.44 21.01 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.761 2.025 . . . . 0.0 110.87 175.232 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 30.7 tttp -61.83 132.23 52.4 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.143 1.377 . . . . 0.0 110.938 173.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 48.9 p -139.38 165.04 28.26 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.967 1.707 . . . . 0.0 110.141 178.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 24.8 t30 -52.6 -32.49 41.69 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 175.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 63.4 mm-40 -60.68 -59.92 4.62 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.535 1.134 . . . . 0.0 111.616 169.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 94.5 mt -67.12 -32.21 73.2 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.215 1.006 . . . . 0.0 112.911 -177.297 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 -58.8 -51.34 70.42 Favored 'General case' 0 C--O 1.225 -0.225 0 C-N-CA 124.362 1.065 . . . . 0.0 110.223 170.031 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 49.8 t80 -58.07 -39.34 78.27 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 118.909 0.777 . . . . 0.0 112.347 178.366 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 89.0 mmm -57.08 -55.04 39.89 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 121.662 -0.649 . . . . 0.0 112.266 172.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -82.32 -4.44 57.23 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 115.108 1.521 . . . . 0.0 115.108 -175.2 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -117.21 -19.64 9.56 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.247 1.419 . . . . 0.0 112.778 -174.041 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.6 t -133.47 -52.72 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 CA-C-O 118.757 -0.64 . . . . 0.0 112.266 179.202 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.8 t -69.08 -67.71 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 CA-C-N 118.794 0.724 . . . . 0.0 110.848 -172.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 99.3 t -57.07 -46.11 84.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.928 1.291 . . . . 0.0 109.743 171.587 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 40.3 tptt -58.77 -22.22 57.56 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 114.301 1.222 . . . . 0.0 114.301 -176.233 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 34.2 m -99.43 -41.09 7.56 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.196 0.998 . . . . 0.0 113.151 172.717 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 62.3 mt -60.05 -28.95 68.2 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.257 0.935 . . . . 0.0 112.682 173.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 36.0 t-105 -79.04 -33.85 44.38 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 127.123 2.169 . . . . 0.0 113.843 178.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 61.2 pttt -86.56 -5.18 59.21 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 175.682 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 57.4 t-80 -54.28 152.53 6.19 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.507 1.923 . . . . 0.0 113.473 174.526 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 22.7 tp60 -56.83 -21.13 26.66 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 126.029 1.732 . . . . 0.0 114.676 176.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -124.35 19.66 8.91 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.409 1.484 . . . . 0.0 113.916 -175.068 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -74.0 -24.69 59.62 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 114.106 1.151 . . . . 0.0 114.106 175.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . 0.41 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 49.4 p-90 -57.17 -36.4 46.1 Favored Pre-proline 0 CA--C 1.548 0.876 0 N-CA-C 117.206 2.299 . . . . 0.0 117.206 -173.508 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.41 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 85.0 Cg_endo -74.82 0.02 9.33 Favored 'Trans proline' 0 CA--C 1.545 1.039 0 CA-C-N 123.013 2.112 . . . . 0.0 113.934 171.514 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -117.98 6.19 12.15 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.96 1.704 . . . . 0.0 113.321 -178.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 23.3 m-30 -72.31 -14.22 61.69 Favored 'General case' 0 CA--C 1.545 0.758 0 O-C-N 120.28 -1.512 . . . . 0.0 114.059 176.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 89.1 mt-30 -151.57 145.99 18.41 Favored Pre-proline 0 CA--C 1.544 0.724 0 C-N-CA 125.233 1.413 . . . . 0.0 110.536 -177.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -65.36 151.65 84.49 Favored 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 123.383 2.722 . . . . 0.0 112.765 -178.218 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 41.6 t -64.17 135.79 27.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 124.737 1.215 . . . . 0.0 111.071 -178.703 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 52.8 m-20 -112.71 92.41 4.01 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.925 1.29 . . . . 0.0 110.163 175.33 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.57 -27.42 38.79 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.286 1.034 . . . . 0.0 113.682 175.651 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 81.8 mt -65.71 -49.6 76.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 C-N-CA 125.392 1.477 . . . . 0.0 111.104 173.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -65.99 -38.92 89.73 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.48 1.112 . . . . 0.0 112.589 179.21 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 90.3 mt -87.35 -3.6 59.03 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.893 1.677 . . . . 0.0 113.518 -177.268 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 51.14 56.55 7.81 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 125.584 1.554 . . . . 0.0 113.01 -176.424 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 58.0 mt -113.87 78.36 4.05 Favored Pre-proline 0 CA--C 1.543 0.7 0 C-N-CA 126.157 1.783 . . . . 0.0 110.651 -179.811 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -66.28 -17.2 53.87 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 123.323 2.682 . . . . 0.0 113.101 -177.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 -100.35 7.13 44.52 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.884 1.674 . . . . 0.0 113.184 175.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 85.8 t80 -52.28 -57.62 9.16 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 120.015 1.28 . . . . 0.0 112.117 -177.474 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -74.81 -11.65 60.2 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.888 1.275 . . . . 0.0 114.33 179.606 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 10.1 mptt -72.7 -32.54 65.83 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 121.263 -0.898 . . . . 0.0 111.296 176.349 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.2 mp -99.07 -48.71 11.86 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 125.439 1.496 . . . . 0.0 111.088 175.003 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 28.0 mm -67.18 110.95 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 C-N-CA 123.66 0.784 . . . . 0.0 110.082 178.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -68.25 -44.87 74.65 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.972 0.909 . . . . 0.0 112.113 -178.441 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 71.5 m-80 -150.22 117.83 3.56 Favored Pre-proline 0 CA--C 1.546 0.789 0 C-N-CA 126.5 1.92 . . . . 0.0 109.075 173.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -74.24 146.95 36.76 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 123.116 2.544 . . . . 0.0 111.478 177.346 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.0 tpt -156.25 146.68 21.63 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.984 1.314 . . . . 0.0 110.52 176.678 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -152.11 153.22 33.48 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.258 1.423 . . . . 0.0 112.099 -171.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 2.7 ttp -64.74 -38.3 90.53 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.197 0.599 . . . . 0.0 112.456 -175.426 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -59.26 -34.09 78.49 Favored Glycine 0 CA--C 1.53 1.02 0 C-N-CA 124.63 1.11 . . . . 0.0 113.056 173.552 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 24.2 m -76.23 -47.17 24.91 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 117.868 0.834 . . . . 0.0 111.278 172.056 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 86.7 mt -52.66 -53.14 21.98 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.197 0 C-N-CA 124.568 1.147 . . . . 0.0 111.247 178.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.37 -30.42 71.24 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -178.964 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.02 -40.0 94.21 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 117.712 -1.137 . . . . 0.0 113.413 171.012 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . 0.275 6.4 ptp180 -72.68 -30.03 63.9 Favored 'General case' 0 N--CA 1.484 1.24 0 CA-C-N 120.544 1.52 . . . . 0.0 114.135 172.712 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 86.9 mt -66.87 -36.14 81.63 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 119.763 1.165 . . . . 0.0 112.949 167.679 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 88.5 mt-10 -78.02 9.33 3.74 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.685 1.594 . . . . 0.0 113.704 178.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 38.8 m-80 -138.42 166.79 23.35 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 127.023 2.129 . . . . 0.0 111.788 179.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 13.9 p-10 -79.96 108.41 13.51 Favored 'General case' 0 CA--C 1.544 0.719 0 O-C-N 121.4 -0.813 . . . . 0.0 109.773 168.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 49.4 t80 -140.36 -46.26 0.42 Allowed 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -178.277 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -133.15 177.0 8.01 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.836 2.054 . . . . 0.0 111.625 178.427 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.3 t-105 -112.99 -21.86 10.89 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.898 1.279 . . . . 0.0 112.787 -177.598 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 28.2 t -138.07 142.95 40.27 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.046 -1.034 . . . . 0.0 112.337 -172.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -68.89 -13.55 62.49 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 115.316 1.599 . . . . 0.0 115.316 -173.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 23.2 m -55.45 -29.97 59.66 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 119.412 1.006 . . . . 0.0 112.775 173.873 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 40.0 mm-40 -72.5 -41.37 66.01 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.202 -0.936 . . . . 0.0 112.258 174.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 42.2 t -62.23 -38.24 88.45 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.025 0.93 . . . . 0.0 111.998 172.209 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 82.9 mtp -65.6 -40.67 92.92 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 124.124 0.969 . . . . 0.0 112.171 174.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 62.6 mt-30 -59.96 -44.5 94.39 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 122.895 0.478 . . . . 0.0 111.606 171.072 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -64.44 -38.56 91.46 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 118.797 0.726 . . . . 0.0 112.663 178.173 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -61.21 -45.04 96.22 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 121.265 -0.897 . . . . 0.0 112.357 170.002 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 33.2 t30 -59.22 -43.05 92.32 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 121.506 -0.747 . . . . 0.0 111.963 174.722 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 85.0 m -62.69 -39.51 94.21 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.192 0.997 . . . . 0.0 112.414 174.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 12.9 ttm -58.2 -60.88 3.07 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 119.485 1.039 . . . . 0.0 111.272 174.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -61.01 -41.0 95.68 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.035 0.534 . . . . 0.0 111.966 -177.506 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 77.3 m -64.46 -47.93 77.18 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.294 0.638 . . . . 0.0 112.083 178.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -64.7 -31.93 73.38 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 119.493 1.042 . . . . 0.0 112.643 -178.687 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 40.8 m -59.91 -43.7 94.73 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.906 0.883 . . . . 0.0 112.516 169.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -68.9 -29.17 67.39 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 179.106 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 86.1 mt -72.25 -57.47 7.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 123.256 0.622 . . . . 0.0 110.906 178.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -71.62 -35.03 70.32 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -171.221 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 59.5 m-80 -95.99 162.65 13.47 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.456 1.103 . . . . 0.0 111.733 -178.651 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -73.45 152.07 89.74 Favored Pre-proline 0 N--CA 1.474 0.764 0 O-C-N 121.261 -0.9 . . . . 0.0 110.426 170.545 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -65.87 -1.67 5.45 Favored 'Trans proline' 0 CA--C 1.544 1.019 0 C-N-CA 123.569 2.846 . . . . 0.0 114.922 -178.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 65.0 p -118.06 -0.62 11.58 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.703 2.001 . . . . 0.0 113.063 -179.609 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 58.5 m-20 -68.48 144.98 54.45 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 118.719 0.69 . . . . 0.0 110.709 170.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -55.87 -45.77 78.43 Favored 'General case' 0 N--CA 1.471 0.625 0 O-C-N 121.682 -0.636 . . . . 0.0 112.504 -175.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.5 tp -55.32 -30.4 25.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 124.918 1.287 . . . . 0.0 114.058 177.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 48.3 t -73.31 -46.56 49.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 O-C-N 121.427 -0.796 . . . . 0.0 110.582 174.06 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 72.4 mt -61.39 -37.15 82.39 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 119.103 0.865 . . . . 0.0 111.523 177.008 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 8.9 mtt -59.63 -51.21 70.77 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.963 1.305 . . . . 0.0 112.04 169.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.97 -38.75 87.03 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.387 0.675 . . . . 0.0 112.701 176.425 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 90.0 mt-30 -62.5 -45.51 92.69 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 119.329 0.968 . . . . 0.0 112.094 173.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.25 -44.28 96.91 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.543 0.737 . . . . 0.0 112.473 177.045 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 85.2 mt -65.4 -45.67 83.06 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.913 0.885 . . . . 0.0 112.042 174.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.94 -37.68 88.02 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.138 -0.976 . . . . 0.0 113.075 -176.502 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 55.7 mtmt -58.85 -46.16 88.37 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 121.744 -0.598 . . . . 0.0 111.727 172.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 89.6 mt -67.6 -43.9 86.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 123.429 0.692 . . . . 0.0 110.702 178.142 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 34.0 t80 -50.57 -51.09 51.42 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.851 0.861 . . . . 0.0 111.095 174.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 99.6 mt -64.0 -40.26 95.96 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 178.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 82.8 mm-40 -62.64 -37.25 85.6 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 119.42 1.009 . . . . 0.0 113.004 173.576 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 33.2 mmtm -70.99 -52.66 18.35 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.111 1.364 . . . . 0.0 111.47 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.5 m -67.44 -25.16 32.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 CA-C-N 119.603 1.092 . . . . 0.0 112.366 178.395 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -62.22 -30.4 71.06 Favored 'General case' 0 CA--C 1.54 0.582 0 O-C-N 121.573 -0.705 . . . . 0.0 112.703 172.043 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -88.77 -9.16 52.86 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.478 1.111 . . . . 0.0 112.844 174.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 40.1 ttp -67.26 145.2 98.55 Favored Pre-proline 0 CA--C 1.545 0.786 0 C-N-CA 124.074 0.95 . . . . 0.0 110.347 170.033 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -60.13 156.75 38.0 Favored 'Trans proline' 0 CA--C 1.539 0.737 0 C-N-CA 123.23 2.62 . . . . 0.0 111.63 170.159 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.25 -26.74 19.91 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.503 0.721 . . . . 0.0 112.893 172.152 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -85.7 170.38 12.56 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 126.254 1.822 . . . . 0.0 111.333 171.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -132.57 171.72 13.45 Favored 'General case' 0 CA--C 1.533 0.304 0 O-C-N 120.683 -1.261 . . . . 0.0 112.294 173.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 15.0 p -152.2 142.74 15.5 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 C-N-CA 124.033 0.933 . . . . 0.0 110.656 174.05 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -64.88 136.88 57.36 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.701 1.6 . . . . 0.0 111.686 173.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 59.8 mt -99.65 161.36 13.66 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.069 0.947 . . . . 0.0 113.327 -174.054 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 99.3 mt -63.0 156.24 68.54 Favored Pre-proline 0 CA--C 1.55 0.981 0 C-N-CA 125.092 1.357 . . . . 0.0 112.133 169.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -71.62 158.78 52.79 Favored 'Trans proline' 0 CA--C 1.546 1.124 0 C-N-CA 123.082 2.521 . . . . 0.0 112.153 176.196 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -71.18 159.68 51.33 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 123.297 2.664 . . . . 0.0 112.619 178.054 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -66.43 153.79 92.17 Favored Pre-proline 0 CA--C 1.552 1.03 0 C-N-CA 124.205 1.002 . . . . 0.0 112.473 174.467 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.44 114.03 3.33 Favored 'Trans proline' 0 CA--C 1.539 0.75 0 C-N-CA 123.413 2.742 . . . . 0.0 110.775 173.27 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -142.79 174.11 10.95 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 126.197 1.799 . . . . 0.0 111.952 -170.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . -157.06 -168.94 20.36 Favored Glycine 0 CA--C 1.536 1.35 0 C-N-CA 125.522 1.534 . . . . 0.0 113.375 -178.658 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 36.7 mtmm . . . . . 0 C--O 1.254 1.332 0 C-N-CA 125.89 1.676 . . . . 0.0 113.501 179.955 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.485 0 N-CA-C 111.808 -0.517 . . . . 0.0 111.808 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 59.8 p -75.88 -15.14 60.25 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 115.24 1.57 . . . . 0.0 115.24 -177.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.4 t -63.68 144.35 57.09 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.247 1.019 . . . . 0.0 112.506 177.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 179.97 32.76 0.06 OUTLIER Glycine 0 CA--C 1.536 1.363 0 N-CA-C 114.983 0.753 . . . . 0.0 114.983 -176.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 22.4 p -63.66 -46.88 83.59 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.305 1.042 . . . . 0.0 113.07 179.232 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.9 p -64.29 148.91 49.18 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 125.481 1.513 . . . . 0.0 113.759 -178.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -102.76 -174.56 26.86 Favored Glycine 0 CA--C 1.535 1.334 0 C-N-CA 124.897 1.237 . . . . 0.0 114.199 179.555 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -132.99 172.63 12.37 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 126.33 1.852 . . . . 0.0 112.902 -170.518 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 20.5 m -131.74 7.79 1.75 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 C-N-CA 124.66 1.184 . . . . 0.0 113.461 -176.55 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 11.7 t -148.11 166.71 27.01 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 127.526 2.33 . . . . 0.0 110.085 175.168 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -142.46 149.37 50.77 Favored Pre-proline 0 CA--C 1.545 0.76 0 C-N-CA 124.423 1.089 . . . . 0.0 113.417 -172.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -74.01 -32.19 7.27 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.34 2.694 . . . . 0.0 113.567 177.447 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 7.7 t -156.18 -5.09 0.12 Allowed 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 116.566 2.061 . . . . 0.0 116.566 -175.536 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 34.9 ttpt -63.98 131.35 94.93 Favored Pre-proline 0 N--CA 1.481 1.098 0 CA-C-N 120.72 1.6 . . . . 0.0 110.761 179.545 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -71.93 156.34 56.51 Favored 'Trans proline' 0 CA--C 1.54 0.778 0 C-N-CA 122.658 2.239 . . . . 0.0 112.631 -178.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -178.29 160.65 26.9 Favored Glycine 0 CA--C 1.532 1.119 0 C-N-CA 124.255 0.931 . . . . 0.0 113.59 176.317 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 32.3 ptt180 -163.23 159.55 22.94 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 126.739 2.016 . . . . 0.0 110.721 172.717 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.2 tttm -71.11 137.25 48.72 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.192 0.997 . . . . 0.0 111.244 174.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 76.0 p -144.44 167.24 22.96 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 125.817 1.647 . . . . 0.0 110.922 -175.319 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 25.5 p-10 -51.13 -36.01 38.53 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 113.51 0.929 . . . . 0.0 113.51 169.359 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.5 mm100 -64.67 -54.09 37.24 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.269 1.028 . . . . 0.0 110.762 178.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.1 mt -66.97 -34.36 77.59 Favored 'General case' 0 CA--C 1.537 0.442 0 N-CA-C 112.524 0.564 . . . . 0.0 112.524 178.647 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.1 tp60 -57.55 -53.86 53.42 Favored 'General case' 0 C--O 1.222 -0.354 0 C-N-CA 123.036 0.534 . . . . 0.0 110.498 169.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 60.5 t80 -56.58 -41.89 77.72 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.348 0.976 . . . . 0.0 112.626 179.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 94.8 mmm -57.62 -51.24 70.32 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.69 -0.631 . . . . 0.0 112.184 172.421 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -85.32 -5.29 59.32 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 -173.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 60.0 t30 -124.72 -14.48 6.75 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.764 1.626 . . . . 0.0 113.294 -171.549 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 21.4 t -133.15 -52.8 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 C-N-CA 123.192 0.597 . . . . 0.0 111.058 177.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.4 t -68.95 -65.63 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 123.34 0.656 . . . . 0.0 110.696 -174.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 89.9 t -57.8 -46.7 87.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 C-N-CA 124.093 0.957 . . . . 0.0 110.322 173.24 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 69.7 tttt -58.62 -39.19 79.8 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.357 0.663 . . . . 0.0 112.552 -174.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 40.9 m -78.03 -43.56 29.05 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 118.461 0.573 . . . . 0.0 112.212 175.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 62.8 mt -61.6 -33.32 73.69 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 118.821 0.737 . . . . 0.0 112.411 177.67 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 30.9 t-105 -71.27 -31.44 67.51 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.701 1.6 . . . . 0.0 113.346 176.12 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.7 mtmp? -80.49 -7.42 59.17 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 175.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 53.0 t-80 -63.56 152.94 37.28 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.701 1.2 . . . . 0.0 112.981 -179.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 99.9 mm-40 -61.54 -19.63 62.35 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.072 1.349 . . . . 0.0 114.394 177.299 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -117.85 13.06 14.0 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.34 1.456 . . . . 0.0 113.706 -176.289 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.14 -25.93 64.63 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.815 1.246 . . . . 0.0 114.12 177.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 69.2 p-90 -56.5 -35.49 35.77 Favored Pre-proline 0 CA--C 1.547 0.865 0 N-CA-C 118.113 2.635 . . . . 0.0 118.113 -169.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -78.71 -6.94 15.54 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 CA-C-N 123.33 2.225 . . . . 0.0 112.985 176.565 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 57.7 m-85 -103.09 -7.67 21.15 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.307 1.443 . . . . 0.0 112.382 179.311 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 20.3 m-30 -62.42 -17.61 59.67 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 114.559 1.318 . . . . 0.0 114.559 179.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 89.5 mt-30 -139.7 150.88 64.63 Favored Pre-proline 0 CA--C 1.544 0.727 0 C-N-CA 124.947 1.299 . . . . 0.0 111.127 -179.088 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -70.67 143.89 47.66 Favored 'Trans proline' 0 CA--C 1.537 0.645 0 C-N-CA 123.151 2.567 . . . . 0.0 112.672 178.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 63.8 t -64.64 145.32 13.99 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 C-N-CA 124.309 1.043 . . . . 0.0 110.56 169.152 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -130.04 109.51 10.91 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.315 1.446 . . . . 0.0 110.116 173.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.32 -29.12 60.86 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.478 1.111 . . . . 0.0 113.645 179.082 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 84.4 mt -66.33 -48.87 79.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 125.227 1.411 . . . . 0.0 110.882 174.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 45.9 mmtm -68.46 -39.16 81.54 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.767 1.227 . . . . 0.0 113.126 -178.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.5 mp -87.89 -3.97 58.88 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.611 1.164 . . . . 0.0 112.774 179.482 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 52.29 58.15 5.7 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 126.083 1.753 . . . . 0.0 113.243 -177.007 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 44.7 mt -115.63 82.67 10.33 Favored Pre-proline 0 CA--C 1.544 0.749 0 C-N-CA 126.135 1.774 . . . . 0.0 110.512 -177.157 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -67.04 -8.31 21.37 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 123.911 3.074 . . . . 0.0 114.108 -173.419 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 24.9 p-10 -116.02 2.58 13.48 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 127.566 2.346 . . . . 0.0 113.737 179.24 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 58.7 t80 -49.65 -50.68 42.28 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 119.933 1.242 . . . . 0.0 113.199 -175.167 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 99.7 m-70 -76.39 -18.47 58.85 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.878 1.271 . . . . 0.0 114.115 -178.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 10.7 mmpt? -69.7 -45.13 68.94 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.071 0.948 . . . . 0.0 110.563 174.654 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.6 mp -72.37 -51.71 27.83 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 C-N-CA 123.44 0.696 . . . . 0.0 109.929 171.241 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 37.7 mm -99.54 103.66 15.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 CA-C-O 122.586 1.184 . . . . 0.0 112.156 -171.774 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 40.3 mmtm -65.47 -32.91 74.78 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.318 1.447 . . . . 0.0 113.146 175.689 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -137.01 76.77 44.87 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 125.217 1.407 . . . . 0.0 111.561 -170.03 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -70.78 128.51 15.19 Favored 'Trans proline' 0 CA--C 1.537 0.658 0 C-N-CA 124.102 3.202 . . . . 0.0 111.052 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 17.7 tpp -155.41 140.99 17.9 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.078 1.751 . . . . 0.0 109.455 -173.461 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -141.26 148.34 39.68 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 127.561 2.344 . . . . 0.0 109.161 172.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 13.0 ttp -49.45 -33.11 13.34 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 115.341 1.608 . . . . 0.0 115.341 -170.077 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -57.49 -20.07 36.49 Favored Glycine 0 CA--C 1.538 1.502 0 C-N-CA 125.382 1.468 . . . . 0.0 115.271 173.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 28.7 m -85.58 -40.13 16.6 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.51 1.124 . . . . 0.0 111.694 172.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 34.5 mt -56.39 -49.5 76.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 C-N-CA 124.431 1.092 . . . . 0.0 110.945 -177.472 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -58.32 -33.74 69.82 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 178.352 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -70.73 -45.6 64.56 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.415 1.086 . . . . 0.0 112.214 -178.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 3.8 ptp180 -69.47 -26.87 64.79 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 113.76 1.022 . . . . 0.0 113.76 172.121 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 45.7 mt -68.97 -42.47 76.56 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 119.339 0.972 . . . . 0.0 113.344 168.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -71.73 -36.37 70.45 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.666 0.786 . . . . 0.0 112.83 178.231 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 -74.17 167.62 21.21 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.004 0.922 . . . . 0.0 111.43 169.251 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 61.3 t-20 -89.6 96.51 10.73 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 121.064 -1.022 . . . . 0.0 109.139 168.074 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 57.8 t80 -123.6 -25.61 4.32 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.317 1.047 . . . . 0.0 113.74 -178.313 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -145.61 179.97 7.07 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.737 1.215 . . . . 0.0 113.565 175.814 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 2.3 t-105 -113.0 -27.5 8.04 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 126.057 1.743 . . . . 0.0 112.361 -177.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 21.0 p -135.9 137.0 40.95 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 125.164 1.386 . . . . 0.0 112.688 -168.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -58.27 -19.88 37.86 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 115.588 1.699 . . . . 0.0 115.588 -178.308 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 11.1 m -56.2 -34.43 66.26 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 119.466 1.03 . . . . 0.0 113.173 176.305 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -67.0 -44.03 81.39 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.508 0.671 . . . . 0.0 111.437 173.447 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 1.9 m -66.53 -33.39 75.57 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 126.046 1.738 . . . . 0.0 112.279 178.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 76.0 mtp -68.25 -43.58 77.53 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 125.138 1.375 . . . . 0.0 112.376 172.209 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -63.49 -30.8 71.87 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 118.02 0.373 . . . . 0.0 111.704 176.206 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 93.2 m-20 -68.36 -44.04 76.11 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.727 0.811 . . . . 0.0 112.116 173.212 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -60.54 -45.1 95.11 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 118.936 0.789 . . . . 0.0 112.528 171.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 16.8 t30 -56.33 -45.98 80.09 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.241 0.617 . . . . 0.0 111.402 172.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 71.6 m -63.33 -33.36 75.37 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.462 1.105 . . . . 0.0 112.581 176.428 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 12.1 tmm? -68.99 -55.44 10.87 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 124.59 1.156 . . . . 0.0 111.906 -177.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 29.6 m-85 -62.58 -39.13 92.74 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.392 0.677 . . . . 0.0 112.423 173.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 97.0 m -66.08 -47.19 75.07 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 121.427 -0.796 . . . . 0.0 112.287 -179.662 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -62.98 -30.71 71.8 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 119.891 1.223 . . . . 0.0 112.479 179.473 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 92.1 m -63.45 -43.5 97.21 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.059 0.944 . . . . 0.0 112.54 170.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 15.2 m-30 -65.18 -35.76 82.1 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 175.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 77.6 mt -70.27 -56.83 9.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 C-N-CA 123.214 0.606 . . . . 0.0 110.923 -178.504 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.3 t80 -69.28 -32.5 71.71 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 114.087 1.143 . . . . 0.0 114.087 -172.198 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 60.2 m-80 -101.39 164.76 11.61 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.232 1.013 . . . . 0.0 112.546 -174.235 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -67.07 140.88 96.13 Favored Pre-proline 0 N--CA 1.472 0.659 0 C-N-CA 123.816 0.846 . . . . 0.0 109.831 173.538 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -67.48 -5.32 13.78 Favored 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 123.669 2.912 . . . . 0.0 114.634 -174.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 51.7 p -116.6 -0.29 12.45 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.573 1.949 . . . . 0.0 113.187 179.69 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -67.08 151.7 47.13 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 121.601 -0.687 . . . . 0.0 111.222 172.59 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -50.45 -49.88 53.78 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.499 0.719 . . . . 0.0 112.257 178.472 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.5 tp -56.55 -33.18 38.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 -176.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 54.6 t -71.25 -49.3 49.14 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 CA-C-O 118.868 -0.586 . . . . 0.0 110.583 173.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 76.0 mt -61.47 -37.06 82.24 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.499 1.045 . . . . 0.0 112.115 178.659 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 32.0 mtp -61.97 -48.57 79.77 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 126.027 1.731 . . . . 0.0 111.543 172.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.6 -39.72 92.23 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 173.319 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -63.66 -38.7 92.11 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 119.37 0.986 . . . . 0.0 112.696 175.273 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -66.4 -46.32 76.98 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.629 0.772 . . . . 0.0 111.874 175.311 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 86.6 mt -63.73 -44.43 93.58 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.186 0.994 . . . . 0.0 112.308 175.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -65.18 -37.06 86.17 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.045 -1.035 . . . . 0.0 113.056 -175.655 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 36.1 mtmm -61.0 -41.94 97.48 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 121.341 -0.85 . . . . 0.0 111.719 172.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 81.4 mt -65.62 -45.55 91.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 CA-C-O 118.785 -0.626 . . . . 0.0 110.464 174.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 34.1 t80 -50.2 -51.08 47.0 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 119.226 0.921 . . . . 0.0 111.427 174.385 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.4 mt -63.19 -42.24 99.31 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 121.652 -0.655 . . . . 0.0 112.643 179.075 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 93.3 mm-40 -61.56 -36.12 79.73 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 119.341 0.973 . . . . 0.0 113.022 174.086 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 34.5 mmtm -70.98 -53.57 14.38 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.99 1.316 . . . . 0.0 111.409 179.435 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 4.7 m -68.92 -25.54 30.41 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 CA-C-N 119.654 1.115 . . . . 0.0 112.647 179.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -59.14 -28.37 66.51 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 173.06 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -93.52 -4.96 50.14 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.943 1.297 . . . . 0.0 112.569 177.603 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 38.8 ttp -67.2 139.16 94.87 Favored Pre-proline 0 CA--C 1.548 0.901 0 C-N-CA 124.028 0.931 . . . . 0.0 110.532 171.577 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -64.91 156.08 64.26 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 123.045 2.497 . . . . 0.0 112.269 175.609 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 62.2 mm-40 -85.37 -16.04 41.2 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.98 0.912 . . . . 0.0 113.172 177.489 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 13.6 mp0 -103.82 146.56 28.46 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.587 1.155 . . . . 0.0 113.097 -175.673 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.43 146.09 27.14 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.305 1.042 . . . . 0.0 111.715 174.056 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 82.4 t -141.46 125.47 16.58 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 C-N-CA 127.338 2.255 . . . . 0.0 108.71 174.071 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -65.61 125.07 24.09 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.84 1.656 . . . . 0.0 111.329 169.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 90.6 mt -78.17 159.98 28.26 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.485 0.714 . . . . 0.0 112.75 177.719 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 93.5 mt -65.69 154.61 88.24 Favored Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 123.892 0.877 . . . . 0.0 111.366 169.181 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -70.65 159.6 52.19 Favored 'Trans proline' 0 CA--C 1.546 1.093 0 C-N-CA 122.973 2.448 . . . . 0.0 112.621 -179.299 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.46 170.7 15.62 Favored 'Trans proline' 0 CA--C 1.542 0.915 0 C-N-CA 123.631 2.887 . . . . 0.0 112.991 177.304 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -137.61 156.93 74.52 Favored Pre-proline 0 CA--C 1.549 0.913 0 C-N-CA 125.768 1.627 . . . . 0.0 111.211 -178.023 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -69.58 150.12 68.9 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 122.954 2.436 . . . . 0.0 112.733 -179.36 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 2.2 mppt? -95.03 80.06 3.61 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.497 1.519 . . . . 0.0 109.911 177.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . -66.38 -18.39 67.45 Favored Glycine 0 CA--C 1.539 1.584 0 C-N-CA 124.649 1.119 . . . . 0.0 115.106 -179.271 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 22.7 ptmt . . . . . 0 C--O 1.251 1.157 0 C-N-CA 126.86 2.064 . . . . 0.0 112.316 175.332 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.896 0 N-CA-C 114.715 0.646 . . . . 0.0 114.715 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 19.7 ptt180 -161.42 166.49 27.22 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 126.901 2.08 . . . . 0.0 110.678 175.626 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.486 ' HG3' HD12 ' A' ' 147' ' ' LEU . 0.2 OUTLIER -71.42 117.33 12.82 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.378 1.471 . . . . 0.0 111.882 -177.014 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 69.4 p -126.99 163.21 24.21 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.667 1.187 . . . . 0.0 112.089 -179.252 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -56.54 -35.41 68.09 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.302 1.441 . . . . 0.0 113.636 174.496 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -67.38 -50.21 60.69 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 122.874 0.47 . . . . 0.0 111.255 177.719 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 89.3 mt -62.05 -35.77 79.64 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.443 -0.786 . . . . 0.0 112.178 173.197 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 19.1 tp60 -58.75 -49.17 78.62 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 119.012 -0.518 . . . . 0.0 111.201 173.828 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 55.4 t80 -58.28 -42.57 86.86 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 119.437 1.017 . . . . 0.0 112.402 177.664 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 97.0 mmm -55.82 -51.42 67.54 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.128 0.571 . . . . 0.0 112.142 173.779 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.418 ' HB3' HD13 ' A' ' 90' ' ' LEU . 9.5 pt20 -83.46 -12.68 56.07 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 114.971 1.471 . . . . 0.0 114.971 -175.506 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 59.0 t30 -107.4 -22.77 12.45 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.545 1.138 . . . . 0.0 112.869 -172.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 13.5 t -129.69 -49.69 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 C-N-CA 123.361 0.664 . . . . 0.0 112.081 -179.103 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.5 t -69.6 -64.16 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 CA-C-N 118.694 0.679 . . . . 0.0 110.586 -173.919 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 73.3 t -57.04 -45.08 83.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.675 0 C-N-CA 124.703 1.201 . . . . 0.0 110.259 172.779 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.3 tppp? -53.15 -47.34 68.84 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.179 0.991 . . . . 0.0 112.066 -179.472 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 32.6 m -76.68 -40.95 47.3 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -179.4 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 59.6 mt -63.25 -33.4 75.41 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.264 0.626 . . . . 0.0 112.329 176.328 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 22.3 t-105 -73.2 -31.06 63.96 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.56 1.544 . . . . 0.0 113.274 174.869 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 54.8 mtmt -77.65 -9.52 59.02 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 174.501 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 47.0 t-80 -63.29 149.38 45.79 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.746 1.218 . . . . 0.0 113.221 -179.139 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 17.1 pt20 -61.31 -12.53 14.06 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 115.265 1.58 . . . . 0.0 115.265 176.607 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 20.2 m-85 -124.22 17.04 9.13 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.96 1.704 . . . . 0.0 113.645 -179.341 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.51 -27.81 65.51 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 114.168 1.173 . . . . 0.0 114.168 176.777 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 41.5 p-90 -56.62 -37.78 61.37 Favored Pre-proline 0 CA--C 1.547 0.831 0 N-CA-C 118.096 2.628 . . . . 0.0 118.096 -169.58 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -75.17 -5.81 17.16 Favored 'Trans proline' 0 CA--C 1.544 0.988 0 CA-C-N 123.221 2.186 . . . . 0.0 113.623 174.859 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -106.49 -5.61 18.74 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.432 1.493 . . . . 0.0 112.877 178.514 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -61.24 -18.07 56.52 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 114.392 1.256 . . . . 0.0 114.392 178.214 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -143.48 155.98 60.46 Favored Pre-proline 0 CA--C 1.545 0.755 0 C-N-CA 125.868 1.667 . . . . 0.0 110.677 -175.718 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -65.67 151.32 84.92 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 122.752 2.302 . . . . 0.0 111.912 171.61 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 60.8 t -66.78 104.67 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 124.051 0.94 . . . . 0.0 110.773 176.3 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 -74.88 85.59 2.23 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.202 1.001 . . . . 0.0 110.089 169.501 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -51.84 -25.91 8.82 Favored 'General case' 0 CA--C 1.548 0.904 0 N-CA-C 114.053 1.131 . . . . 0.0 114.053 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 81.7 mt -64.17 -49.9 79.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 C-N-CA 125.618 1.567 . . . . 0.0 111.436 171.488 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -73.88 -40.52 63.15 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 125.239 1.416 . . . . 0.0 112.87 -178.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -74.29 -10.71 59.86 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.928 1.291 . . . . 0.0 113.132 174.917 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 68.3 m-20 56.11 56.53 5.8 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.48 1.912 . . . . 0.0 112.503 -179.283 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 46.6 mt -115.67 80.51 8.39 Favored Pre-proline 0 CA--C 1.545 0.77 0 C-N-CA 126.318 1.847 . . . . 0.0 110.35 -177.734 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -68.1 -6.26 16.77 Favored 'Trans proline' 0 CA--C 1.543 0.937 0 C-N-CA 123.977 3.118 . . . . 0.0 114.361 -174.195 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 29.4 m-20 -122.29 12.44 10.2 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.06 1.744 . . . . 0.0 112.53 178.526 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 80.0 t80 -48.5 -55.44 11.01 Favored 'General case' 0 N--CA 1.476 0.859 0 O-C-N 120.915 -1.116 . . . . 0.0 113.319 -175.258 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -73.95 -12.17 60.57 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.825 1.25 . . . . 0.0 114.353 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.61 -34.69 67.54 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 121.123 -0.986 . . . . 0.0 111.807 174.072 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.4 mp -92.28 -47.42 14.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 124.68 1.192 . . . . 0.0 110.906 174.68 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.556 HD11 ' HB2' ' A' ' 115' ' ' TYR . 38.6 mm -76.99 110.51 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 123.511 0.724 . . . . 0.0 111.335 -177.981 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -71.31 -35.87 71.41 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.805 1.242 . . . . 0.0 112.836 174.747 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 13.2 p30 -147.69 83.14 7.66 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 125.534 1.534 . . . . 0.0 111.721 -168.983 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -69.37 131.66 22.27 Favored 'Trans proline' 0 CA--C 1.535 0.566 0 C-N-CA 123.467 2.778 . . . . 0.0 110.919 -177.763 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 6.4 tpt -156.49 133.73 10.62 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.004 1.322 . . . . 0.0 110.28 -170.202 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -146.79 151.06 36.53 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.631 1.572 . . . . 0.0 111.22 -176.729 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.6 ttp -56.23 -36.78 68.86 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.462 1.505 . . . . 0.0 113.284 -170.298 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -58.94 -25.77 59.86 Favored Glycine 0 CA--C 1.533 1.188 0 C-N-CA 125.014 1.292 . . . . 0.0 114.77 174.505 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 39.8 m -92.96 -33.63 14.09 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.572 1.149 . . . . 0.0 111.634 175.133 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 44.7 mt -56.78 -50.84 73.32 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 CA-C-N 119.196 0.907 . . . . 0.0 110.497 174.553 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -62.07 -33.06 73.7 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 177.185 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.431 ' HE3' ' HA ' ' A' ' 88' ' ' LYS . 0.6 OUTLIER -67.45 -27.73 67.29 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -176.501 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 5.1 ptp180 -84.06 -31.93 25.1 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 113.839 1.051 . . . . 0.0 113.839 169.583 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.418 HD13 ' HB3' ' A' ' 43' ' ' GLN . 87.4 mt -62.04 -33.71 74.87 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 119.541 1.064 . . . . 0.0 113.311 168.075 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -67.73 1.92 2.22 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 125.603 1.561 . . . . 0.0 113.805 172.463 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 57.8 m-80 -137.57 -169.78 2.6 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 128.494 2.718 . . . . 0.0 110.696 -177.285 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 75.1 m-80 -113.73 44.21 1.66 Allowed 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.537 1.535 . . . . 0.0 111.051 -178.507 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 41.2 t80 -64.4 -35.95 82.56 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.553 0.741 . . . . 0.0 111.92 -175.713 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -137.6 176.43 8.71 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 127.098 2.159 . . . . 0.0 111.842 -178.303 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 2.5 t-105 -108.89 -25.29 10.84 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.882 1.673 . . . . 0.0 112.283 -178.35 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 51.9 p -133.05 145.73 51.06 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.25 1.42 . . . . 0.0 113.678 -168.872 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -69.9 -19.66 63.4 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 115.229 1.566 . . . . 0.0 115.229 -175.245 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 18.0 m -56.24 -28.81 59.78 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.785 0.834 . . . . 0.0 113.067 174.662 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -71.98 -44.12 64.03 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.554 0.742 . . . . 0.0 112.299 174.569 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 42.5 t -61.16 -38.97 88.38 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.713 0.805 . . . . 0.0 111.797 172.32 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 83.5 mtp -61.42 -43.17 99.33 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 121.44 -0.787 . . . . 0.0 112.387 172.926 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . 0.253 2.4 pt20 -67.43 -30.4 70.13 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 175.763 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -68.03 -43.62 78.34 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.374 -0.829 . . . . 0.0 111.961 170.986 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -59.36 -45.44 91.41 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 121.202 -0.936 . . . . 0.0 112.312 172.277 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 18.6 t30 -56.83 -47.38 80.44 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 122.965 0.506 . . . . 0.0 111.67 172.561 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 74.6 m -61.05 -37.91 84.32 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.907 0.883 . . . . 0.0 112.508 178.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 51.9 ttp -59.99 -55.9 28.34 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 119.091 0.86 . . . . 0.0 111.983 173.539 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -64.74 -42.47 95.18 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 112.207 0.447 . . . . 0.0 112.207 -177.602 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 98.0 m -64.61 -46.91 80.62 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.444 -0.785 . . . . 0.0 112.355 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -63.56 -32.49 73.97 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 119.909 1.232 . . . . 0.0 112.143 179.317 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 94.8 m -61.97 -43.62 98.46 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.761 0.824 . . . . 0.0 112.927 170.527 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -67.37 -32.71 73.83 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 178.163 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 89.1 mt -65.12 -56.3 16.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 C-N-CA 123.388 0.675 . . . . 0.0 110.825 177.232 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' TYR . . . . . 0.556 ' HB2' HD11 ' A' ' 77' ' ' ILE . 31.9 t80 -69.13 -37.25 78.2 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 -172.483 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 64.7 m-80 -100.79 159.3 15.3 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.862 0.865 . . . . 0.0 112.724 -170.6 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 49.2 mmtm -66.82 146.11 99.03 Favored Pre-proline 0 N--CA 1.476 0.867 0 C-N-CA 123.773 0.829 . . . . 0.0 110.571 172.886 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -66.24 -7.61 17.9 Favored 'Trans proline' 0 CA--C 1.542 0.919 0 C-N-CA 123.604 2.87 . . . . 0.0 114.656 -175.402 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 50.8 p -113.6 -0.66 14.28 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 126.624 1.969 . . . . 0.0 113.235 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -65.89 147.25 53.67 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.568 -0.708 . . . . 0.0 111.027 173.462 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -51.85 -48.49 63.96 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.568 0.747 . . . . 0.0 112.405 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 9.9 tp -57.02 -30.9 35.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 N-CA-C 114.073 1.138 . . . . 0.0 114.073 -179.792 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 51.9 t -72.76 -47.44 49.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 O-C-N 121.55 -0.719 . . . . 0.0 110.394 174.121 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 75.0 mt -61.08 -36.74 80.46 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 118.994 0.816 . . . . 0.0 111.808 176.915 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 11.2 mtt -59.01 -52.64 64.9 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.892 1.277 . . . . 0.0 112.011 169.953 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.14 -39.78 87.5 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.254 0.621 . . . . 0.0 112.542 176.716 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 90.3 mt-30 -62.51 -38.36 89.61 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.909 0.884 . . . . 0.0 112.833 174.117 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -75.49 -34.7 60.89 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.196 0.998 . . . . 0.0 113.214 178.027 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 72.0 mt -68.87 -45.51 70.81 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.182 0.593 . . . . 0.0 111.383 170.356 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -62.54 -39.95 95.24 Favored 'General case' 0 N--CA 1.468 0.467 0 O-C-N 121.281 -0.887 . . . . 0.0 112.98 -175.716 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 5.2 ptpp? -61.0 -42.36 98.3 Favored 'General case' 0 N--CA 1.474 0.737 0 O-C-N 121.382 -0.824 . . . . 0.0 112.36 176.895 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 87.8 mt -66.26 -46.24 87.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 C-N-CA 123.828 0.851 . . . . 0.0 110.632 174.343 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -50.09 -50.22 48.95 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 119.102 0.864 . . . . 0.0 111.188 174.494 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.2 mt -63.01 -42.17 99.76 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 178.216 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -62.0 -35.43 78.52 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 119.444 1.02 . . . . 0.0 112.964 174.143 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 34.6 mmtm -72.98 -52.43 14.52 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.862 1.265 . . . . 0.0 111.635 179.5 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.0 m -67.92 -25.24 31.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 CA-C-N 119.736 1.153 . . . . 0.0 112.447 178.409 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -61.69 -30.32 70.67 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.58 -0.7 . . . . 0.0 112.604 170.878 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -90.24 -9.45 47.99 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.758 1.223 . . . . 0.0 112.683 175.539 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 40.0 ttp -64.77 141.55 98.35 Favored Pre-proline 0 CA--C 1.547 0.859 0 CA-C-N 119.004 0.82 . . . . 0.0 109.86 169.014 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -51.99 151.69 15.66 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 122.945 2.43 . . . . 0.0 113.43 170.517 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 18.7 mm100 -90.64 -21.05 21.87 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.385 0.674 . . . . 0.0 112.648 172.161 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -93.97 159.39 15.19 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.673 1.589 . . . . 0.0 111.053 173.514 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -125.3 139.11 53.99 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.07 1.348 . . . . 0.0 111.293 -171.111 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 9.9 p -146.01 150.73 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 124.315 1.046 . . . . 0.0 111.438 -175.929 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 24.6 tp10 -69.35 146.69 51.94 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.109 0.964 . . . . 0.0 111.715 171.593 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 147' ' ' LEU . . . . . 0.486 HD12 ' HG3' ' A' ' 35' ' ' LYS . 88.3 mt . . . . . 0 N--CA 1.473 0.71 0 N-CA-C 113.608 0.966 . . . . 0.0 113.608 173.529 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.888 0 CA-C-O 121.566 0.537 . . . . 0.0 114.33 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 8.6 ptp180 -164.66 167.83 18.71 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 127.461 2.304 . . . . 0.0 110.175 176.223 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 8.3 tppt? -76.11 114.24 14.54 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 166.859 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 67.2 p -105.84 169.5 8.45 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 125.18 1.392 . . . . 0.0 110.297 174.012 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 24.0 p-10 -50.52 -37.86 41.36 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 174.266 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -71.51 -48.07 51.26 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.519 0.727 . . . . 0.0 111.595 178.431 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 75.9 mt -65.54 -30.78 71.57 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.472 -0.767 . . . . 0.0 112.753 177.047 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 39.3 tt0 -59.56 -52.62 64.76 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 123.913 0.885 . . . . 0.0 109.681 168.879 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 64.9 t80 -58.73 -42.35 88.54 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.025 0.93 . . . . 0.0 112.755 179.453 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 96.7 mmm -53.95 -51.71 62.95 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 118.514 0.597 . . . . 0.0 112.008 174.258 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 4.3 tp60 -75.08 -34.06 61.72 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 121.17 -0.956 . . . . 0.0 113.496 -178.735 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 52.3 t30 -89.81 -22.67 21.99 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.512 1.125 . . . . 0.0 113.479 -168.035 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 6.0 t -130.64 -50.13 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 CA-C-N 118.103 0.411 . . . . 0.0 111.195 -175.531 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 17.0 t -68.19 -62.93 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 122.783 0.433 . . . . 0.0 110.189 -175.4 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 43.1 t -56.4 -48.47 79.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 C-N-CA 125.368 1.467 . . . . 0.0 110.387 173.463 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 24.6 ttpt -60.37 -43.01 96.98 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -173.442 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 53.1 m -71.42 -44.96 63.9 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 119.01 0.823 . . . . 0.0 112.22 173.13 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 70.0 mt -60.4 -35.09 74.95 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.315 0.961 . . . . 0.0 112.325 178.907 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 26.0 t-105 -69.77 -30.1 67.59 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.538 1.535 . . . . 0.0 113.494 176.409 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -84.38 -6.21 59.36 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 124.302 1.041 . . . . 0.0 113.756 177.54 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 45.7 t-80 -63.15 154.73 30.21 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.74 1.216 . . . . 0.0 113.154 -179.33 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 60.9 tt0 -56.47 -24.54 46.52 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.598 1.559 . . . . 0.0 113.931 175.084 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 -122.0 19.28 10.86 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.326 1.451 . . . . 0.0 113.841 -173.132 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.79 -26.74 63.47 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 176.9 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 61.3 p-90 -59.58 -35.45 30.05 Favored Pre-proline 0 CA--C 1.548 0.893 0 N-CA-C 117.861 2.541 . . . . 0.0 117.861 -169.789 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -74.93 -3.42 13.89 Favored 'Trans proline' 0 CA--C 1.544 0.986 0 CA-C-N 123.232 2.19 . . . . 0.0 113.558 174.23 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 56.5 m-85 -109.98 -6.48 15.16 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.472 1.509 . . . . 0.0 113.066 178.259 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 20.4 m-30 -62.87 -16.53 59.04 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 178.84 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -142.02 156.52 65.08 Favored Pre-proline 0 CA--C 1.544 0.739 0 C-N-CA 126.372 1.869 . . . . 0.0 110.239 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -64.65 152.96 79.91 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 122.673 2.249 . . . . 0.0 112.054 173.45 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 54.6 t -66.38 101.12 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 C-N-CA 124.088 0.955 . . . . 0.0 110.675 176.295 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 52.7 m-20 -75.5 84.67 2.58 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.512 1.125 . . . . 0.0 110.613 172.37 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.97 -28.29 36.65 Favored 'General case' 0 CA--C 1.547 0.827 0 N-CA-C 113.987 1.106 . . . . 0.0 113.987 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 81.9 mt -65.37 -50.1 74.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 124.766 1.226 . . . . 0.0 111.097 172.54 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -66.33 -41.83 89.05 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.217 1.407 . . . . 0.0 112.56 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.6 mp -80.13 -4.76 54.24 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.631 1.173 . . . . 0.0 113.22 177.278 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 60.3 t30 54.8 55.05 8.28 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 126.107 1.763 . . . . 0.0 113.48 -179.239 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 34.8 mt -114.62 83.13 8.57 Favored Pre-proline 0 CA--C 1.543 0.673 0 C-N-CA 126.387 1.875 . . . . 0.0 110.343 -178.117 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -68.07 -3.44 10.66 Favored 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 123.884 3.056 . . . . 0.0 114.337 -175.562 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -127.34 9.86 6.71 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 126.174 1.79 . . . . 0.0 112.821 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 65.7 t80 -51.93 -51.86 54.07 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-N 120.284 1.402 . . . . 0.0 112.89 -175.838 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -76.17 -10.88 59.75 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.16 1.384 . . . . 0.0 113.89 179.432 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -72.44 -42.95 64.45 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.82 0.848 . . . . 0.0 110.267 175.402 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.9 mp -79.11 -55.54 9.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 C-N-CA 124.708 1.203 . . . . 0.0 110.262 172.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 47.9 mm -85.01 104.22 12.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 CA-C-O 122.153 0.978 . . . . 0.0 111.387 -175.489 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -71.24 -29.46 65.15 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.955 1.702 . . . . 0.0 114.058 -179.26 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -143.75 77.42 15.0 Favored Pre-proline 0 CA--C 1.542 0.639 0 C-N-CA 125.486 1.514 . . . . 0.0 110.712 -172.582 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -67.06 142.84 63.11 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 123.983 3.122 . . . . 0.0 111.648 -179.254 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 8.0 tpt -157.46 137.87 12.86 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.555 1.542 . . . . 0.0 109.846 -176.593 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -146.54 150.04 34.77 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.955 1.302 . . . . 0.0 111.401 -176.351 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 9.7 ttp -56.78 -36.72 70.18 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.992 1.317 . . . . 0.0 113.511 -169.83 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -61.31 -21.59 59.98 Favored Glycine 0 CA--C 1.536 1.405 0 C-N-CA 124.888 1.233 . . . . 0.0 114.77 173.857 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 24.3 m -97.08 -34.1 11.28 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.807 1.243 . . . . 0.0 111.523 172.817 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 76.8 mt -55.42 -50.37 66.24 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 119.467 1.031 . . . . 0.0 110.653 173.568 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 14.1 ptmm? -61.81 -29.71 70.34 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 113.976 1.102 . . . . 0.0 113.976 176.368 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.413 ' HE3' ' HA ' ' A' ' 88' ' ' LYS . 1.5 tpmt? -70.64 -32.9 70.37 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.748 1.219 . . . . 0.0 113.301 -175.735 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 3.8 ptp180 -77.95 -31.43 50.91 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 169.571 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 80.8 mt -67.6 -28.47 67.78 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 114.04 1.126 . . . . 0.0 114.04 169.262 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -65.92 -8.48 22.63 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 125.271 1.428 . . . . 0.0 114.149 174.894 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 -135.17 163.64 29.49 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.702 1.601 . . . . 0.0 112.819 -171.032 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 -81.12 105.39 12.29 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 169.071 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -140.53 -40.71 0.42 Allowed 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.308 1.043 . . . . 0.0 112.675 -172.519 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -130.81 175.53 8.96 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 126.603 1.961 . . . . 0.0 111.25 172.67 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 3.1 t-105 -115.24 -21.2 10.04 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.602 1.161 . . . . 0.0 112.833 -174.308 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 91.7 p -127.19 149.16 50.1 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.387 1.075 . . . . 0.0 112.783 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -64.32 -20.32 66.02 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 114.212 1.19 . . . . 0.0 114.212 175.227 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 83.1 p -51.13 -38.38 51.66 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.022 0.929 . . . . 0.0 113.255 177.896 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -67.19 -43.16 82.84 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.357 1.063 . . . . 0.0 111.782 179.241 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 49.6 t -66.92 -36.35 82.06 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.23 1.012 . . . . 0.0 112.742 174.656 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 88.1 mtp -62.42 -41.66 98.87 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 121.425 -0.797 . . . . 0.0 111.964 176.615 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 61.8 mm-40 -64.68 -33.93 77.11 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 112.767 0.655 . . . . 0.0 112.767 173.341 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 87.5 m-20 -67.69 -41.86 82.98 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 120.967 -1.083 . . . . 0.0 111.78 174.447 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -59.38 -47.58 84.91 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.208 0.603 . . . . 0.0 112.308 169.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.75 -42.0 92.22 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 121.776 -0.577 . . . . 0.0 111.297 177.029 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 62.4 m -62.49 -45.47 92.85 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.72 0.808 . . . . 0.0 111.547 178.095 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 57.5 ttp -55.68 -52.4 63.99 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.157 0.983 . . . . 0.0 112.778 176.235 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -68.46 -37.28 80.04 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.0 m -59.28 -50.15 75.1 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.226 1.01 . . . . 0.0 111.818 173.988 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -57.97 -37.46 74.22 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.268 0.627 . . . . 0.0 112.18 -178.939 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 90.3 m -57.29 -43.16 82.94 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.122 0.969 . . . . 0.0 112.386 173.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -70.18 -29.57 66.47 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.3 1.04 . . . . 0.0 113.632 176.592 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 82.2 mt -75.67 -57.13 6.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 123.804 0.842 . . . . 0.0 110.894 179.663 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -69.74 -23.04 63.33 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 114.507 1.299 . . . . 0.0 114.507 -172.118 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 36.6 m-80 -120.32 165.93 14.21 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.336 1.054 . . . . 0.0 112.724 -170.566 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -70.19 148.47 95.85 Favored Pre-proline 0 N--CA 1.475 0.813 0 C-N-CA 124.178 0.991 . . . . 0.0 110.477 174.794 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -65.99 -6.38 14.25 Favored 'Trans proline' 0 CA--C 1.543 0.963 0 C-N-CA 123.634 2.889 . . . . 0.0 114.568 -178.319 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 67.9 p -116.0 1.32 13.26 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 126.641 1.977 . . . . 0.0 113.099 179.276 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -66.91 147.81 52.75 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 121.478 -0.764 . . . . 0.0 110.833 173.135 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -52.29 -48.55 65.28 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.441 0.696 . . . . 0.0 112.322 178.961 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.1 tp -58.15 -30.11 38.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 -178.816 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 39.2 t -71.38 -48.3 54.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 O-C-N 121.538 -0.726 . . . . 0.0 110.383 173.226 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 74.3 mt -61.35 -36.65 80.76 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 118.876 0.762 . . . . 0.0 111.701 177.502 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 11.7 mtt -59.23 -51.75 68.63 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 124.735 1.214 . . . . 0.0 111.984 169.935 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -59.97 -40.9 90.68 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 123.191 0.596 . . . . 0.0 112.474 176.932 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 89.5 mt-30 -61.71 -45.96 91.71 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 119.085 0.857 . . . . 0.0 111.972 174.382 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -69.0 -28.0 66.2 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.445 1.098 . . . . 0.0 113.862 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 78.7 mt -78.36 -45.09 23.36 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.857 0.863 . . . . 0.0 111.547 169.792 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -61.04 -40.31 93.12 Favored 'General case' 0 N--CA 1.47 0.569 0 O-C-N 121.124 -0.985 . . . . 0.0 112.777 -175.189 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 60.6 pttt -59.22 -39.76 83.71 Favored 'General case' 0 N--CA 1.474 0.741 0 O-C-N 121.535 -0.728 . . . . 0.0 112.282 176.389 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 69.1 mt -72.66 -42.37 62.61 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 C-N-CA 124.457 1.103 . . . . 0.0 111.272 175.686 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -50.85 -51.58 49.9 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.395 0.998 . . . . 0.0 110.384 171.654 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 99.1 mt -62.18 -45.03 95.21 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 177.027 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -62.89 -30.61 71.66 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 119.603 1.092 . . . . 0.0 113.402 179.074 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 70.3 mmtt -75.1 -54.92 6.31 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 124.658 1.183 . . . . 0.0 112.262 174.216 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 6.0 m -66.13 -25.03 34.8 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 CA-C-N 120.691 1.587 . . . . 0.0 112.535 -178.469 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -58.09 -28.47 64.62 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 172.209 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -97.81 -3.18 39.38 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.235 1.414 . . . . 0.0 112.423 178.6 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 42.9 ttp -62.64 138.27 96.71 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 123.994 0.917 . . . . 0.0 110.728 173.637 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.07 125.98 15.62 Favored 'Trans proline' 0 CA--C 1.534 0.516 0 C-N-CA 122.864 2.376 . . . . 0.0 110.365 177.295 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 80.4 mm-40 -76.2 -22.4 55.34 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 113.472 0.915 . . . . 0.0 113.472 -173.671 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -75.13 159.02 32.14 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.244 1.417 . . . . 0.0 111.585 169.482 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -122.59 129.65 52.14 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.574 1.55 . . . . 0.0 111.208 -174.404 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 78.8 t -141.76 131.5 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 125.545 1.538 . . . . 0.0 110.961 -169.43 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -69.31 125.03 25.42 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.601 1.56 . . . . 0.0 111.074 169.779 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 97.7 mt . . . . . 0 CA--C 1.54 0.589 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 178.418 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.96 0 CA-C-O 121.234 0.352 . . . . 0.0 113.299 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 34.8 ptt180 -163.79 157.87 19.46 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 126.235 1.814 . . . . 0.0 110.425 175.926 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 26.0 ttpt -71.45 135.96 47.42 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.451 0.7 . . . . 0.0 110.315 170.627 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 70.9 p -140.22 166.79 23.71 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 125.951 1.701 . . . . 0.0 110.181 -175.455 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 25.1 p-10 -46.63 -37.69 8.59 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 170.429 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 -70.31 -55.57 8.87 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.573 0.749 . . . . 0.0 111.683 179.205 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 86.2 mt -62.67 -34.55 77.34 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 121.534 -0.729 . . . . 0.0 112.597 178.284 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -56.24 -54.3 47.01 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.904 0.882 . . . . 0.0 110.842 170.499 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 75.1 t80 -59.29 -40.54 86.45 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 119.098 0.863 . . . . 0.0 112.925 179.175 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 92.3 mmm -55.48 -50.98 68.47 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 118.754 0.706 . . . . 0.0 111.795 172.453 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -85.56 -3.39 58.86 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 114.874 1.435 . . . . 0.0 114.874 -175.147 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 38.5 m-80 -118.33 -17.48 9.46 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.027 1.331 . . . . 0.0 114.265 -178.659 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 37.9 t -136.99 -50.18 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-N 119.211 0.914 . . . . 0.0 111.866 -178.335 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.4 t -67.75 -62.71 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 CA-C-N 119.378 0.99 . . . . 0.0 110.634 -174.468 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 84.5 t -60.71 -44.46 97.24 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 C-N-CA 123.736 0.814 . . . . 0.0 110.481 174.836 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt -56.68 -44.23 81.23 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 118.688 0.676 . . . . 0.0 112.401 -178.784 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 56.4 m -70.56 -47.14 61.75 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 122.672 0.389 . . . . 0.0 111.815 176.793 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 63.2 mt -61.48 -33.24 73.44 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 123.323 0.649 . . . . 0.0 112.199 179.09 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' TRP . . . . . 0.454 ' CZ3' ' HE3' ' A' ' 87' ' ' LYS . 21.3 t-105 -72.48 -29.18 63.42 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 125.655 1.582 . . . . 0.0 113.475 175.94 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt -82.04 -8.96 59.69 Favored 'General case' 0 N--CA 1.479 0.984 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 176.48 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 44.2 t-80 -62.17 152.76 32.21 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.638 1.175 . . . . 0.0 113.096 -178.315 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 22.6 tp60 -57.87 -19.84 32.24 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.487 1.515 . . . . 0.0 114.017 174.766 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 15.4 m-85 -122.9 16.09 10.08 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.709 1.604 . . . . 0.0 113.995 -173.918 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.34 -29.64 66.39 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 114.149 1.166 . . . . 0.0 114.149 178.531 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' TRP . . . . . 0.428 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 39.8 p-90 -56.4 -37.31 56.12 Favored Pre-proline 0 CA--C 1.547 0.841 0 N-CA-C 117.079 2.252 . . . . 0.0 117.079 -171.329 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.428 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 55.8 Cg_endo -67.95 -6.53 17.27 Favored 'Trans proline' 0 C--N 1.356 0.924 0 CA-C-N 122.997 2.106 . . . . 0.0 114.985 172.267 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -113.69 -3.08 13.6 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.424 1.489 . . . . 0.0 113.129 179.119 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.8 m-30 -63.76 -20.61 65.9 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 113.666 0.987 . . . . 0.0 113.666 176.212 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -140.65 157.32 68.2 Favored Pre-proline 0 CA--C 1.545 0.772 0 C-N-CA 126.683 1.993 . . . . 0.0 110.048 -177.541 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -65.08 153.46 78.18 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 122.608 2.205 . . . . 0.0 112.144 174.526 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 63.7 t -65.77 102.51 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 C-N-CA 124.179 0.992 . . . . 0.0 110.963 176.727 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 42.9 m-20 -74.58 86.76 2.11 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.627 1.171 . . . . 0.0 109.855 169.349 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -52.47 -25.75 11.02 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.408 1.262 . . . . 0.0 114.408 -177.041 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 80.7 mt -64.5 -50.58 75.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 125.207 1.403 . . . . 0.0 111.323 171.676 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 55.2 mttm -73.48 -40.64 63.95 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 125.277 1.431 . . . . 0.0 112.937 -178.559 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -74.36 -10.65 59.79 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.19 0.996 . . . . 0.0 113.406 173.552 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 60.3 t30 58.87 54.58 5.05 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 126.7 2.0 . . . . 0.0 112.865 177.809 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 48.4 mt -115.21 81.59 8.29 Favored Pre-proline 0 CA--C 1.545 0.788 0 C-N-CA 126.681 1.993 . . . . 0.0 110.147 -175.253 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -67.68 -5.78 15.11 Favored 'Trans proline' 0 CA--C 1.543 0.956 0 C-N-CA 124.154 3.236 . . . . 0.0 114.925 -171.247 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -128.92 15.47 6.33 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.895 1.678 . . . . 0.0 112.51 179.357 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 63.4 t80 -47.25 -55.14 9.2 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 113.987 1.106 . . . . 0.0 113.987 -172.311 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -74.28 -13.23 60.74 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.783 1.233 . . . . 0.0 114.207 -178.767 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.418 ' HE2' ' HA ' ' A' ' 75' ' ' LYS . 8.9 mmpt? -76.41 -33.12 58.83 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.622 1.169 . . . . 0.0 111.981 175.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.3 mp -91.84 -46.42 14.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 124.687 1.195 . . . . 0.0 110.67 172.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 35.7 mm -84.34 99.01 6.25 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 CA-C-O 122.148 0.975 . . . . 0.0 111.276 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.55 -38.44 87.45 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 126.172 1.789 . . . . 0.0 113.85 177.09 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 -142.52 87.25 9.36 Favored Pre-proline 0 CA--C 1.543 0.706 0 C-N-CA 125.055 1.342 . . . . 0.0 110.616 -176.03 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -68.4 141.98 53.05 Favored 'Trans proline' 0 CA--C 1.538 0.691 0 C-N-CA 123.668 2.912 . . . . 0.0 111.666 -176.875 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.8 tpt -156.25 134.89 11.68 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.498 1.119 . . . . 0.0 110.773 -171.084 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -147.68 152.87 38.55 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.518 1.527 . . . . 0.0 111.237 -176.8 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 6.6 ttp -58.01 -36.89 73.33 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.434 1.094 . . . . 0.0 113.62 -170.404 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -59.49 -29.66 66.94 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 124.497 1.046 . . . . 0.0 114.296 174.914 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 27.9 m -85.88 -31.31 22.28 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.282 1.033 . . . . 0.0 111.786 176.426 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 62.4 mt -60.57 -52.48 61.04 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 CA-C-N 118.887 0.767 . . . . 0.0 110.661 174.465 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.454 ' HE3' ' CZ3' ' A' ' 51' ' ' TRP . 17.0 ptpt -57.89 -32.84 68.12 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 178.523 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 2.8 tppp? -59.29 -38.55 80.45 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 178.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 5.6 ptp180 -86.46 -19.06 30.15 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 114.213 1.19 . . . . 0.0 114.213 175.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 52.9 mt -70.68 -48.15 56.28 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 119.061 0.846 . . . . 0.0 111.964 167.664 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -62.86 -14.27 44.01 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 115.076 1.51 . . . . 0.0 115.076 -171.847 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 46.2 p30 -124.25 14.04 8.98 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 126.141 1.776 . . . . 0.0 113.133 177.181 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . 0.269 6.3 p30 37.24 65.75 0.49 Allowed 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 127.149 2.18 . . . . 0.0 114.403 -174.043 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 74.1 t80 -59.29 -24.2 63.07 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.013 1.325 . . . . 0.0 114.097 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -132.42 -174.31 3.41 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 129.101 2.96 . . . . 0.0 111.863 -169.995 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 2.3 t-105 -112.67 -27.47 8.17 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.761 1.224 . . . . 0.0 113.382 -174.353 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 39.9 t -134.15 145.29 49.12 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.627 1.171 . . . . 0.0 111.773 -177.409 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -57.24 -18.86 18.01 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.837 1.655 . . . . 0.0 114.769 172.795 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 10.8 m -53.82 -32.89 54.42 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.206 1.002 . . . . 0.0 113.132 177.191 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -73.91 -42.61 60.4 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.214 1.006 . . . . 0.0 112.757 175.956 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 49.5 t -60.4 -40.75 92.06 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.271 1.028 . . . . 0.0 112.091 171.526 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 81.7 mtp -61.5 -41.59 97.52 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.099 0.96 . . . . 0.0 112.553 174.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -65.5 -34.04 77.34 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 174.861 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -67.26 -42.79 83.32 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 121.25 -0.907 . . . . 0.0 111.762 173.019 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -60.75 -45.86 92.67 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.254 -0.904 . . . . 0.0 112.599 172.215 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 35.5 t30 -55.62 -45.06 77.57 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.218 0.607 . . . . 0.0 111.678 173.072 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 88.7 m -62.69 -45.18 93.95 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.389 1.076 . . . . 0.0 112.149 179.104 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 12.7 ttm -55.69 -59.56 4.69 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.537 1.135 . . . . 0.0 112.453 177.787 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 -65.18 -34.98 79.66 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 121.98 -0.45 . . . . 0.0 112.136 -178.53 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 16.5 m -58.92 -51.77 68.62 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.322 1.049 . . . . 0.0 111.92 173.27 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -56.43 -40.08 74.16 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.773 0.829 . . . . 0.0 111.763 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 96.6 m -55.8 -50.72 69.73 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.3 0.64 . . . . 0.0 111.955 171.408 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -62.25 -26.59 68.47 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 114.07 1.137 . . . . 0.0 114.07 178.87 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 74.4 mt -73.63 -59.17 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 C-N-CA 123.75 0.82 . . . . 0.0 110.615 173.45 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -74.29 -46.42 41.28 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 -172.2 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -97.58 152.01 19.48 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.769 1.228 . . . . 0.0 111.305 -179.296 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 49.5 mmtm -81.9 155.87 70.17 Favored Pre-proline 0 N--CA 1.475 0.815 0 C-N-CA 125.343 1.457 . . . . 0.0 111.558 -175.774 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' PRO . . . . . 0.428 ' HA ' HG11 ' A' ' 123' ' ' VAL . 49.9 Cg_endo -62.95 -0.7 2.25 Favored 'Trans proline' 0 CA--C 1.543 0.973 0 C-N-CA 124.181 3.254 . . . . 0.0 115.759 -178.887 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 64.0 p -114.13 -4.23 13.15 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 126.878 2.071 . . . . 0.0 113.097 178.239 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 74.9 m-20 -76.24 142.74 41.33 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.038 0.836 . . . . 0.0 110.814 172.859 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -57.62 -46.27 84.31 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 121.49 -0.756 . . . . 0.0 112.299 -176.808 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.1 tp -53.63 -28.58 16.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 125.823 1.649 . . . . 0.0 114.629 175.789 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.428 HG11 ' HA ' ' A' ' 118' ' ' PRO . 55.8 t -75.66 -44.54 40.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 O-C-N 121.021 -1.049 . . . . 0.0 110.758 173.434 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 67.1 mt -61.11 -36.15 78.94 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 119.058 0.844 . . . . 0.0 111.579 174.787 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 10.4 mtt -58.9 -51.64 69.15 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.582 1.153 . . . . 0.0 111.972 169.753 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.27 -40.55 94.5 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.432 0.693 . . . . 0.0 112.536 177.374 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -61.36 -49.17 78.04 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.793 0.837 . . . . 0.0 111.664 174.405 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.87 -43.43 98.42 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.735 0.814 . . . . 0.0 112.495 179.419 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 87.2 mt -64.66 -45.79 85.22 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.593 0.757 . . . . 0.0 111.893 173.664 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -64.38 -36.42 84.08 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.056 -1.027 . . . . 0.0 113.352 -176.213 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 69.5 mttt -57.65 -49.23 77.16 Favored 'General case' 0 N--CA 1.478 0.937 0 O-C-N 121.453 -0.779 . . . . 0.0 111.179 173.426 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 89.9 mt -66.08 -43.37 92.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 123.918 0.887 . . . . 0.0 111.17 178.238 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -51.4 -53.3 38.1 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.741 0.816 . . . . 0.0 110.783 173.891 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 95.6 mt -61.69 -42.61 99.16 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.01 0.524 . . . . 0.0 112.392 177.837 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.61 -34.59 75.92 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-N 119.084 0.857 . . . . 0.0 113.072 178.506 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -74.69 -54.36 7.55 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.507 1.123 . . . . 0.0 112.401 175.764 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.9 m -64.94 -23.94 34.48 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 CA-C-N 120.306 1.412 . . . . 0.0 112.509 -178.655 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -59.29 -31.26 68.96 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 170.803 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 91.5 mt-30 -90.36 -11.75 39.68 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.016 1.326 . . . . 0.0 112.742 176.023 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 45.3 ttp -64.91 137.32 97.11 Favored Pre-proline 0 CA--C 1.546 0.792 0 CA-C-N 119.066 0.848 . . . . 0.0 110.571 174.3 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -66.65 130.9 24.52 Favored 'Trans proline' 0 CA--C 1.537 0.636 0 C-N-CA 122.911 2.407 . . . . 0.0 111.665 -179.521 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -68.52 -30.52 69.34 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.069 1.347 . . . . 0.0 112.45 178.941 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -76.35 158.83 31.08 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.655 1.582 . . . . 0.0 113.21 173.566 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -112.68 139.58 48.16 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 124.939 1.296 . . . . 0.0 110.499 177.602 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 10.2 p -143.97 134.62 21.36 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-O 122.245 1.021 . . . . 0.0 110.76 169.548 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 45.9 tt0 -64.28 128.85 37.6 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.412 1.885 . . . . 0.0 111.219 174.954 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 88.5 mt . . . . . 0 CA--C 1.54 0.577 0 N-CA-C 113.208 0.818 . . . . 0.0 113.208 -177.252 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.962 0 N-CA-C 112.279 -0.328 . . . . 0.0 112.279 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -172.22 165.55 6.01 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.965 1.706 . . . . 0.0 111.384 -174.128 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 26.1 pttm -67.11 139.44 57.52 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.013 0.925 . . . . 0.0 112.822 172.814 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 45.7 p -148.78 164.75 33.48 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 126.257 1.823 . . . . 0.0 110.582 178.152 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 23.7 p-10 -50.89 -39.24 53.68 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 178.571 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 66.8 mt-30 -72.62 -44.07 62.44 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 121.561 -0.712 . . . . 0.0 111.634 179.359 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 89.3 mt -64.22 -32.21 73.71 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 118.707 0.685 . . . . 0.0 111.99 174.541 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -61.18 -52.7 63.72 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-N 118.443 0.565 . . . . 0.0 109.924 168.521 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -55.09 -41.03 71.07 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.27 -0.894 . . . . 0.0 112.635 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 88.7 mmm -57.64 -56.43 22.04 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.878 -0.513 . . . . 0.0 112.042 170.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -77.19 -9.14 58.58 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 114.984 1.476 . . . . 0.0 114.984 -173.445 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -117.75 -23.63 7.51 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.353 1.461 . . . . 0.0 112.598 -169.781 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 18.7 t -127.53 -54.65 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 C-N-CA 123.429 0.692 . . . . 0.0 111.295 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.6 t -64.23 -59.95 3.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 CA-C-N 118.446 0.567 . . . . 0.0 110.652 -174.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 72.1 t -59.36 -46.38 92.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 124.457 1.103 . . . . 0.0 110.664 174.319 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 36.0 ttmt -57.39 -49.77 75.13 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.278 0.631 . . . . 0.0 112.357 -174.762 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 61.5 m -67.1 -43.85 81.45 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 118.599 0.636 . . . . 0.0 112.089 176.657 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 82.9 mt -62.28 -35.18 78.21 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 119.021 0.828 . . . . 0.0 112.481 178.82 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 20.7 t-105 -72.17 -27.09 62.36 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.76 1.624 . . . . 0.0 113.385 175.565 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.1 mtmp? -85.94 -4.47 59.17 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 177.328 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 39.7 t-80 -63.93 156.44 27.76 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.98 1.312 . . . . 0.0 113.185 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -57.77 -23.28 51.43 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.503 1.521 . . . . 0.0 113.638 173.536 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 -123.0 18.93 10.08 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.345 1.458 . . . . 0.0 114.137 -171.614 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.11 -26.34 63.92 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 176.608 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 58.9 p-90 -59.22 -35.92 36.41 Favored Pre-proline 0 CA--C 1.547 0.836 0 N-CA-C 117.978 2.585 . . . . 0.0 117.978 -169.729 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -74.52 -3.5 13.96 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 CA-C-N 123.277 2.206 . . . . 0.0 113.691 173.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 55.9 m-85 -110.3 -5.27 15.3 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.428 1.491 . . . . 0.0 113.14 178.849 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -62.84 -16.16 57.38 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 179.475 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -142.18 155.59 64.91 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 125.969 1.708 . . . . 0.0 110.389 -177.206 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -64.48 144.0 83.81 Favored 'Trans proline' 0 CA--C 1.538 0.677 0 C-N-CA 122.641 2.227 . . . . 0.0 111.713 173.778 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 76.5 t -60.6 115.58 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 123.546 0.738 . . . . 0.0 111.261 175.879 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 57.9 m-20 -92.44 103.89 16.27 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.249 1.02 . . . . 0.0 109.019 169.146 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.55 -30.08 60.12 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 113.418 0.896 . . . . 0.0 113.418 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 81.9 mt -65.03 -49.88 77.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 124.85 1.26 . . . . 0.0 111.155 174.721 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -63.84 -37.3 86.89 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.819 1.248 . . . . 0.0 113.403 -177.384 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.4 mp -89.68 -1.76 58.1 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.231 1.413 . . . . 0.0 112.36 178.216 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 23.0 m120 52.78 52.64 13.57 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 126.162 1.785 . . . . 0.0 113.264 -177.994 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 29.1 mt -107.71 94.28 11.91 Favored Pre-proline 0 CA--C 1.544 0.713 0 C-N-CA 126.26 1.824 . . . . 0.0 109.767 -179.35 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -68.72 -13.81 37.85 Favored 'Trans proline' 0 CA--C 1.542 0.877 0 C-N-CA 123.084 2.523 . . . . 0.0 114.55 -170.668 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 -136.65 21.05 3.1 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.573 1.549 . . . . 0.0 112.921 -173.437 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 64.7 t80 -46.14 -50.49 15.45 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.338 1.055 . . . . 0.0 113.827 -175.727 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 98.8 m-70 -73.48 -17.81 61.19 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 114.454 1.279 . . . . 0.0 114.454 -177.186 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 43.7 mttp -68.15 -39.53 82.63 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 119.343 0.974 . . . . 0.0 111.855 174.339 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.2 mp -81.37 -46.11 20.46 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 C-N-CA 124.8 1.24 . . . . 0.0 110.288 175.444 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 49.4 mm -98.57 98.48 7.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 CA-C-O 122.224 1.011 . . . . 0.0 111.353 -176.494 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.94 -32.5 74.06 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 126.397 1.879 . . . . 0.0 113.868 177.963 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -141.2 75.78 22.82 Favored Pre-proline 0 CA--C 1.542 0.664 0 C-N-CA 125.259 1.423 . . . . 0.0 110.559 -171.317 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -67.08 142.35 61.17 Favored 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 124.174 3.249 . . . . 0.0 111.289 -178.208 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 8.1 tpt -158.09 136.21 10.8 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.61 1.164 . . . . 0.0 110.221 -170.567 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -145.98 149.94 35.11 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.929 1.292 . . . . 0.0 111.563 -176.84 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.4 ttp -57.99 -37.01 73.45 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.667 1.187 . . . . 0.0 113.079 -171.052 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -61.7 -26.1 66.4 Favored Glycine 0 CA--C 1.533 1.178 0 C-N-CA 125.02 1.295 . . . . 0.0 114.597 174.196 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 20.2 m -82.74 -41.73 18.88 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.178 0.991 . . . . 0.0 110.708 170.455 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 68.4 mt -56.02 -51.9 56.23 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 124.114 0.966 . . . . 0.0 111.39 179.148 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.9 -35.68 71.38 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 113.291 0.848 . . . . 0.0 113.291 176.92 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -69.39 -34.34 74.37 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.089 0.956 . . . . 0.0 113.409 -177.301 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 4.9 ptp180 -76.89 -30.59 56.25 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 170.196 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 74.5 mt -63.9 -37.4 87.27 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 119.643 1.111 . . . . 0.0 113.011 168.759 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -75.87 8.55 2.99 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.495 1.518 . . . . 0.0 114.087 177.511 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 37.0 m-80 -137.3 167.07 22.31 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.652 1.981 . . . . 0.0 111.952 -179.564 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 5.4 p30 -80.62 111.49 17.1 Favored 'General case' 0 CA--C 1.545 0.75 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 168.025 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 56.2 t80 -148.25 -38.12 0.18 Allowed 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.864 0.691 . . . . 0.0 112.864 -171.447 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -138.56 173.12 11.92 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.35 1.86 . . . . 0.0 111.365 169.972 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.4 t-105 -108.86 -20.33 13.09 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 125.293 1.437 . . . . 0.0 112.162 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 40.5 t -130.34 138.48 50.45 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 126.087 1.755 . . . . 0.0 111.623 -171.132 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -65.92 -17.08 64.42 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 114.968 1.47 . . . . 0.0 114.968 178.836 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 35.6 p -53.18 -26.92 19.02 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.073 1.349 . . . . 0.0 114.019 172.785 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 53.7 mm-40 -80.54 -41.89 23.37 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.213 1.005 . . . . 0.0 111.999 177.032 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 52.0 t -60.37 -41.8 94.51 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.417 -0.802 . . . . 0.0 111.994 169.71 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 88.8 mtp -60.07 -43.88 95.13 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 121.305 -0.872 . . . . 0.0 112.827 175.489 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -72.06 -28.3 63.25 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 179.13 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 -66.32 -44.33 83.68 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.217 -0.927 . . . . 0.0 111.071 169.31 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -58.5 -47.53 83.78 Favored 'General case' 0 CA--C 1.539 0.519 0 O-C-N 121.273 -0.892 . . . . 0.0 112.422 172.225 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -61.55 -39.3 90.61 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 118.635 0.652 . . . . 0.0 111.724 177.225 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 89.2 m -63.61 -44.71 93.18 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.88 0.872 . . . . 0.0 111.972 176.292 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 52.0 ttp -56.67 -52.7 63.9 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.011 0.924 . . . . 0.0 112.675 176.826 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -68.48 -34.42 75.9 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 17.5 m -59.34 -52.05 67.31 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.295 1.038 . . . . 0.0 111.807 173.197 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 -57.48 -37.43 72.91 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.89 0.876 . . . . 0.0 112.193 -178.366 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 94.6 m -57.11 -44.12 82.97 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.18 0.992 . . . . 0.0 112.188 173.732 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -69.65 -30.05 67.66 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.393 1.077 . . . . 0.0 113.68 176.868 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 82.3 mt -74.26 -57.57 6.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 123.476 0.711 . . . . 0.0 110.747 178.966 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 37.4 t80 -68.11 -30.25 69.36 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 114.068 1.136 . . . . 0.0 114.068 -173.132 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 37.9 m-80 -113.74 162.92 15.69 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.981 0.912 . . . . 0.0 112.803 -169.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -68.6 148.12 98.06 Favored Pre-proline 0 N--CA 1.472 0.633 0 C-N-CA 124.635 1.174 . . . . 0.0 110.321 175.707 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -65.85 -6.89 15.18 Favored 'Trans proline' 0 CA--C 1.544 1.016 0 C-N-CA 123.718 2.945 . . . . 0.0 114.654 -176.633 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 53.9 p -114.3 -0.48 13.85 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 126.686 1.994 . . . . 0.0 113.199 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -66.3 147.2 53.66 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 121.528 -0.732 . . . . 0.0 110.967 173.901 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -52.56 -47.79 66.58 Favored 'General case' 0 CA--C 1.536 0.432 0 O-C-N 121.562 -0.711 . . . . 0.0 112.422 179.154 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.2 tp -58.37 -30.31 40.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -179.224 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 41.0 t -71.56 -47.43 58.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 O-C-N 121.499 -0.751 . . . . 0.0 110.332 173.6 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 76.1 mt -61.86 -36.73 82.09 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.124 0.875 . . . . 0.0 111.844 177.409 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 13.5 mtt -59.15 -51.53 69.63 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 124.638 1.175 . . . . 0.0 111.936 170.025 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.94 -39.07 90.82 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.265 0.626 . . . . 0.0 112.675 177.257 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 88.4 mt-30 -61.33 -47.76 84.42 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 119.121 0.873 . . . . 0.0 111.826 173.726 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -61.61 -45.59 93.44 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.73 0.812 . . . . 0.0 112.48 178.552 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 83.5 mt -65.91 -44.72 84.38 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.761 0.824 . . . . 0.0 112.268 175.568 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -65.08 -36.19 83.54 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 120.972 -1.08 . . . . 0.0 112.755 -177.392 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 55.0 mtmt -58.68 -45.5 89.3 Favored 'General case' 0 N--CA 1.474 0.746 0 O-C-N 121.5 -0.75 . . . . 0.0 111.701 172.045 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 93.2 mt -66.86 -43.51 89.54 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 123.507 0.723 . . . . 0.0 110.927 176.922 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -51.69 -51.42 56.12 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.757 0.823 . . . . 0.0 111.136 173.768 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 91.9 mt -61.98 -41.77 98.39 Favored 'General case' 0 CA--C 1.541 0.603 0 O-C-N 121.738 -0.601 . . . . 0.0 112.573 178.015 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 91.2 mm-40 -61.44 -36.47 80.49 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 119.392 0.997 . . . . 0.0 113.173 174.269 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 66.9 mmtt -72.62 -51.57 19.09 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.973 0.909 . . . . 0.0 112.435 177.311 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 6.0 m -67.98 -24.85 30.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 CA-C-N 120.333 1.424 . . . . 0.0 112.352 179.245 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -59.14 -27.19 65.39 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.535 -0.728 . . . . 0.0 112.833 171.18 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -99.84 2.22 43.7 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.539 1.536 . . . . 0.0 112.427 178.959 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 11.2 ttm -55.7 141.05 66.21 Favored Pre-proline 0 CA--C 1.548 0.869 0 C-N-CA 124.671 1.188 . . . . 0.0 111.824 172.553 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -67.24 122.15 9.38 Favored 'Trans proline' 0 CA--C 1.538 0.68 0 C-N-CA 122.996 2.464 . . . . 0.0 109.566 169.238 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -70.63 -17.99 62.87 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -171.453 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 9.8 mp0 -94.39 159.58 15.05 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.551 1.54 . . . . 0.0 111.941 179.774 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -120.96 129.81 53.59 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.113 1.365 . . . . 0.0 110.856 -175.952 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 9.5 p -152.63 151.41 11.87 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 124.624 1.17 . . . . 0.0 112.338 -179.329 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -57.24 137.91 55.38 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.55 1.54 . . . . 0.0 112.619 169.764 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 52.0 mt . . . . . 0 N--CA 1.47 0.54 0 C-N-CA 123.486 0.714 . . . . 0.0 112.444 169.635 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.232 0 N-CA-C 112.056 -0.418 . . . . 0.0 112.056 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 37.7 ptt180 -155.11 156.8 36.45 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.569 1.548 . . . . 0.0 110.74 172.074 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 36.3 mtpt -76.02 143.16 41.61 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 121.285 0.564 . . . . 0.0 110.053 168.714 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 67.0 p -139.45 165.41 27.31 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 125.134 1.373 . . . . 0.0 109.953 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 27.1 p-10 -52.49 -31.33 34.58 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 171.471 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.5 mm100 -67.91 -50.43 56.25 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.775 0.83 . . . . 0.0 111.377 176.935 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.0 mt -65.51 -32.65 74.37 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.736 -0.603 . . . . 0.0 112.519 175.255 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -61.6 -50.63 71.82 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 118.341 0.518 . . . . 0.0 110.77 169.878 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 65.4 t80 -57.61 -41.26 80.91 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.624 0.77 . . . . 0.0 112.313 178.923 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 91.0 mmm -56.91 -50.41 72.65 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 121.886 -0.509 . . . . 0.0 112.115 171.783 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -83.2 -10.07 58.8 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.704 1.372 . . . . 0.0 114.704 -174.532 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 61.9 t30 -119.79 -15.87 8.82 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.196 1.399 . . . . 0.0 113.297 -169.849 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 42.0 t -130.28 -53.56 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 C-N-CA 123.281 0.632 . . . . 0.0 110.96 176.698 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.6 t -69.83 -65.72 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 123.119 0.568 . . . . 0.0 110.77 -172.033 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 79.4 t -57.19 -46.0 84.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 124.398 1.079 . . . . 0.0 110.368 173.02 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.8 tttt -59.84 -40.05 87.19 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.386 0.674 . . . . 0.0 112.734 -175.245 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 62.7 m -73.85 -45.45 50.99 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 118.343 0.52 . . . . 0.0 111.801 174.589 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 67.9 mt -62.03 -33.46 74.41 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.295 0.638 . . . . 0.0 112.388 179.134 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 25.0 t-105 -69.46 -31.26 69.44 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.428 1.491 . . . . 0.0 113.188 175.085 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 56.4 mtmt -82.49 -5.34 58.65 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 113.692 0.997 . . . . 0.0 113.692 176.775 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 39.4 t-80 -64.22 156.38 28.92 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.6 1.16 . . . . 0.0 113.401 -179.023 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 19.2 mm100 -59.69 -23.27 62.98 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.241 1.416 . . . . 0.0 114.104 175.899 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -124.65 20.22 8.6 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.214 1.406 . . . . 0.0 113.48 -172.813 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.64 -26.59 64.49 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.102 1.361 . . . . 0.0 113.958 176.457 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 64.1 p-90 -58.87 -34.16 22.22 Favored Pre-proline 0 CA--C 1.547 0.84 0 N-CA-C 117.875 2.546 . . . . 0.0 117.875 -169.779 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -77.75 -0.18 10.4 Favored 'Trans proline' 0 CA--C 1.544 0.994 0 CA-C-N 123.213 2.183 . . . . 0.0 113.387 175.418 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -114.63 -3.67 12.88 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.759 1.624 . . . . 0.0 113.158 178.182 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 18.4 m-30 -62.68 -7.52 5.0 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 115.276 1.584 . . . . 0.0 115.276 179.443 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 25.1 pt20 -159.66 157.98 26.89 Favored Pre-proline 0 CA--C 1.545 0.773 0 C-N-CA 126.188 1.795 . . . . 0.0 110.009 -169.804 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -66.08 142.25 67.14 Favored 'Trans proline' 0 CA--C 1.538 0.676 0 C-N-CA 122.702 2.268 . . . . 0.0 111.731 177.295 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 68.1 t -60.3 139.0 20.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 123.859 0.864 . . . . 0.0 111.322 173.736 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 50.6 m-20 -114.4 107.09 15.09 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.079 1.352 . . . . 0.0 109.497 169.928 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.32 -26.89 63.59 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.148 0.979 . . . . 0.0 113.419 177.793 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 80.3 mt -66.56 -50.17 68.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 124.979 1.311 . . . . 0.0 110.864 173.655 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -64.56 -40.66 95.98 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.547 1.139 . . . . 0.0 112.695 -178.886 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 47.7 mt -88.78 -0.76 57.63 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.555 1.142 . . . . 0.0 114.007 179.621 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 61.0 t30 52.28 58.07 5.8 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.019 1.728 . . . . 0.0 113.68 -179.427 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 54.2 mt -114.42 83.21 8.32 Favored Pre-proline 0 CA--C 1.547 0.842 0 C-N-CA 126.331 1.852 . . . . 0.0 110.089 -176.074 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -67.79 -7.44 19.53 Favored 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 124.207 3.271 . . . . 0.0 115.456 -169.461 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -130.38 19.04 5.31 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.774 1.63 . . . . 0.0 112.257 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 70.4 t80 -46.96 -56.44 6.39 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.496 1.118 . . . . 0.0 113.526 -173.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -76.23 -3.07 34.44 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 114.608 1.336 . . . . 0.0 114.608 -179.128 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -84.1 -42.0 16.53 Favored 'General case' 0 N--CA 1.477 0.879 0 O-C-N 121.127 -0.983 . . . . 0.0 110.855 173.972 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.2 mp -81.67 -51.04 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 124.103 0.961 . . . . 0.0 110.408 173.686 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.418 HD11 ' HB2' ' A' ' 115' ' ' TYR . 44.2 mm -71.92 114.47 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 CA-C-O 121.556 0.693 . . . . 0.0 110.142 178.864 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 70.6 mmtt -83.85 -27.93 28.37 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.619 1.168 . . . . 0.0 113.045 179.595 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 21.4 p30 -153.16 81.63 5.05 Favored Pre-proline 0 CA--C 1.548 0.866 0 C-N-CA 126.09 1.756 . . . . 0.0 111.326 -170.025 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -69.17 138.11 38.86 Favored 'Trans proline' 0 CA--C 1.54 0.791 0 C-N-CA 123.498 2.799 . . . . 0.0 111.097 -179.126 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.8 tpt -154.59 141.19 18.91 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.236 1.414 . . . . 0.0 110.03 -178.93 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -144.68 148.14 33.87 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.397 1.479 . . . . 0.0 111.139 -177.912 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.6 ttp -57.19 -36.2 70.55 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.903 1.281 . . . . 0.0 113.3 -172.216 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.89 -22.82 60.54 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 125.127 1.346 . . . . 0.0 114.603 173.828 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 24.5 m -97.12 -34.59 11.09 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.846 1.258 . . . . 0.0 111.425 174.229 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 81.4 mt -53.94 -50.93 50.08 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 CA-C-N 119.31 0.959 . . . . 0.0 110.569 173.145 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -61.88 -32.5 72.87 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 178.096 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.432 ' HE3' ' HA ' ' A' ' 88' ' ' LYS . 1.1 tpmt? -68.78 -31.9 71.26 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -175.238 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 3.8 ptp180 -78.08 -26.45 48.17 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 113.941 1.089 . . . . 0.0 113.941 170.041 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 82.2 mt -70.66 -31.45 68.38 Favored 'General case' 0 N--CA 1.481 1.092 0 CA-C-N 119.648 1.113 . . . . 0.0 113.037 168.414 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -68.18 3.61 1.58 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.401 1.48 . . . . 0.0 113.476 171.955 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -130.74 163.18 27.85 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 127.685 2.394 . . . . 0.0 110.484 175.861 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -83.31 37.5 0.56 Allowed 'General case' 0 CA--C 1.55 0.966 0 O-C-N 120.834 -1.166 . . . . 0.0 111.581 169.877 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -60.76 -32.14 71.46 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.088 1.355 . . . . 0.0 114.32 -168.939 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -132.99 175.88 8.98 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 127.602 2.361 . . . . 0.0 111.057 178.199 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 9.7 t-105 -100.95 -25.91 13.92 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.893 1.277 . . . . 0.0 112.886 -178.824 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 34.7 t -143.77 148.64 35.91 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.287 1.035 . . . . 0.0 112.82 -170.482 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -65.36 -18.8 65.6 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 115.991 1.848 . . . . 0.0 115.991 -174.92 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 32.6 t -56.08 -32.48 64.16 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.398 0.999 . . . . 0.0 112.603 178.87 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -63.53 -45.97 88.13 Favored 'General case' 0 CA--C 1.544 0.727 0 O-C-N 121.272 -0.892 . . . . 0.0 112.264 173.499 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 48.8 t -65.28 -37.1 86.13 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.869 0.868 . . . . 0.0 112.602 174.713 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 82.5 mtp -65.65 -40.47 92.51 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.724 0.81 . . . . 0.0 111.881 175.696 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -62.1 -39.8 93.72 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.369 0.668 . . . . 0.0 112.076 170.667 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 85.2 m-20 -64.28 -39.58 94.23 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.366 0.985 . . . . 0.0 112.73 175.728 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -61.01 -46.98 88.54 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.5 -0.75 . . . . 0.0 112.315 170.429 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 17.5 t30 -56.63 -45.25 81.66 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.084 0.553 . . . . 0.0 111.893 174.845 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 52.3 m -62.51 -40.36 96.47 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.381 1.072 . . . . 0.0 112.687 175.571 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 53.1 ttp -59.52 -52.32 66.09 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 119.708 1.14 . . . . 0.0 112.061 177.32 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -68.45 -39.81 81.32 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 179.619 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 85.6 m -64.72 -47.55 77.89 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.588 0.755 . . . . 0.0 112.037 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -64.69 -31.94 73.39 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 119.024 0.829 . . . . 0.0 112.121 -179.551 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 81.3 m -61.66 -43.44 98.86 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.816 0.846 . . . . 0.0 112.794 170.261 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -68.02 -32.2 72.41 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.929 1.085 . . . . 0.0 113.929 178.66 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 92.3 mt -64.38 -57.63 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 C-N-CA 123.471 0.708 . . . . 0.0 110.994 177.21 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' TYR . . . . . 0.418 ' HB2' HD11 ' A' ' 77' ' ' ILE . 31.0 t80 -68.79 -35.94 77.65 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 114.375 1.25 . . . . 0.0 114.375 -172.301 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 64.1 m-80 -103.98 159.84 15.33 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.804 0.841 . . . . 0.0 113.164 -169.22 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 3.4 mppt? -66.0 148.44 98.34 Favored Pre-proline 0 N--CA 1.472 0.667 0 C-N-CA 124.187 0.995 . . . . 0.0 110.523 172.784 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -65.37 -7.8 16.96 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 123.563 2.842 . . . . 0.0 114.567 -177.95 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 69.5 p -115.53 1.79 13.69 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 126.473 1.909 . . . . 0.0 113.108 179.518 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -65.89 143.73 57.26 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 121.491 -0.756 . . . . 0.0 110.509 173.787 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -52.59 -45.62 66.59 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.633 -0.667 . . . . 0.0 112.526 -178.422 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 9.5 tp -56.55 -34.7 42.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 124.637 1.175 . . . . 0.0 113.885 177.91 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 55.7 t -71.49 -42.52 72.71 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 C-N-CA 123.403 0.681 . . . . 0.0 110.65 175.124 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 66.5 mt -62.37 -36.24 81.65 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.099 0.863 . . . . 0.0 111.917 175.196 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -58.11 -53.45 58.11 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 118.298 0.499 . . . . 0.0 110.919 170.597 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -59.39 -41.43 89.35 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 123.745 0.818 . . . . 0.0 112.399 179.314 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -61.16 -39.9 91.84 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.999 0.92 . . . . 0.0 113.12 175.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -79.13 -31.57 44.17 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 85.1 mt -71.02 -46.4 62.2 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.351 0.66 . . . . 0.0 111.297 170.053 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -63.31 -38.04 89.6 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 121.102 -0.999 . . . . 0.0 113.244 -173.694 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 4.9 ptpp? -60.14 -39.36 86.06 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 121.456 -0.778 . . . . 0.0 112.543 175.136 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 78.4 mt -73.18 -41.2 58.53 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 C-N-CA 124.193 0.997 . . . . 0.0 111.518 175.121 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -50.96 -52.14 45.51 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 119.162 0.892 . . . . 0.0 110.438 172.649 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.3 mt -63.63 -40.1 96.03 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 118.558 -0.734 . . . . 0.0 112.909 177.948 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -68.43 -30.56 69.48 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 120.373 1.442 . . . . 0.0 112.657 179.45 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 69.0 mmtt -75.94 -48.19 22.19 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 117.89 -1.052 . . . . 0.0 112.301 176.122 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.9 m -67.84 -25.79 33.33 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 CA-C-N 120.765 1.62 . . . . 0.0 112.04 176.398 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -62.19 -30.53 71.13 Favored 'General case' 0 CA--C 1.541 0.609 0 O-C-N 121.492 -0.755 . . . . 0.0 112.477 171.811 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -91.29 -3.26 57.02 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.062 1.345 . . . . 0.0 112.913 176.606 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 5.9 ttm -57.0 141.2 76.5 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 124.152 0.981 . . . . 0.0 111.271 171.449 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -63.05 144.23 92.31 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 C-N-CA 122.494 2.129 . . . . 0.0 109.911 168.798 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -74.87 -23.46 58.4 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 114.239 1.199 . . . . 0.0 114.239 -179.115 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -100.04 155.25 17.82 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.636 1.574 . . . . 0.0 113.024 -169.755 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -112.79 137.1 51.62 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.962 1.705 . . . . 0.0 111.229 -174.799 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 12.7 p -146.62 141.18 20.69 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 C-N-CA 124.657 1.183 . . . . 0.0 110.735 172.623 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -68.52 134.71 50.47 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.509 1.124 . . . . 0.0 111.074 175.307 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 96.0 mt . . . . . 0 CA--C 1.539 0.546 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 -175.988 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.038 0 N-CA-C 114.474 0.55 . . . . 0.0 114.474 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 -162.9 163.55 26.3 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 127.65 2.38 . . . . 0.0 109.586 170.099 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.8 ttmm -73.0 142.57 47.74 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 122.907 0.483 . . . . 0.0 111.634 177.462 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 82.6 p -138.7 165.16 27.68 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.935 1.694 . . . . 0.0 109.51 -179.765 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 22.2 t30 -51.36 -31.43 22.11 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 114.168 1.173 . . . . 0.0 114.168 174.564 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 69.3 mt-30 -74.84 -48.79 23.23 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.166 -0.959 . . . . 0.0 112.791 174.343 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 89.1 mt -61.95 -31.43 71.77 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 120.331 1.423 . . . . 0.0 112.479 173.881 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.5 tp60 -60.8 -52.67 64.09 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.107 0.963 . . . . 0.0 110.906 170.462 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 83.5 t80 -55.83 -41.95 75.02 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.088 0.955 . . . . 0.0 112.446 176.99 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 87.9 mmm -55.21 -53.99 49.0 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 122.685 0.394 . . . . 0.0 111.267 172.066 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -70.67 -22.93 62.43 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 114.833 1.42 . . . . 0.0 114.833 -178.26 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 18.8 m-80 -108.04 -17.23 14.09 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 115.074 1.509 . . . . 0.0 115.074 -168.467 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.6 t -138.83 -41.08 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 CA-C-N 119.078 0.854 . . . . 0.0 112.036 -176.956 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 11.9 t -71.62 -69.96 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 176.92 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 69.5 t -58.36 -48.63 84.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 126.138 1.775 . . . . 0.0 111.495 177.728 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 70.2 tttt -56.54 -43.43 79.86 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.491 0.716 . . . . 0.0 112.884 -171.223 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 60.4 m -85.28 -34.93 21.81 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.327 0.651 . . . . 0.0 112.455 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 68.6 mt -59.65 -32.85 70.83 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 119.629 1.104 . . . . 0.0 111.712 169.175 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 29.3 t-105 -73.14 -34.41 66.07 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 126.048 1.739 . . . . 0.0 113.162 175.068 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp -76.03 -11.17 59.9 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.554 1.142 . . . . 0.0 113.982 174.643 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 55.7 t-80 -61.23 150.83 33.36 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.168 1.387 . . . . 0.0 113.181 -178.188 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -60.37 -20.94 61.41 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.014 1.326 . . . . 0.0 113.727 178.357 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -116.06 16.81 16.01 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.535 1.534 . . . . 0.0 113.643 -178.674 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.67 -29.85 65.06 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 113.979 1.103 . . . . 0.0 113.979 177.745 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 68.1 p-90 -57.67 -34.05 22.65 Favored Pre-proline 0 CA--C 1.548 0.9 0 N-CA-C 118.019 2.6 . . . . 0.0 118.019 -170.334 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -75.51 -4.78 15.75 Favored 'Trans proline' 0 CA--C 1.543 0.966 0 CA-C-N 123.598 2.321 . . . . 0.0 113.408 174.739 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -108.16 -4.52 17.59 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.38 1.472 . . . . 0.0 112.968 178.195 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.7 m-30 -64.47 -17.89 64.27 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 114.011 1.115 . . . . 0.0 114.011 179.238 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 7.7 mp0 -139.36 155.06 72.31 Favored Pre-proline 0 CA--C 1.544 0.747 0 C-N-CA 125.726 1.611 . . . . 0.0 110.203 -176.612 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -65.68 141.56 66.77 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 122.252 1.968 . . . . 0.0 111.888 174.434 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 50.7 t -56.93 145.54 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 124.561 1.144 . . . . 0.0 111.627 172.615 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -121.64 120.57 35.13 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 124.55 1.14 . . . . 0.0 110.049 169.708 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.55 -31.28 70.39 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 123.2 0.6 . . . . 0.0 112.59 178.239 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 81.8 mt -67.37 -49.69 69.38 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 C-N-CA 124.525 1.13 . . . . 0.0 110.923 173.552 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm -64.34 -39.35 93.72 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.219 1.408 . . . . 0.0 113.445 -176.296 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.4 mp -90.93 0.57 57.48 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.249 1.02 . . . . 0.0 113.058 177.233 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 65.9 t30 54.18 53.91 10.33 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 126.001 1.721 . . . . 0.0 113.636 -179.282 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 52.6 mt -111.51 95.31 26.39 Favored Pre-proline 0 CA--C 1.546 0.797 0 C-N-CA 126.415 1.886 . . . . 0.0 110.212 -174.953 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -68.92 -8.37 23.33 Favored 'Trans proline' 0 CA--C 1.544 1.022 0 C-N-CA 123.455 2.77 . . . . 0.0 114.632 -174.001 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -138.41 21.39 2.75 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 125.569 1.548 . . . . 0.0 112.881 -174.76 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 47.5 t80 -50.61 -55.13 17.73 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 120.44 -1.413 . . . . 0.0 113.484 -174.367 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -76.7 -10.56 59.47 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.692 1.197 . . . . 0.0 114.208 -179.154 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.3 mmmm -72.93 -44.33 61.32 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.404 1.082 . . . . 0.0 110.117 176.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.4 mp -81.41 -52.4 13.97 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 123.963 0.905 . . . . 0.0 110.075 172.542 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 20.5 mm -81.43 104.89 10.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 CA-C-O 122.183 0.992 . . . . 0.0 111.629 -176.715 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 69.8 mmtt -69.7 -35.09 74.78 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.856 1.662 . . . . 0.0 113.603 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 70.5 m-80 -143.1 94.34 6.35 Favored Pre-proline 0 CA--C 1.545 0.776 0 C-N-CA 125.79 1.636 . . . . 0.0 110.013 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -70.67 149.21 60.71 Favored 'Trans proline' 0 CA--C 1.538 0.721 0 C-N-CA 123.141 2.561 . . . . 0.0 111.103 178.161 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -153.93 136.06 14.77 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.434 1.094 . . . . 0.0 110.182 -174.596 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -143.82 148.98 36.32 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.56 1.944 . . . . 0.0 110.815 177.982 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.6 ttp -57.94 -34.31 69.76 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.797 1.239 . . . . 0.0 113.043 -171.469 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -56.87 -27.6 56.53 Favored Glycine 0 CA--C 1.532 1.145 0 C-N-CA 125.375 1.464 . . . . 0.0 114.394 173.801 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 43.7 m -78.38 -45.92 21.23 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 118.032 0.916 . . . . 0.0 110.878 169.681 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.9 mt -55.82 -53.76 34.01 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 C-N-CA 125.076 1.35 . . . . 0.0 111.754 -175.142 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 4.8 ptpt -54.15 -38.2 65.26 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 174.069 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.548 ' HA ' ' HE2' ' A' ' 88' ' ' LYS . 0.2 OUTLIER -71.03 -39.31 72.41 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.156 0.982 . . . . 0.0 113.179 -176.996 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 12.4 ptp180 -72.43 -32.34 66.23 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 113.683 0.994 . . . . 0.0 113.683 172.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 53.2 mt -61.19 -43.54 98.71 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.416 0.686 . . . . 0.0 112.821 169.158 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -59.63 -39.37 84.1 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 -176.138 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -108.55 17.21 22.26 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 -171.23 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 27.1 m-20 54.79 59.72 3.92 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.467 1.907 . . . . 0.0 114.159 174.785 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 76.6 t80 -63.55 -20.5 65.69 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.401 1.08 . . . . 0.0 113.588 178.982 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -145.06 177.48 8.74 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 129.483 3.113 . . . . 0.0 110.768 -173.62 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.7 t-105 -104.47 -27.5 11.88 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.264 1.026 . . . . 0.0 112.843 174.818 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 20.2 m -126.15 138.62 53.68 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.078 0.951 . . . . 0.0 113.273 -168.627 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -65.52 -19.74 66.05 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 115.939 1.829 . . . . 0.0 115.939 -175.312 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 16.8 m -56.55 -28.0 59.05 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.179 0.9 . . . . 0.0 112.826 173.867 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 56.5 mm-40 -70.35 -43.72 69.61 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.629 0.771 . . . . 0.0 112.03 173.975 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 42.8 t -62.51 -36.41 82.46 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 121.437 -0.789 . . . . 0.0 112.46 172.816 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 79.0 mtp -63.64 -40.04 95.87 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 121.392 -0.818 . . . . 0.0 112.36 175.099 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.06 -32.01 73.28 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.262 0.625 . . . . 0.0 112.144 174.923 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -72.85 -42.45 63.71 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.505 0.722 . . . . 0.0 111.554 178.087 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 -59.49 -46.28 89.26 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 118.546 0.612 . . . . 0.0 112.148 169.829 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 24.5 t30 -56.84 -44.51 82.17 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.02 0.528 . . . . 0.0 112.054 174.221 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 36.8 m -66.54 -36.41 82.6 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.852 0.861 . . . . 0.0 112.265 178.174 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 48.5 ttp -61.62 -55.47 30.25 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.27 -0.894 . . . . 0.0 112.083 174.933 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -65.72 -38.66 89.79 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 122.039 -0.413 . . . . 0.0 111.845 -179.744 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 91.8 m -66.0 -46.3 78.47 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 121.572 -0.705 . . . . 0.0 112.46 178.9 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.1 p30 -63.79 -31.64 72.88 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 120.117 1.326 . . . . 0.0 112.315 178.948 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 33.4 m -59.78 -47.51 85.39 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 118.917 -0.563 . . . . 0.0 112.047 169.089 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -68.51 -31.06 70.04 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 114.048 1.129 . . . . 0.0 114.048 179.463 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 88.2 mt -67.78 -59.3 3.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 123.304 0.642 . . . . 0.0 110.607 175.195 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 32.2 t80 -71.79 -35.15 69.9 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 114.023 1.119 . . . . 0.0 114.023 -171.516 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -105.8 155.09 19.64 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.334 1.053 . . . . 0.0 111.64 -172.308 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -72.91 154.04 91.0 Favored Pre-proline 0 N--CA 1.471 0.609 0 C-N-CA 124.304 1.041 . . . . 0.0 110.429 178.215 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -64.78 -0.82 3.45 Favored 'Trans proline' 0 CA--C 1.545 1.05 0 C-N-CA 123.748 2.965 . . . . 0.0 114.883 -179.6 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 64.5 p -116.31 -2.58 12.08 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 126.999 2.12 . . . . 0.0 113.134 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 62.4 m-20 -71.51 143.21 50.06 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 119.08 0.854 . . . . 0.0 110.449 171.342 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -56.05 -47.34 78.09 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 121.538 -0.726 . . . . 0.0 112.373 -175.821 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.5 tp -52.34 -30.91 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 125.201 1.4 . . . . 0.0 114.332 177.029 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 52.4 t -74.05 -47.19 43.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 O-C-N 121.569 -0.707 . . . . 0.0 110.809 174.581 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 76.1 mt -61.48 -37.35 83.32 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 119.237 0.926 . . . . 0.0 111.66 177.105 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 7.8 mtp -60.13 -50.77 72.36 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.506 1.523 . . . . 0.0 111.999 170.136 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.91 -39.68 90.27 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.55 0.74 . . . . 0.0 112.824 175.767 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 88.9 mt-30 -60.83 -48.53 81.4 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 119.413 1.006 . . . . 0.0 111.823 173.853 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -61.19 -42.64 98.94 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.512 0.725 . . . . 0.0 112.671 178.428 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 86.7 mt -66.02 -45.84 80.04 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.607 0.763 . . . . 0.0 112.067 173.381 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -64.43 -39.65 94.24 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 121.054 -1.028 . . . . 0.0 112.621 -176.367 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 5.2 mtpm? -56.3 -36.98 69.27 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 121.529 -0.732 . . . . 0.0 112.041 175.038 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 68.4 mt -75.24 -46.65 38.15 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 123.627 0.771 . . . . 0.0 111.073 173.764 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 43.9 t80 -49.25 -48.22 45.92 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 119.933 1.242 . . . . 0.0 111.771 174.768 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.3 mt -65.43 -38.89 91.25 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.32 -0.862 . . . . 0.0 113.046 178.13 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -67.6 -29.37 68.69 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 119.97 1.259 . . . . 0.0 112.376 176.699 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 28.7 mmtp -75.53 -49.98 17.05 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.25 1.42 . . . . 0.0 112.577 178.624 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 7.1 m -69.84 -25.41 28.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 119.289 0.949 . . . . 0.0 111.736 178.163 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -61.65 -29.81 70.31 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.665 -0.647 . . . . 0.0 112.453 170.157 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -96.96 1.26 50.14 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.595 1.558 . . . . 0.0 112.626 177.268 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 8.4 ttm -54.13 139.67 54.51 Favored Pre-proline 0 CA--C 1.544 0.725 0 C-N-CA 124.271 1.028 . . . . 0.0 111.306 172.226 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -66.51 117.95 5.14 Favored 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 122.463 2.109 . . . . 0.0 108.568 169.159 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 -65.64 -28.49 69.15 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 -173.044 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -83.75 164.4 19.61 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.135 1.774 . . . . 0.0 111.953 172.138 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -132.24 143.22 49.77 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.111 0.964 . . . . 0.0 111.731 -175.916 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 55.0 t -130.69 133.29 63.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 125.504 1.521 . . . . 0.0 110.371 -176.243 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -68.07 117.05 9.41 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.68 1.592 . . . . 0.0 111.221 170.59 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 80.6 mt . . . . . 0 N--CA 1.472 0.654 0 N-CA-C 113.245 0.831 . . . . 0.0 113.245 -178.32 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.975 0 CA-C-O 121.053 0.252 . . . . 0.0 113.24 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 37.8 ptt180 -159.17 160.47 35.53 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.91 1.684 . . . . 0.0 110.982 175.576 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 22.5 ptmt -70.87 132.85 45.89 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.584 0.753 . . . . 0.0 110.837 169.408 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 77.4 p -140.62 161.59 37.39 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 125.076 1.35 . . . . 0.0 111.38 -177.087 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 26.5 p-10 -48.99 -38.94 24.71 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 114.066 1.135 . . . . 0.0 114.066 170.649 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -69.7 -51.22 36.39 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.65 0.78 . . . . 0.0 111.557 178.922 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.5 mt -65.73 -30.18 70.81 Favored 'General case' 0 CA--C 1.54 0.582 0 O-C-N 121.652 -0.655 . . . . 0.0 112.36 177.423 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 44.7 tt0 -60.8 -52.54 64.66 Favored 'General case' 0 C--O 1.224 -0.268 0 C-N-CA 123.427 0.691 . . . . 0.0 110.237 169.056 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -56.25 -42.18 76.96 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 118.836 0.744 . . . . 0.0 112.15 179.14 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 96.5 mmm -55.98 -50.71 70.06 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 172.684 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -84.44 -11.5 56.09 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -174.43 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 66.6 t30 -117.19 -18.86 9.88 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.55 1.54 . . . . 0.0 112.872 -170.277 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 6.0 t -133.6 -49.67 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 C-N-CA 123.606 0.762 . . . . 0.0 111.869 -177.62 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 22.3 t -69.28 -64.22 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 CA-C-N 119.095 0.861 . . . . 0.0 110.794 -176.76 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 45.0 t -53.83 -50.07 54.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 124.864 1.265 . . . . 0.0 109.841 171.402 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.3 tppt? -60.74 -26.35 67.13 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 -174.095 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 21.0 m -98.66 -39.65 8.57 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-N 118.948 0.795 . . . . 0.0 112.429 177.236 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 80.7 mt -59.0 -30.14 67.77 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.485 -0.759 . . . . 0.0 112.121 171.816 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' TRP . . . . . 0.429 ' CE3' ' HD3' ' A' ' 87' ' ' LYS . 27.5 t-105 -75.56 -39.22 58.47 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 114.826 1.417 . . . . 0.0 114.826 179.061 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 8.9 ptpp? -76.62 -10.42 59.38 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 177.116 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 60.3 t-80 -54.74 152.5 7.03 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.073 1.749 . . . . 0.0 113.456 -178.79 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 58.9 mt-30 -54.37 -25.57 25.11 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.813 1.645 . . . . 0.0 114.437 177.671 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -125.19 18.62 8.33 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.041 1.337 . . . . 0.0 113.705 -172.783 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.13 -24.85 63.25 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.391 1.476 . . . . 0.0 114.177 176.17 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 64.6 p-90 -58.14 -33.42 17.74 Favored Pre-proline 0 CA--C 1.547 0.851 0 N-CA-C 117.592 2.441 . . . . 0.0 117.592 -170.356 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -81.27 2.29 8.68 Favored 'Trans proline' 0 CA--C 1.547 1.133 0 CA-C-N 123.041 2.122 . . . . 0.0 113.237 175.643 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -113.38 -5.29 13.55 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.493 1.517 . . . . 0.0 113.572 178.858 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 23.4 m-30 -64.19 -17.99 64.06 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 119.848 1.204 . . . . 0.0 113.952 177.8 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -144.03 158.31 55.8 Favored Pre-proline 0 CA--C 1.546 0.819 0 C-N-CA 126.55 1.94 . . . . 0.0 110.625 -176.504 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -67.48 159.5 52.18 Favored 'Trans proline' 0 CA--C 1.537 0.635 0 C-N-CA 123.061 2.507 . . . . 0.0 112.476 172.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 60.1 t -70.86 107.08 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 123.85 0.86 . . . . 0.0 109.458 170.066 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 -72.39 79.95 1.03 Allowed 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.282 1.033 . . . . 0.0 110.517 169.97 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -51.16 -27.72 9.35 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.917 1.287 . . . . 0.0 114.348 -177.731 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 85.2 mt -64.0 -48.38 86.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 125.592 1.557 . . . . 0.0 111.566 172.136 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -75.96 -39.83 55.23 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.57 1.548 . . . . 0.0 112.899 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -74.74 -9.65 58.77 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.874 1.67 . . . . 0.0 113.094 176.085 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 57.75 55.0 5.77 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.426 1.891 . . . . 0.0 112.527 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 55.8 mt -116.1 78.96 8.07 Favored Pre-proline 0 CA--C 1.543 0.706 0 C-N-CA 126.241 1.816 . . . . 0.0 110.703 -178.444 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -66.87 -16.67 50.56 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 123.302 2.668 . . . . 0.0 112.999 -179.166 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 -100.96 7.54 43.5 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.903 1.681 . . . . 0.0 113.103 175.954 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 79.0 t80 -52.75 -56.48 15.34 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 120.462 -1.399 . . . . 0.0 112.398 -176.506 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -74.07 -15.08 61.08 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.776 1.23 . . . . 0.0 114.128 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 9.9 mptt -69.92 -31.88 69.88 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.042 0.937 . . . . 0.0 111.592 177.251 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.4 mp -102.05 -45.2 10.81 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 125.688 1.595 . . . . 0.0 111.27 176.077 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.599 HD11 ' HB2' ' A' ' 115' ' ' TYR . 34.4 mm -76.42 101.68 2.86 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 121.929 0.871 . . . . 0.0 111.151 179.006 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.68 -40.72 95.89 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.747 1.619 . . . . 0.0 112.983 172.026 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -144.22 98.77 5.05 Favored Pre-proline 0 CA--C 1.545 0.766 0 C-N-CA 125.347 1.459 . . . . 0.0 110.575 -176.362 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -74.49 147.31 36.16 Favored 'Trans proline' 0 CA--C 1.539 0.773 0 C-N-CA 123.206 2.604 . . . . 0.0 111.083 175.361 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.3 tpt -155.68 148.26 23.98 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.832 1.253 . . . . 0.0 110.557 178.785 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -147.46 154.45 40.81 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 125.686 1.595 . . . . 0.0 111.368 179.679 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.5 ttp -62.03 -36.96 83.14 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 123.856 0.862 . . . . 0.0 112.563 -171.628 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -56.11 -49.11 69.5 Favored Glycine 0 CA--C 1.532 1.142 0 C-N-CA 124.242 0.925 . . . . 0.0 112.615 177.198 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 85.2 m -69.67 -33.71 72.96 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 117.661 -1.161 . . . . 0.0 112.648 174.7 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 97.7 mt -56.56 -49.54 77.2 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 CA-C-N 120.663 1.574 . . . . 0.0 110.826 172.47 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.429 ' HD3' ' CE3' ' A' ' 51' ' ' TRP . 0.4 OUTLIER -60.35 -35.36 75.5 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 118.698 0.681 . . . . 0.0 112.511 174.941 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.452 ' HE3' ' HA ' ' A' ' 88' ' ' LYS . 1.4 tpmt? -65.73 -41.9 91.69 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 -179.874 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 13.3 ptp180 -67.68 -24.08 65.38 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 173.265 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 74.8 mt -75.66 -39.06 58.24 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 167.724 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -63.05 -27.26 69.28 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 114.845 1.424 . . . . 0.0 114.845 -176.631 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -137.04 136.28 38.27 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.907 1.683 . . . . 0.0 110.642 -179.312 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 -51.99 134.4 32.0 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.227 1.411 . . . . 0.0 113.81 -169.453 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 44.1 t80 -155.54 -34.48 0.09 Allowed 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.588 1.555 . . . . 0.0 112.981 179.109 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -134.86 176.79 8.33 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.234 1.414 . . . . 0.0 112.045 179.127 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 12.0 t-105 -115.16 -21.1 10.13 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.114 1.365 . . . . 0.0 113.31 -169.693 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 44.3 t -144.63 151.53 39.14 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 125.489 1.516 . . . . 0.0 111.207 -178.838 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -58.56 -22.55 56.13 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 115.572 1.693 . . . . 0.0 115.572 -177.79 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 39.5 m -54.8 -31.52 59.11 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 -179.044 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -68.87 -46.07 69.37 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 121.374 -0.829 . . . . 0.0 112.17 173.959 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 46.4 t -63.75 -36.34 83.54 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.515 1.126 . . . . 0.0 112.354 177.433 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 81.6 mtp -58.67 -40.56 83.89 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 123.93 0.892 . . . . 0.0 112.535 174.007 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -66.68 -32.57 73.98 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 174.314 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 -69.36 -39.29 78.17 Favored 'General case' 0 CA--C 1.541 0.634 0 O-C-N 120.98 -1.075 . . . . 0.0 111.759 173.986 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -60.35 -47.13 87.36 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.446 -0.784 . . . . 0.0 112.145 169.442 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -60.19 -41.08 92.16 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 121.665 -0.647 . . . . 0.0 111.429 175.4 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 86.0 m -62.31 -40.14 95.35 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.764 0.826 . . . . 0.0 111.756 177.662 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 48.0 ttp -59.64 -50.75 72.67 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.481 0.713 . . . . 0.0 112.305 175.431 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -71.08 -41.67 70.38 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -179.532 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 41.7 m -64.97 -46.75 80.17 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 121.358 -0.839 . . . . 0.0 112.09 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -63.23 -32.83 74.33 Favored 'General case' 0 CA--C 1.547 0.854 0 CA-C-N 119.585 1.084 . . . . 0.0 112.004 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 67.4 m -61.06 -43.23 99.2 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.904 0.882 . . . . 0.0 113.136 170.21 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 17.9 m-85 -67.52 -31.91 72.35 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 177.584 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 87.3 mt -68.18 -56.06 14.11 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.825 0 C-N-CA 123.266 0.626 . . . . 0.0 110.785 177.622 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' TYR . . . . . 0.599 ' HB2' HD11 ' A' ' 77' ' ' ILE . 34.5 t80 -69.41 -36.79 77.06 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 114.389 1.255 . . . . 0.0 114.389 -172.296 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 60.1 m-80 -101.01 158.71 15.8 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.245 1.018 . . . . 0.0 111.872 -172.612 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 3.7 mptp? -70.35 151.07 95.81 Favored Pre-proline 0 N--CA 1.47 0.568 0 C-N-CA 123.822 0.849 . . . . 0.0 109.671 174.517 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -65.45 -1.03 4.14 Favored 'Trans proline' 0 CA--C 1.546 1.076 0 C-N-CA 123.714 2.943 . . . . 0.0 114.725 -179.183 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 52.6 p -119.96 -2.19 10.32 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 127.266 2.226 . . . . 0.0 113.207 -179.431 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -67.44 145.54 54.91 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 118.837 0.744 . . . . 0.0 110.545 169.64 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -58.01 -40.89 81.93 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 121.561 -0.712 . . . . 0.0 112.386 -173.766 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 9.9 tp -55.59 -35.73 39.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 125.517 1.527 . . . . 0.0 113.877 178.823 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 46.4 t -67.35 -44.79 86.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 123.216 0.606 . . . . 0.0 110.456 174.825 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 53.0 mt -62.66 -36.17 82.0 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 118.588 0.631 . . . . 0.0 111.774 177.539 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 1.1 mmt -58.93 -52.16 66.94 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 122.765 0.426 . . . . 0.0 111.27 170.764 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -62.06 -38.82 90.21 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.459 0.703 . . . . 0.0 112.307 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -60.17 -47.48 85.75 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 119.227 0.921 . . . . 0.0 112.2 173.639 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -63.83 -44.56 92.84 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.437 0.695 . . . . 0.0 112.617 178.081 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 92.5 mt -65.91 -44.86 83.96 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.927 0.891 . . . . 0.0 112.135 176.541 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -63.26 -39.17 93.84 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 119.374 0.988 . . . . 0.0 112.615 -176.71 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -58.82 -40.86 85.39 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 121.381 -0.824 . . . . 0.0 112.107 175.065 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 85.0 mt -72.7 -41.78 62.29 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 123.624 0.77 . . . . 0.0 111.209 175.962 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -51.96 -51.39 57.42 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.891 0.768 . . . . 0.0 110.68 173.354 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 99.0 mt -62.58 -40.89 98.3 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.327 0.651 . . . . 0.0 112.665 177.841 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.73 -35.38 80.87 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 119.634 1.106 . . . . 0.0 112.729 176.498 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 71.0 mmtt -70.47 -52.87 19.0 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.748 1.219 . . . . 0.0 111.885 177.209 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 6.4 m -66.53 -24.12 32.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 CA-C-N 120.09 1.314 . . . . 0.0 112.313 179.211 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -64.79 -35.11 80.05 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.769 -0.582 . . . . 0.0 112.364 170.526 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -81.8 -16.72 50.01 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.372 1.069 . . . . 0.0 112.904 173.027 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 49.3 ttp -63.68 137.73 97.18 Favored Pre-proline 0 CA--C 1.546 0.818 0 CA-C-N 119.266 0.939 . . . . 0.0 110.937 174.97 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -68.48 136.23 35.98 Favored 'Trans proline' 0 CA--C 1.536 0.605 0 C-N-CA 122.786 2.324 . . . . 0.0 111.73 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -74.6 -22.95 58.68 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.216 1.006 . . . . 0.0 112.797 175.53 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -77.16 156.37 31.65 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.251 1.42 . . . . 0.0 111.783 173.903 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -126.58 135.78 51.69 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.377 1.471 . . . . 0.0 110.795 -174.723 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 12.7 p -148.22 140.32 18.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 C-N-CA 124.668 1.187 . . . . 0.0 110.946 174.387 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -70.15 132.32 45.62 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.5 1.12 . . . . 0.0 111.045 174.383 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 77.6 mt . . . . . 0 N--CA 1.471 0.599 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 -175.765 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.85 0 CA-C-O 122.252 0.918 . . . . 0.0 115.094 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 8.8 ptp180 -164.33 162.87 22.56 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 128.403 2.681 . . . . 0.0 108.724 173.566 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 50.5 tttt -73.51 124.38 25.75 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 168.283 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 62.6 p -122.26 165.76 15.7 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 125.043 1.337 . . . . 0.0 110.743 -176.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -50.33 -35.19 26.6 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.424 1.09 . . . . 0.0 113.589 171.385 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -70.76 -49.38 47.4 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 121.512 -0.743 . . . . 0.0 112.11 176.662 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.5 mt -64.2 -32.58 74.22 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 121.676 -0.64 . . . . 0.0 112.275 175.829 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 8.6 tp60 -60.51 -50.83 72.0 Favored 'General case' 0 C--O 1.223 -0.335 0 CA-C-O 118.47 -0.776 . . . . 0.0 110.434 170.036 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 60.9 t80 -56.83 -43.87 81.49 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.809 1.186 . . . . 0.0 112.269 177.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 93.3 mmm -55.08 -52.2 63.96 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 122.946 0.498 . . . . 0.0 112.083 172.911 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 -72.48 -30.95 64.99 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 -177.741 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -91.56 -25.87 19.01 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.429 1.492 . . . . 0.0 113.271 -168.428 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 34.3 t -128.4 -52.18 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 C-N-CA 123.224 0.61 . . . . 0.0 111.443 -176.312 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 16.3 t -69.85 -65.87 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 C-N-CA 123.624 0.769 . . . . 0.0 110.468 -171.336 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 48.8 t -54.21 -49.74 60.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 C-N-CA 125.624 1.57 . . . . 0.0 110.13 173.067 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -53.33 -52.65 58.5 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 118.824 -0.608 . . . . 0.0 111.63 -177.568 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 25.4 m -70.91 -40.16 72.32 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 118.576 0.625 . . . . 0.0 112.407 -178.429 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 62.7 mt -59.67 -29.59 68.16 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 118.682 0.674 . . . . 0.0 112.141 172.788 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' TRP . . . . . 0.465 ' CZ3' ' HE3' ' A' ' 87' ' ' LYS . 26.8 t-105 -79.83 -33.88 39.89 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.902 1.681 . . . . 0.0 114.234 179.209 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 15.4 ptmt -80.05 -9.51 59.7 Favored 'General case' 0 N--CA 1.483 1.193 0 CA-C-N 119.968 1.258 . . . . 0.0 114.166 174.587 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 50.1 t-80 -55.42 151.57 9.96 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.771 1.628 . . . . 0.0 113.519 177.664 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.62 -17.38 21.63 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.765 1.626 . . . . 0.0 114.442 176.76 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -125.85 17.04 8.01 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.48 1.512 . . . . 0.0 114.043 -173.784 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.32 -29.97 65.65 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 177.263 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' TRP . . . . . 0.409 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 41.5 p-90 -54.84 -36.98 50.77 Favored Pre-proline 0 CA--C 1.549 0.919 0 N-CA-C 117.543 2.423 . . . . 0.0 117.543 -171.896 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.409 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 73.1 Cg_endo -70.53 -3.03 11.69 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 CA-C-N 123.187 2.174 . . . . 0.0 114.7 173.136 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 -115.78 -3.25 12.24 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.345 1.458 . . . . 0.0 113.363 178.574 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -63.64 -27.45 69.24 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 119.511 1.051 . . . . 0.0 113.435 178.577 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -138.16 153.83 73.54 Favored Pre-proline 0 CA--C 1.542 0.652 0 C-N-CA 126.138 1.775 . . . . 0.0 110.003 -173.119 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -66.3 141.21 61.5 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 C-N-CA 122.416 2.077 . . . . 0.0 113.308 -175.316 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 54.5 t -57.08 136.23 20.28 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 124.716 1.206 . . . . 0.0 110.432 169.42 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -127.95 101.48 6.34 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 125.304 1.442 . . . . 0.0 109.983 178.635 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.0 -30.06 61.26 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.499 1.12 . . . . 0.0 113.924 -179.387 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 83.6 mt -67.77 -48.84 74.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 125.02 1.328 . . . . 0.0 111.109 175.085 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -66.21 -37.54 85.82 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.945 1.298 . . . . 0.0 112.96 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 72.3 mt -95.24 0.55 54.03 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.335 1.854 . . . . 0.0 113.103 -174.302 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 51.6 57.5 6.5 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.914 1.686 . . . . 0.0 113.036 -179.073 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 36.8 mt -113.92 78.24 4.06 Favored Pre-proline 0 CA--C 1.546 0.815 0 C-N-CA 126.042 1.737 . . . . 0.0 110.021 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -66.56 -7.34 17.62 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 124.387 3.392 . . . . 0.0 115.292 -169.421 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -130.71 17.79 5.22 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.942 1.697 . . . . 0.0 112.204 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 69.8 t80 -46.55 -54.61 9.03 Favored 'General case' 0 N--CA 1.476 0.849 0 O-C-N 120.997 -1.064 . . . . 0.0 113.486 -174.213 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -76.24 -8.88 58.03 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.013 1.325 . . . . 0.0 114.477 -179.312 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.1 mmmp? -77.86 -39.13 44.36 Favored 'General case' 0 N--CA 1.476 0.857 0 O-C-N 121.214 -0.929 . . . . 0.0 110.866 173.626 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.3 mp -82.61 -50.38 15.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 124.219 1.007 . . . . 0.0 110.565 174.026 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.593 HD11 ' HB2' ' A' ' 115' ' ' TYR . 34.4 mm -76.87 109.08 10.88 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.625 0 C-N-CA 123.642 0.777 . . . . 0.0 111.319 -178.257 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.22 -40.24 93.24 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.506 1.123 . . . . 0.0 112.464 171.364 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -154.44 106.18 2.39 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 125.98 1.712 . . . . 0.0 110.905 -172.677 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -76.71 163.26 31.81 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 123.6 2.867 . . . . 0.0 111.934 178.007 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.406 ' HE2' ' H ' ' A' ' 82' ' ' ASP . 0.0 OUTLIER -158.19 153.14 25.24 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.954 0.901 . . . . 0.0 111.981 175.025 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.406 ' H ' ' HE2' ' A' ' 81' ' ' MET . 10.8 m-20 -153.19 132.32 12.65 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 126.906 2.082 . . . . 0.0 110.566 -171.971 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 7.2 ttp -59.82 -36.2 76.29 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.254 1.022 . . . . 0.0 113.37 -172.032 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -58.15 -24.85 56.0 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 124.662 1.125 . . . . 0.0 114.503 175.06 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 91.2 m -94.25 -17.44 22.66 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.267 1.427 . . . . 0.0 112.524 178.158 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.5 mt -72.43 -52.86 21.51 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 O-C-N 120.803 -1.185 . . . . 0.0 110.302 170.577 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.465 ' HE3' ' CZ3' ' A' ' 51' ' ' TRP . 16.6 ptpt -57.8 -29.0 64.54 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -178.56 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 3.0 tppp? -66.8 -45.35 78.65 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.98 1.312 . . . . 0.0 112.697 -177.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 1.4 ptt180 -77.55 -27.7 51.62 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.169 0.987 . . . . 0.0 113.009 178.25 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 64.6 mt -60.98 -34.15 74.33 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 168.916 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -73.12 -38.85 66.17 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 118.864 0.756 . . . . 0.0 112.362 173.809 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -69.8 178.13 2.76 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 125.261 1.425 . . . . 0.0 112.896 171.071 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 41.5 p-10 -99.12 34.2 2.19 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.832 2.053 . . . . 0.0 111.936 174.284 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 65.5 t80 -63.87 -36.32 83.54 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.409 1.084 . . . . 0.0 113.696 -169.232 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -136.63 -177.99 4.98 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 128.184 2.594 . . . . 0.0 110.78 177.551 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 7.4 t-105 -115.0 -29.91 6.54 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.984 1.314 . . . . 0.0 112.464 -178.13 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 54.3 m -132.17 141.24 49.02 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.062 0.945 . . . . 0.0 112.665 -168.954 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -63.45 -16.63 61.15 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 115.943 1.831 . . . . 0.0 115.943 -173.52 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 14.7 m -55.32 -30.85 61.01 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.969 0.907 . . . . 0.0 112.989 175.012 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -65.49 -50.52 65.01 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 121.544 -0.723 . . . . 0.0 111.332 173.283 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 53.2 t -59.96 -37.74 80.44 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.25 1.02 . . . . 0.0 112.567 175.396 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 85.5 mtp -62.01 -42.68 99.42 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 121.184 -0.947 . . . . 0.0 112.393 173.318 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -64.95 -35.93 82.76 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 112.702 0.63 . . . . 0.0 112.702 173.425 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 55.8 m-20 -61.37 -48.02 83.17 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.487 1.039 . . . . 0.0 112.084 172.372 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -60.79 -43.71 97.76 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.622 -0.674 . . . . 0.0 112.767 174.573 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 18.1 t30 -55.2 -52.11 64.4 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.113 0.565 . . . . 0.0 111.526 173.729 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 96.5 m -61.01 -35.99 78.31 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.748 0.819 . . . . 0.0 112.737 177.546 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 27.7 ttp -61.3 -49.9 75.17 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 119.421 1.009 . . . . 0.0 112.554 176.573 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -70.9 -42.29 70.17 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 179.428 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 62.5 m -63.86 -46.76 83.54 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.764 0.825 . . . . 0.0 112.664 179.629 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -64.38 -33.78 76.65 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 119.852 1.206 . . . . 0.0 112.108 -179.296 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 19.2 m -59.15 -41.72 89.01 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.76 0.824 . . . . 0.0 112.989 169.522 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -68.73 -29.39 67.8 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 177.787 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 87.5 mt -69.12 -56.69 11.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 123.383 0.673 . . . . 0.0 110.986 176.063 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' TYR . . . . . 0.593 ' HB2' HD11 ' A' ' 77' ' ' ILE . 33.7 t80 -67.9 -31.51 71.34 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 114.577 1.325 . . . . 0.0 114.577 -173.167 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 60.8 m-80 -110.18 160.43 16.5 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.474 1.11 . . . . 0.0 112.053 -170.332 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 49.0 mmtm -72.18 152.14 92.46 Favored Pre-proline 0 N--CA 1.474 0.752 0 O-C-N 121.499 -0.75 . . . . 0.0 110.343 172.363 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -65.74 -1.24 4.68 Favored 'Trans proline' 0 CA--C 1.545 1.042 0 C-N-CA 123.676 2.917 . . . . 0.0 115.043 -177.461 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 67.7 p -119.01 -0.59 11.11 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.663 1.985 . . . . 0.0 113.126 -179.429 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -68.45 146.5 53.12 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 118.794 0.724 . . . . 0.0 110.68 170.344 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -55.39 -49.53 72.09 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 121.681 -0.637 . . . . 0.0 112.209 -175.562 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.5 tp -51.99 -31.12 13.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 125.232 1.413 . . . . 0.0 114.54 177.921 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 55.2 t -73.84 -48.96 37.23 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 O-C-N 121.541 -0.725 . . . . 0.0 110.719 174.174 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 77.2 mt -61.33 -37.4 83.14 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 119.124 0.875 . . . . 0.0 111.848 177.806 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 10.6 mtp -57.91 -52.62 64.72 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.869 1.668 . . . . 0.0 111.918 169.801 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.43 -39.23 90.02 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 113.04 0.755 . . . . 0.0 113.04 176.164 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' GLN . . . . . 0.428 ' O ' ' HE2' ' A' ' 131' ' ' LYS . 89.4 mt-30 -61.55 -47.79 83.96 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 119.312 0.96 . . . . 0.0 112.012 174.342 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.34 -40.44 96.38 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.698 -0.626 . . . . 0.0 112.514 177.885 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 82.6 mt -65.37 -44.73 86.7 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.436 0.694 . . . . 0.0 111.904 172.812 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -59.34 -48.09 82.95 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.343 0.974 . . . . 0.0 113.173 -175.093 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.428 ' HE2' ' O ' ' A' ' 127' ' ' GLN . 1.1 mppt? -60.45 -32.83 71.76 Favored 'General case' 0 CA--C 1.533 0.31 0 O-C-N 120.947 -1.096 . . . . 0.0 113.693 176.646 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 73.8 mt -76.18 -40.79 36.93 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 CA-C-N 118.803 0.729 . . . . 0.0 111.362 174.178 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -51.45 -51.61 53.47 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.383 -0.823 . . . . 0.0 109.965 170.593 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.3 mt -61.3 -43.18 99.3 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.507 0.723 . . . . 0.0 112.939 177.781 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -64.92 -31.58 72.88 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 120.056 1.298 . . . . 0.0 112.76 -178.588 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -76.14 -52.0 11.02 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.774 0.83 . . . . 0.0 112.191 175.544 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.3 m -65.61 -24.79 35.22 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 CA-C-N 120.338 1.426 . . . . 0.0 112.586 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -60.25 -30.69 69.59 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 112.889 0.699 . . . . 0.0 112.889 171.45 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 80.0 mt-30 -91.71 -9.17 44.75 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.752 1.221 . . . . 0.0 112.925 175.494 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 46.2 ttp -64.64 142.07 98.42 Favored Pre-proline 0 CA--C 1.549 0.918 0 O-C-N 121.282 -0.886 . . . . 0.0 110.807 173.528 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_exo -50.25 162.37 0.86 Allowed 'Trans proline' 0 CA--C 1.542 0.908 0 C-N-CA 123.787 2.991 . . . . 0.0 114.728 169.56 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 -93.65 -11.55 31.38 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.414 1.086 . . . . 0.0 113.53 172.321 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -124.18 163.2 22.05 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 127.097 2.159 . . . . 0.0 111.07 -175.237 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -124.93 162.42 24.48 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 114.973 1.471 . . . . 0.0 114.973 -177.99 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 65.3 t -138.48 135.28 43.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 125.999 1.72 . . . . 0.0 109.889 -176.806 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -65.38 121.38 14.72 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.338 1.455 . . . . 0.0 111.142 170.206 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 84.4 mt . . . . . 0 CA--C 1.538 0.517 0 CA-C-O 121.615 0.722 . . . . 0.0 112.4 177.324 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.12 0 CA-C-O 121.086 0.27 . . . . 0.0 112.855 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 33.1 ptt180 -154.91 156.84 36.83 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 126.026 1.73 . . . . 0.0 111.038 177.375 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.8 tttt -73.38 140.04 46.35 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.444 0.698 . . . . 0.0 110.758 170.107 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 70.0 p -142.13 168.3 20.08 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 126.373 1.869 . . . . 0.0 109.695 -177.457 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 24.9 p-10 -49.87 -32.87 15.42 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 169.815 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.3 mm-40 -67.59 -57.04 7.15 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.01 0.924 . . . . 0.0 111.351 178.705 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 89.6 mt -65.37 -33.32 75.67 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.527 -0.733 . . . . 0.0 112.689 178.167 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -58.45 -50.24 74.44 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.98 0.912 . . . . 0.0 111.318 170.998 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -59.6 -40.09 86.31 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.543 0.737 . . . . 0.0 112.603 177.912 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 90.4 mmm -56.38 -49.14 75.29 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 121.86 -0.525 . . . . 0.0 112.331 173.459 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -77.9 -18.38 56.22 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 114.772 1.397 . . . . 0.0 114.772 178.313 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 56.7 m-20 -102.96 -21.3 13.97 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 -171.5 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 59.0 t -131.84 -48.61 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 123.989 0.916 . . . . 0.0 111.645 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.4 t -72.31 -66.57 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 CA-C-N 118.863 0.756 . . . . 0.0 110.86 -170.423 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 89.8 t -58.76 -40.8 80.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 124.157 0.983 . . . . 0.0 110.362 172.338 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.5 tppp? -54.63 -47.64 73.21 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.892 0.877 . . . . 0.0 112.427 178.922 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 62.4 m -73.06 -44.33 60.78 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 122.923 0.489 . . . . 0.0 111.624 178.34 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 55.3 mt -62.86 -32.54 73.79 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.471 0.708 . . . . 0.0 112.426 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 18.0 t-105 -75.26 -30.09 60.36 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.319 1.447 . . . . 0.0 113.192 174.164 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 54.2 mtmt -79.03 -9.14 59.45 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.514 0.931 . . . . 0.0 113.514 175.105 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 35.6 t-80 -62.89 154.53 29.88 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.754 1.222 . . . . 0.0 113.494 -178.106 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -58.11 -24.48 58.86 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.475 1.51 . . . . 0.0 113.815 174.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -123.36 22.23 9.34 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.158 1.383 . . . . 0.0 113.657 -172.85 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.57 -26.08 63.38 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.725 1.21 . . . . 0.0 113.843 173.982 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 64.6 p-90 -59.14 -33.9 20.02 Favored Pre-proline 0 CA--C 1.546 0.804 0 N-CA-C 117.735 2.494 . . . . 0.0 117.735 -170.155 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -73.84 -2.61 12.48 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 CA-C-N 123.216 2.184 . . . . 0.0 113.781 173.757 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -115.75 -2.11 12.49 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.547 1.539 . . . . 0.0 113.474 179.221 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -63.06 -24.99 68.17 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 120.913 -1.117 . . . . 0.0 113.565 177.373 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -139.69 153.94 70.62 Favored Pre-proline 0 CA--C 1.543 0.681 0 C-N-CA 126.134 1.774 . . . . 0.0 110.377 -174.834 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -66.28 142.02 64.94 Favored 'Trans proline' 0 CA--C 1.537 0.652 0 C-N-CA 122.774 2.316 . . . . 0.0 112.569 179.526 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 49.5 t -59.13 142.31 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 124.452 1.101 . . . . 0.0 111.491 171.595 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -120.52 95.65 4.81 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.482 1.513 . . . . 0.0 109.536 171.513 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.25 -27.31 45.55 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.653 1.181 . . . . 0.0 113.877 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 77.9 mt -63.44 -53.46 45.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 124.437 1.095 . . . . 0.0 110.59 173.932 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 4.3 mptp? -66.16 -35.76 81.33 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.401 1.48 . . . . 0.0 112.707 -179.663 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 47.1 mt -81.08 -3.3 51.5 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 114.039 1.125 . . . . 0.0 114.039 174.318 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 62.7 t30 54.56 52.93 11.44 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.937 1.695 . . . . 0.0 113.677 -178.318 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 45.9 mt -115.47 80.61 8.02 Favored Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 126.644 1.978 . . . . 0.0 110.431 -177.06 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -67.47 -10.42 28.66 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 123.806 3.004 . . . . 0.0 113.917 -175.372 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -126.05 22.41 7.31 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.153 1.781 . . . . 0.0 112.397 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 71.6 t80 -51.04 -57.81 7.69 Favored 'General case' 0 N--CA 1.474 0.741 0 O-C-N 120.844 -1.16 . . . . 0.0 112.476 177.702 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -74.02 -12.7 60.7 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.973 1.309 . . . . 0.0 114.499 -178.094 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -71.61 -32.97 68.57 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.053 0.941 . . . . 0.0 111.645 177.725 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.9 mp -103.01 -43.51 9.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 125.82 1.648 . . . . 0.0 111.667 -178.851 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 22.6 mm -61.17 114.82 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 124.231 1.013 . . . . 0.0 110.244 173.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -63.41 -46.1 87.96 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.452 1.101 . . . . 0.0 111.756 179.011 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -156.19 127.94 3.85 Favored Pre-proline 0 CA--C 1.545 0.757 0 C-N-CA 125.606 1.562 . . . . 0.0 110.847 169.389 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -76.45 155.48 36.33 Favored 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 123.564 2.842 . . . . 0.0 112.232 -177.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 33.5 tpp -163.12 140.94 7.9 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.629 1.571 . . . . 0.0 110.115 174.479 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 25.8 m-20 -139.12 134.97 33.59 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 126.574 1.949 . . . . 0.0 108.42 169.375 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.5 ttp -46.96 -30.86 2.8 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 127.348 2.259 . . . . 0.0 116.24 -168.64 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.3 -30.41 40.13 Favored Glycine 0 CA--C 1.54 1.631 0 CA-C-N 119.08 0.854 . . . . 0.0 114.141 172.839 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 2.2 m -70.89 -35.63 72.41 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 125.259 1.424 . . . . 0.0 112.363 175.733 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 46.6 mt -67.94 -52.25 41.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.552 1.141 . . . . 0.0 110.008 -176.106 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.49 -40.12 77.94 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 174.869 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 3.2 tppp? -59.83 -39.85 86.48 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.014 0.926 . . . . 0.0 112.797 179.683 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 1.5 ptm180 -87.24 -28.35 22.4 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 39.6 mt -61.85 -34.88 76.77 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.127 0.971 . . . . 0.0 112.833 167.052 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -74.31 9.59 1.61 Allowed 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 124.962 1.305 . . . . 0.0 113.758 174.645 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 46.0 m-80 -129.29 161.02 31.19 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 127.36 2.264 . . . . 0.0 110.015 173.34 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 10.3 p-10 -78.34 36.89 0.25 Allowed 'General case' 0 CA--C 1.551 1.006 0 O-C-N 120.767 -1.208 . . . . 0.0 112.177 169.933 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -62.6 -34.18 76.47 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.073 1.349 . . . . 0.0 113.235 -169.604 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -134.54 -179.38 5.55 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 127.089 2.156 . . . . 0.0 111.296 174.851 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 4.3 t-105 -110.97 -26.24 9.38 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.217 1.407 . . . . 0.0 112.789 -177.725 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 62.1 m -134.29 143.74 47.92 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.664 1.186 . . . . 0.0 112.632 -170.091 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -65.3 -16.18 63.3 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 115.232 1.567 . . . . 0.0 115.232 -177.869 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 11.4 p -51.83 -36.21 47.3 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.497 1.119 . . . . 0.0 113.476 172.801 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -69.65 -42.0 74.82 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.764 0.825 . . . . 0.0 112.227 176.836 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 49.4 t -64.81 -35.33 80.75 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.162 0.985 . . . . 0.0 112.459 172.702 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 89.4 mtp -66.84 -42.32 85.96 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 121.323 -0.861 . . . . 0.0 111.817 173.66 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -63.73 -29.62 70.81 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 173.688 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -66.81 -45.95 76.73 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 119.341 0.973 . . . . 0.0 112.301 171.657 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -63.37 -41.28 98.8 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 121.322 -0.861 . . . . 0.0 112.687 173.091 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 22.7 t30 -57.66 -46.15 84.6 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.831 -0.543 . . . . 0.0 111.578 172.202 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 81.4 m -56.02 -49.82 72.61 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.19 0.996 . . . . 0.0 111.417 175.891 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 27.3 ttm -56.72 -61.29 2.53 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.224 1.01 . . . . 0.0 112.313 179.255 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -63.16 -40.79 98.56 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -175.107 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 66.5 m -66.72 -45.79 77.55 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.442 -0.786 . . . . 0.0 112.167 176.045 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -63.19 -30.84 71.91 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 120.102 1.319 . . . . 0.0 112.586 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 82.7 m -60.58 -45.17 94.92 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.266 1.026 . . . . 0.0 112.217 170.544 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -69.71 -29.56 66.99 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 179.563 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 88.6 mt -71.21 -55.83 12.56 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 CA-C-N 118.41 0.55 . . . . 0.0 110.126 178.027 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -71.3 -30.45 66.26 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 114.567 1.321 . . . . 0.0 114.567 -172.882 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 44.4 m-80 -113.61 158.25 21.06 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.012 0.925 . . . . 0.0 112.654 -171.011 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -66.16 147.89 98.66 Favored Pre-proline 0 N--CA 1.472 0.672 0 C-N-CA 124.61 1.164 . . . . 0.0 110.834 176.756 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -65.72 -6.94 15.06 Favored 'Trans proline' 0 CA--C 1.543 0.954 0 C-N-CA 123.828 3.019 . . . . 0.0 114.973 -175.161 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 70.7 p -116.46 1.18 12.93 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 126.265 1.826 . . . . 0.0 113.096 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -67.53 146.04 54.33 Favored 'General case' 0 CA--C 1.541 0.633 0 O-C-N 121.451 -0.781 . . . . 0.0 110.941 174.096 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -51.97 -46.25 64.74 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.7 0.8 . . . . 0.0 112.808 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 9.6 tp -57.43 -34.56 46.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 124.488 1.115 . . . . 0.0 113.747 179.39 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 45.4 t -69.95 -43.55 79.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 123.428 0.691 . . . . 0.0 110.67 174.203 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 69.5 mt -63.25 -35.8 81.53 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 119.003 0.819 . . . . 0.0 111.94 176.416 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -57.79 -53.4 58.62 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 118.26 0.482 . . . . 0.0 110.738 170.381 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.87 -39.99 91.26 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.483 0.713 . . . . 0.0 112.611 179.669 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -60.72 -50.12 74.77 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.07 0.85 . . . . 0.0 112.036 174.419 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.87 -41.33 99.36 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.427 0.691 . . . . 0.0 112.41 -179.654 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 85.4 mt -65.48 -45.74 82.47 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.635 0.774 . . . . 0.0 111.848 173.472 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -60.37 -43.24 96.74 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.566 1.075 . . . . 0.0 113.165 -176.595 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 66.1 mttt -58.23 -38.24 76.46 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.53 0.732 . . . . 0.0 111.857 178.104 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 70.1 mt -78.16 -41.62 26.84 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 123.406 0.682 . . . . 0.0 111.729 176.657 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 29.2 t80 -50.42 -51.57 45.26 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 119.131 0.878 . . . . 0.0 110.413 172.448 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 99.4 mt -62.04 -42.48 99.22 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.891 0.7 . . . . 0.0 112.891 178.401 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -67.89 -30.65 70.05 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 120.009 1.277 . . . . 0.0 112.755 179.85 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 69.2 mmtt -75.52 -48.39 22.76 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 117.616 -1.183 . . . . 0.0 112.435 175.189 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.7 m -68.43 -25.98 32.51 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 CA-C-N 121.094 1.77 . . . . 0.0 112.362 177.253 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -59.85 -31.12 69.46 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.748 -0.595 . . . . 0.0 112.431 171.394 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 21.6 mm100 -89.97 -5.85 56.26 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.125 1.37 . . . . 0.0 113.027 176.498 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 40.8 ttp -63.43 137.26 97.03 Favored Pre-proline 0 CA--C 1.546 0.819 0 C-N-CA 123.802 0.841 . . . . 0.0 110.418 171.922 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_endo -61.63 148.7 92.42 Favored 'Trans proline' 0 CA--C 1.534 0.514 0 C-N-CA 122.601 2.201 . . . . 0.0 111.023 174.966 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 -92.09 -13.46 30.77 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -174.487 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 9.5 mp0 -100.01 150.54 22.33 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 126.184 1.794 . . . . 0.0 111.862 176.047 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -98.84 140.93 32.28 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.04 1.336 . . . . 0.0 110.315 177.237 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 8.5 p -146.29 138.04 19.34 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 CA-C-O 122.299 1.047 . . . . 0.0 111.162 169.854 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -65.51 131.84 47.39 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.452 1.901 . . . . 0.0 111.64 176.054 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 98.6 mt . . . . . 0 N--CA 1.471 0.6 0 N-CA-C 114.068 1.136 . . . . 0.0 114.068 -177.095 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.394 0 N-CA-C 111.766 -0.533 . . . . 0.0 111.766 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 34.6 ptt180 -153.02 152.57 31.52 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.471 1.508 . . . . 0.0 110.675 172.169 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 74.0 tttt -71.75 139.24 48.99 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.362 0.665 . . . . 0.0 110.4 169.531 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 61.9 p -140.41 168.56 19.52 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.864 1.666 . . . . 0.0 110.421 -176.468 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 26.2 p-10 -48.94 -37.36 19.75 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 114.29 1.219 . . . . 0.0 114.29 172.039 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -72.11 -46.17 57.7 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 121.521 -0.737 . . . . 0.0 111.767 178.849 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 79.4 mt -65.44 -32.62 74.34 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 121.805 -0.559 . . . . 0.0 112.222 175.097 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 44.3 tt0 -59.6 -52.48 65.36 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 123.292 0.637 . . . . 0.0 109.863 168.92 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -56.4 -41.38 76.2 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.503 0.721 . . . . 0.0 112.516 179.179 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 89.9 mmm -57.15 -56.03 27.08 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 118.303 0.502 . . . . 0.0 112.017 171.496 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.2 pt20 -77.46 -11.53 59.86 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.952 1.464 . . . . 0.0 114.952 -175.243 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -115.48 -21.14 9.92 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.771 1.228 . . . . 0.0 113.334 -169.634 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 16.0 t -129.2 -51.4 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 C-N-CA 123.225 0.61 . . . . 0.0 111.229 -179.243 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.5 t -68.04 -63.01 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 123.246 0.618 . . . . 0.0 110.469 -176.505 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 69.0 t -57.79 -48.36 83.86 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 124.518 1.127 . . . . 0.0 110.523 174.429 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm -58.22 -44.34 88.16 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 118.482 0.583 . . . . 0.0 112.24 -175.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 40.5 m -71.01 -43.05 68.75 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 177.685 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 75.7 mt -63.16 -33.83 76.31 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.291 0.636 . . . . 0.0 112.355 176.576 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' TRP . . . . . 0.464 ' CZ3' ' HE3' ' A' ' 87' ' ' LYS . 19.3 t-105 -70.75 -28.33 64.61 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.741 1.616 . . . . 0.0 113.353 175.056 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.4 mtmp? -83.92 -4.13 58.47 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.291 1.036 . . . . 0.0 113.533 176.122 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 36.1 t-80 -65.99 158.91 27.01 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.902 1.281 . . . . 0.0 113.301 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -58.84 -24.53 62.15 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.518 1.527 . . . . 0.0 113.88 175.42 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 -125.4 22.1 7.79 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.802 1.241 . . . . 0.0 114.057 -171.532 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.72 -28.27 65.68 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 176.211 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' TRP . . . . . 0.427 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 45.0 p-90 -56.69 -37.6 59.41 Favored Pre-proline 0 CA--C 1.547 0.855 0 N-CA-C 117.324 2.342 . . . . 0.0 117.324 -170.911 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.427 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 64.0 Cg_endo -70.22 -5.53 16.72 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 CA-C-N 123.042 2.122 . . . . 0.0 114.592 172.325 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 80.7 m-85 -113.19 -1.06 14.45 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.345 1.458 . . . . 0.0 113.302 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -64.02 -17.83 63.72 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 113.914 1.079 . . . . 0.0 113.914 175.379 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 -142.88 157.06 62.01 Favored Pre-proline 0 CA--C 1.546 0.797 0 C-N-CA 125.958 1.703 . . . . 0.0 111.047 -172.311 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -65.42 152.48 81.85 Favored 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 122.998 2.465 . . . . 0.0 112.34 173.613 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 36.5 t -71.85 144.75 12.92 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 124.485 1.114 . . . . 0.0 110.56 177.153 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -128.97 97.07 4.52 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.197 1.399 . . . . 0.0 110.604 178.834 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.0 -28.46 57.35 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.563 1.145 . . . . 0.0 113.858 178.607 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 82.6 mt -66.72 -49.34 75.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 125.071 1.348 . . . . 0.0 111.021 174.614 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 9.6 mtpm? -67.75 -37.73 82.54 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.636 1.174 . . . . 0.0 112.745 -179.537 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 85.0 mt -90.63 -1.2 57.88 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.952 1.701 . . . . 0.0 113.513 -177.596 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 51.96 57.43 6.51 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 125.754 1.622 . . . . 0.0 113.296 -178.938 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 53.9 mt -113.6 83.59 7.25 Favored Pre-proline 0 CA--C 1.547 0.854 0 C-N-CA 125.9 1.68 . . . . 0.0 110.655 -177.537 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -67.66 -11.6 32.68 Favored 'Trans proline' 0 CA--C 1.541 0.858 0 C-N-CA 123.975 3.117 . . . . 0.0 114.61 -170.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.432 ' HA ' ' HE3' ' A' ' 75' ' ' LYS . 40.9 m-20 -125.8 21.53 7.61 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.416 1.486 . . . . 0.0 113.048 177.878 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -48.28 -55.39 10.7 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 121.212 -0.93 . . . . 0.0 113.009 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -77.39 -16.25 58.94 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 114.672 1.36 . . . . 0.0 114.672 -177.802 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.432 ' HE3' ' HA ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -68.66 -39.64 80.54 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.141 -0.975 . . . . 0.0 111.714 172.656 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.3 mp -88.65 -46.2 15.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 124.35 1.06 . . . . 0.0 111.189 175.69 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.574 HD11 ' HB2' ' A' ' 115' ' ' TYR . 32.3 mm -80.34 104.51 8.78 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-O 121.685 0.755 . . . . 0.0 111.189 178.514 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -69.34 -36.65 77.11 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.84 1.256 . . . . 0.0 112.578 174.822 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -146.35 103.46 4.04 Favored Pre-proline 0 CA--C 1.547 0.83 0 C-N-CA 125.69 1.596 . . . . 0.0 110.686 -178.904 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -76.32 149.17 31.16 Favored 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 123.403 2.735 . . . . 0.0 111.232 174.191 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 6.8 tpt -157.83 148.66 21.02 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.726 1.211 . . . . 0.0 111.105 177.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -150.56 154.85 38.33 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.771 1.628 . . . . 0.0 111.533 -178.644 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 4.5 ttp -64.07 -33.23 75.28 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.911 0.885 . . . . 0.0 113.369 -174.21 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.67 -44.97 97.26 Favored Glycine 0 CA--C 1.532 1.138 0 C-N-CA 124.697 1.141 . . . . 0.0 112.899 173.759 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 57.7 m -68.56 -39.78 80.91 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 121.789 -0.83 . . . . 0.0 111.827 172.727 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 95.3 mt -55.56 -53.23 38.82 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 CA-C-N 120.104 1.32 . . . . 0.0 111.22 176.119 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.464 ' HE3' ' CZ3' ' A' ' 51' ' ' TRP . 16.3 ptpt -59.74 -30.52 68.89 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 177.871 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm -66.83 -44.9 79.91 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.814 0.846 . . . . 0.0 112.867 177.037 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 6.9 ptp180 -75.17 -19.6 59.77 Favored 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 172.817 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 46.3 mt -70.76 -51.55 26.41 Favored 'General case' 0 CA--C 1.543 0.673 0 CA-C-N 119.152 0.887 . . . . 0.0 111.328 167.051 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -71.46 -41.53 69.29 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 113.461 0.912 . . . . 0.0 113.461 -176.315 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -86.34 110.75 19.89 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 169.931 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 46.2 t30 -48.79 115.63 1.33 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.54 1.136 . . . . 0.0 112.915 -175.178 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 54.7 t80 -137.0 -26.76 1.02 Allowed 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 114.365 1.246 . . . . 0.0 114.365 -172.501 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -138.56 170.79 15.38 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.801 1.24 . . . . 0.0 112.708 178.196 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 8.8 t-105 -99.92 -21.45 15.67 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.136 1.375 . . . . 0.0 112.657 -176.91 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.7 p -141.42 148.29 39.32 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.452 1.501 . . . . 0.0 113.105 -169.53 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -72.19 -17.18 61.95 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 115.221 1.563 . . . . 0.0 115.221 -176.359 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 5.7 p -52.88 -37.03 60.02 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.033 0.933 . . . . 0.0 113.004 174.817 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -67.45 -43.72 80.4 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.705 -0.622 . . . . 0.0 112.474 178.501 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 45.4 t -60.17 -40.77 91.1 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.119 0.968 . . . . 0.0 112.617 170.48 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 83.9 mtp -62.35 -42.61 99.53 Favored 'General case' 0 N--CA 1.473 0.679 0 O-C-N 121.303 -0.873 . . . . 0.0 112.579 176.136 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 58.0 mm-40 -66.45 -32.99 74.7 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 173.424 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -66.46 -41.27 89.33 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 120.736 -1.227 . . . . 0.0 111.922 171.911 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -60.67 -45.49 93.95 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.264 -0.898 . . . . 0.0 112.47 170.859 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.91 -42.62 94.3 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.434 -0.791 . . . . 0.0 110.924 173.857 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 88.0 m -60.26 -40.23 89.59 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.976 0.91 . . . . 0.0 111.883 178.312 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 17.2 ttm -57.31 -59.61 4.87 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 119.001 0.819 . . . . 0.0 111.534 173.456 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -64.17 -43.46 95.08 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -176.431 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 97.5 m -63.71 -47.44 81.13 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.973 0.909 . . . . 0.0 112.054 179.025 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -64.2 -34.25 77.66 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-N 119.711 1.142 . . . . 0.0 112.224 -179.079 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 24.6 m -58.4 -43.8 88.71 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 113.232 0.827 . . . . 0.0 113.232 170.147 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 14.9 m-85 -68.45 -29.1 67.67 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.861 1.06 . . . . 0.0 113.861 178.861 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 86.8 mt -70.08 -56.57 10.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 123.27 0.628 . . . . 0.0 110.647 176.573 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' TYR . . . . . 0.574 ' HB2' HD11 ' A' ' 77' ' ' ILE . 33.7 t80 -69.33 -35.3 75.78 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 114.371 1.248 . . . . 0.0 114.371 -173.572 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 55.6 m-80 -105.58 154.96 19.68 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.25 1.02 . . . . 0.0 111.535 -172.423 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 53.3 mttm -68.3 151.58 97.12 Favored Pre-proline 0 N--CA 1.471 0.577 0 C-N-CA 123.988 0.915 . . . . 0.0 111.037 175.383 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -65.24 -1.03 3.97 Favored 'Trans proline' 0 CA--C 1.547 1.168 0 C-N-CA 123.601 2.868 . . . . 0.0 114.763 -179.238 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 52.0 p -117.67 -2.41 11.43 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 127.123 2.169 . . . . 0.0 113.151 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 -69.31 144.38 53.55 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 118.966 0.803 . . . . 0.0 110.648 171.106 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -56.29 -46.27 79.83 Favored 'General case' 0 N--CA 1.471 0.616 0 O-C-N 121.649 -0.657 . . . . 0.0 112.514 -175.728 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.4 tp -54.42 -30.29 21.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 125.118 1.367 . . . . 0.0 114.209 177.6 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 45.5 t -72.81 -47.18 50.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 O-C-N 121.422 -0.798 . . . . 0.0 110.555 174.015 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 71.8 mt -61.46 -37.08 82.27 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 118.93 0.786 . . . . 0.0 111.599 176.924 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 7.7 mtt -59.01 -51.91 68.01 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.921 1.288 . . . . 0.0 111.971 169.835 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.28 -39.65 87.63 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.353 0.661 . . . . 0.0 112.72 176.713 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 89.3 mt-30 -62.41 -45.36 93.45 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 119.24 0.927 . . . . 0.0 111.902 174.663 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -67.41 -29.69 69.26 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.246 1.018 . . . . 0.0 113.615 179.149 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 81.5 mt -76.14 -48.52 20.3 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.832 0.853 . . . . 0.0 111.49 169.716 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -62.05 -37.81 86.39 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 113.376 0.88 . . . . 0.0 113.376 -173.546 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 59.5 pttt -58.9 -44.21 91.15 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 121.593 -0.692 . . . . 0.0 111.679 176.171 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 65.9 mt -70.99 -39.97 75.71 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 124.413 1.085 . . . . 0.0 110.91 176.935 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -51.11 -49.5 60.64 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.903 1.229 . . . . 0.0 110.808 171.43 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.7 mt -63.9 -39.68 94.75 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 176.762 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -57.3 -41.09 79.17 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-N 119.688 1.131 . . . . 0.0 112.652 172.184 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 36.7 mmtm -75.69 -48.83 20.32 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.961 1.304 . . . . 0.0 111.786 -175.309 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.8 m -68.78 -25.96 31.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 CA-C-N 120.121 1.328 . . . . 0.0 112.218 176.837 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -61.59 -28.3 69.25 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 121.495 -0.753 . . . . 0.0 112.449 171.475 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -96.51 1.73 51.73 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.399 1.48 . . . . 0.0 112.687 177.696 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 8.9 ttm -54.28 141.53 51.71 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 124.951 1.3 . . . . 0.0 112.482 174.539 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -67.6 114.84 3.44 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 123.076 2.517 . . . . 0.0 109.233 168.556 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -71.44 -20.58 62.08 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 -169.922 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -84.41 160.24 20.65 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.74 1.616 . . . . 0.0 112.056 177.149 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -116.43 133.07 56.44 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.116 1.367 . . . . 0.0 110.986 178.04 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 13.0 p -149.28 142.94 18.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 C-N-CA 124.848 1.259 . . . . 0.0 111.286 173.027 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -70.77 137.75 49.86 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.656 1.182 . . . . 0.0 111.636 176.066 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 95.9 mt . . . . . 0 N--CA 1.47 0.553 0 N-CA-C 114.058 1.133 . . . . 0.0 114.058 -175.854 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.207 0 N-CA-C 111.753 -0.539 . . . . 0.0 111.753 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 34.9 ptt180 -162.83 161.2 25.92 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.918 1.687 . . . . 0.0 110.693 179.317 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.589 ' HB3' HD12 ' A' ' 147' ' ' LEU . 46.6 mttp -76.93 141.23 40.57 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 121.398 0.618 . . . . 0.0 110.425 167.516 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 81.0 p -141.04 164.16 31.02 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 125.585 1.554 . . . . 0.0 110.004 176.904 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -52.68 -30.97 34.82 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 170.631 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.4 mm-40 -67.9 -54.74 16.45 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.884 0.874 . . . . 0.0 111.188 177.144 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.3 mt -65.03 -32.88 74.82 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 121.489 -0.757 . . . . 0.0 112.52 176.326 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.515 ' HB2' HD11 ' A' ' 147' ' ' LEU . 53.4 tt0 -57.16 -52.81 63.8 Favored 'General case' 0 C--O 1.224 -0.26 0 C-N-CA 123.977 0.911 . . . . 0.0 110.92 170.065 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -60.21 -41.18 92.49 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.453 0.701 . . . . 0.0 112.596 179.197 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 93.9 mmm -55.85 -48.35 75.67 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 121.747 -0.595 . . . . 0.0 111.794 171.725 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -86.42 -5.57 59.13 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 115.114 1.524 . . . . 0.0 115.114 -175.739 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 30.6 m-20 -117.0 -18.36 10.12 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 125.157 1.383 . . . . 0.0 113.481 -176.117 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 46.9 t -133.85 -50.66 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 123.934 0.894 . . . . 0.0 111.686 179.602 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.0 t -71.54 -67.48 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-N 119.407 1.003 . . . . 0.0 110.802 -171.468 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 59.1 t -57.61 -41.85 80.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 123.655 0.782 . . . . 0.0 109.965 171.805 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.74 -45.02 86.44 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 118.87 0.759 . . . . 0.0 113.005 -177.604 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 62.4 m -71.76 -44.46 64.0 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 122.925 0.49 . . . . 0.0 111.364 176.865 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 66.6 mt -62.0 -32.49 72.97 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.572 0.749 . . . . 0.0 112.277 178.145 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 16.9 t-105 -73.17 -29.53 62.92 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.022 1.729 . . . . 0.0 112.955 176.066 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 56.5 mtmt -84.25 -5.28 59.24 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.256 1.022 . . . . 0.0 113.462 176.568 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 37.3 t-80 -65.02 156.18 32.23 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.695 1.198 . . . . 0.0 113.564 -178.439 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 18.4 tp60 -58.74 -20.82 52.62 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.604 1.562 . . . . 0.0 114.057 174.49 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -125.12 19.97 8.26 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.399 1.479 . . . . 0.0 113.791 -174.44 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.3 -30.01 65.73 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 177.736 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' TRP . . . . . 0.446 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 39.4 p-90 -54.57 -37.84 59.34 Favored Pre-proline 0 CA--C 1.547 0.863 0 N-CA-C 117.094 2.257 . . . . 0.0 117.094 -172.517 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.446 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 56.9 Cg_endo -67.99 -7.28 19.29 Favored 'Trans proline' 0 C--N 1.354 0.866 0 CA-C-N 122.959 2.092 . . . . 0.0 115.012 172.785 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 72.7 m-85 -114.5 -1.45 13.43 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.132 1.373 . . . . 0.0 113.284 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 20.1 m-30 -65.18 -22.53 66.92 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 113.458 0.91 . . . . 0.0 113.458 176.212 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -138.4 155.46 73.89 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 126.515 1.926 . . . . 0.0 110.005 -176.386 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -67.24 147.63 78.95 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 122.571 2.18 . . . . 0.0 112.4 178.828 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 76.6 t -59.75 142.34 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 123.903 0.881 . . . . 0.0 111.258 170.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -122.97 101.24 7.31 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 125.689 1.596 . . . . 0.0 109.497 171.746 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.27 -27.23 61.91 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 -179.26 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 84.3 mt -64.81 -49.61 79.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 124.855 1.262 . . . . 0.0 110.846 172.677 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -68.36 -42.31 79.37 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.97 1.308 . . . . 0.0 112.788 -178.526 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.4 mp -80.74 -4.32 54.04 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.358 1.063 . . . . 0.0 113.329 176.889 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 61.7 t30 55.02 56.28 6.76 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 126.266 1.826 . . . . 0.0 113.501 -179.499 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 51.5 mt -115.28 84.05 11.04 Favored Pre-proline 0 CA--C 1.545 0.77 0 C-N-CA 126.312 1.845 . . . . 0.0 110.741 -175.436 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -68.3 -3.88 11.71 Favored 'Trans proline' 0 CA--C 1.544 1.009 0 C-N-CA 123.945 3.097 . . . . 0.0 114.633 -174.368 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -131.24 14.78 5.11 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 126.051 1.74 . . . . 0.0 112.528 -178.681 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 40.9 t80 -51.13 -55.05 19.75 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 120.729 -1.232 . . . . 0.0 113.364 -173.212 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -79.44 -9.44 59.6 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.346 1.059 . . . . 0.0 113.854 178.894 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -70.65 -47.27 60.88 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.006 0.922 . . . . 0.0 110.337 177.325 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.9 mp -77.11 -50.39 20.85 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 C-N-CA 124.137 0.975 . . . . 0.0 109.84 172.096 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 40.9 mm -91.4 103.04 14.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 CA-C-O 122.48 1.134 . . . . 0.0 112.097 -171.962 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt -68.06 -32.26 72.48 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.936 1.694 . . . . 0.0 113.487 179.641 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -147.59 91.67 4.94 Favored Pre-proline 0 CA--C 1.545 0.761 0 C-N-CA 125.715 1.606 . . . . 0.0 110.209 -178.044 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -78.76 159.61 27.97 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 123.499 2.799 . . . . 0.0 111.356 174.522 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 40.8 mmm -147.05 160.87 41.88 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.522 1.129 . . . . 0.0 112.751 168.585 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -146.81 146.79 30.36 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 127.099 2.159 . . . . 0.0 110.228 175.912 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.2 ttp -61.84 -35.19 77.55 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.163 0.985 . . . . 0.0 113.63 -170.362 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -57.87 -42.4 94.65 Favored Glycine 0 CA--C 1.531 1.075 0 C-N-CA 123.831 0.729 . . . . 0.0 113.219 177.448 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 19.7 m -67.13 -41.58 85.9 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.826 0.85 . . . . 0.0 111.602 176.147 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 95.0 mt -60.02 -52.06 65.58 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 124.257 1.023 . . . . 0.0 110.493 177.444 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 25.2 ttpp -57.75 -37.4 73.56 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 125.417 1.487 . . . . 0.0 112.888 176.391 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 34.0 ttmt -62.69 -41.88 99.34 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 113.458 0.91 . . . . 0.0 113.458 178.613 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -74.03 -27.09 60.77 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 114.537 1.31 . . . . 0.0 114.537 172.777 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 62.5 mt -61.8 -48.62 79.78 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 118.675 0.67 . . . . 0.0 111.29 168.711 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -59.29 -42.01 90.28 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.054 0.942 . . . . 0.0 111.977 176.478 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 -83.51 2.56 36.34 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 125.086 1.354 . . . . 0.0 113.987 179.371 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 34.86 56.72 0.74 Allowed 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 127.579 2.352 . . . . 0.0 115.091 -171.997 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 71.2 t80 -58.83 -24.37 61.91 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 127.358 2.263 . . . . 0.0 114.948 -176.757 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -133.22 -175.48 3.81 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 129.043 2.937 . . . . 0.0 111.568 -169.852 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 14.4 t-105 -110.45 -27.45 9.01 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.382 1.073 . . . . 0.0 113.142 -171.511 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 16.9 m -145.95 151.69 38.22 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.724 1.21 . . . . 0.0 112.703 -171.898 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -66.0 -21.23 66.39 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 116.502 2.038 . . . . 0.0 116.502 -172.711 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 47.0 t -53.85 -36.7 62.88 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 119.282 0.946 . . . . 0.0 112.552 178.843 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -65.86 -44.78 84.39 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 121.088 -1.008 . . . . 0.0 112.015 179.087 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 53.1 t -57.92 -41.91 83.68 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.088 0.955 . . . . 0.0 112.37 171.123 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 79.9 mtp -61.86 -40.33 94.99 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.999 0.92 . . . . 0.0 112.975 175.83 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 65.0 mt-30 -62.57 -37.32 85.72 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.093 0.957 . . . . 0.0 112.682 175.269 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -71.96 -33.91 68.55 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.0 -1.063 . . . . 0.0 113.281 174.543 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -64.25 -45.0 90.07 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 119.346 0.975 . . . . 0.0 112.212 169.538 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 24.1 t30 -56.27 -42.12 76.95 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.866 -0.521 . . . . 0.0 111.534 171.502 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 60.4 m -64.98 -39.57 93.68 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.128 0.971 . . . . 0.0 112.491 176.357 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 21.1 ttm -58.98 -61.09 2.9 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.941 0.897 . . . . 0.0 111.352 174.742 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -62.91 -39.79 95.63 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 -176.351 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 90.5 m -65.11 -47.33 77.53 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.195 0.598 . . . . 0.0 112.07 178.424 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -64.71 -32.53 74.25 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 119.615 1.098 . . . . 0.0 112.549 -179.227 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 55.9 m -59.8 -45.15 93.2 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.717 0.807 . . . . 0.0 112.543 169.945 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 14.3 m-85 -67.84 -32.55 73.15 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 177.826 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 85.6 mt -69.41 -58.19 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 123.576 0.75 . . . . 0.0 111.05 176.963 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 43.2 t80 -68.31 -34.61 76.45 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 114.246 1.202 . . . . 0.0 114.246 -170.874 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 60.5 m-80 -101.03 164.7 11.68 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.51 1.124 . . . . 0.0 111.987 -173.375 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -72.61 150.84 91.32 Favored Pre-proline 0 N--CA 1.476 0.836 0 O-C-N 121.368 -0.833 . . . . 0.0 109.921 170.25 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -66.08 -1.65 5.62 Favored 'Trans proline' 0 CA--C 1.546 1.108 0 C-N-CA 123.393 2.728 . . . . 0.0 114.68 -178.493 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 50.7 p -118.24 -1.34 11.35 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.994 2.118 . . . . 0.0 113.113 -179.056 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 54.4 m-20 -67.46 145.9 54.53 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.535 -0.728 . . . . 0.0 110.822 170.618 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -56.22 -46.69 79.4 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.619 -0.675 . . . . 0.0 112.406 -176.068 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.5 tp -54.73 -29.13 20.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 125.227 1.411 . . . . 0.0 114.442 177.855 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 38.6 t -73.17 -45.57 53.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 O-C-N 121.281 -0.887 . . . . 0.0 110.517 173.631 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 73.5 mt -63.31 -36.87 85.12 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 118.977 0.808 . . . . 0.0 111.405 176.689 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 7.6 mtt -59.17 -52.11 67.12 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.019 1.328 . . . . 0.0 111.648 169.541 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.54 -38.8 85.64 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.483 0.713 . . . . 0.0 112.707 176.827 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -62.74 -49.41 75.15 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.955 0.798 . . . . 0.0 112.146 174.049 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -61.25 -39.51 90.62 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.493 0.717 . . . . 0.0 112.295 179.595 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 80.5 mt -66.08 -48.42 71.02 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.487 0.715 . . . . 0.0 111.872 170.934 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -62.27 -39.72 93.85 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 120.78 -1.2 . . . . 0.0 113.53 -175.965 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 14.2 mttm -60.02 -29.33 68.42 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.672 0.789 . . . . 0.0 112.595 174.975 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 59.4 mt -86.61 -39.98 13.79 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 C-N-CA 123.615 0.766 . . . . 0.0 112.055 174.134 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 35.6 t80 -50.43 -53.17 31.49 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.366 0.985 . . . . 0.0 110.455 172.899 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.2 mt -62.97 -40.24 97.1 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 112.951 0.723 . . . . 0.0 112.951 -179.869 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.5 pt20 -71.33 -29.67 65.28 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 119.694 1.134 . . . . 0.0 112.847 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -75.69 -48.44 21.97 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 117.638 -1.173 . . . . 0.0 112.439 174.704 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 6.1 m -66.97 -26.28 36.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 CA-C-N 121.031 1.741 . . . . 0.0 112.075 177.033 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -60.64 -29.99 69.6 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 172.139 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -89.99 -6.25 55.83 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 124.712 1.205 . . . . 0.0 112.838 175.648 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 39.7 ttp -63.77 139.45 97.63 Favored Pre-proline 0 CA--C 1.547 0.847 0 O-C-N 121.251 -0.906 . . . . 0.0 110.278 170.834 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -63.75 154.62 68.34 Favored 'Trans proline' 0 CA--C 1.538 0.699 0 C-N-CA 122.758 2.305 . . . . 0.0 111.907 175.832 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 20.1 mm100 -84.54 -18.07 36.89 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 176.055 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -96.35 155.22 16.86 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.357 1.463 . . . . 0.0 112.934 -179.441 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -122.32 138.25 54.57 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.652 1.181 . . . . 0.0 111.065 -175.58 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 9.7 p -145.16 140.08 22.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 C-N-CA 125.289 1.436 . . . . 0.0 110.672 176.121 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -70.24 135.78 49.32 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.67 1.188 . . . . 0.0 111.354 176.385 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 147' ' ' LEU . . . . . 0.589 HD12 ' HB3' ' A' ' 35' ' ' LYS . 84.1 mt . . . . . 0 CA--C 1.54 0.585 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 -173.04 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.191 0 CA-C-O 121.111 0.284 . . . . 0.0 113.367 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.5 ptt180 -158.4 152.46 23.93 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 126.55 1.94 . . . . 0.0 109.858 168.583 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 26.2 ttpt -82.63 141.64 32.36 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 121.455 0.645 . . . . 0.0 111.127 174.84 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 59.3 p -135.74 166.63 22.81 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 125.562 1.545 . . . . 0.0 111.143 -169.24 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 27.3 p-10 -47.54 -38.34 13.95 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.288 1.035 . . . . 0.0 113.767 172.604 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 15.0 tt0 -72.72 -42.12 64.49 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.424 1.09 . . . . 0.0 112.323 -179.344 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 73.3 mt -67.18 -31.65 72.2 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.566 0.746 . . . . 0.0 112.137 171.262 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -60.96 -48.46 81.7 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 118.539 0.609 . . . . 0.0 110.413 169.551 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -55.76 -41.07 73.44 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.466 0.706 . . . . 0.0 112.415 177.417 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 90.3 mmm -57.0 -52.87 63.55 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 119.004 -0.522 . . . . 0.0 112.401 172.468 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -77.87 -17.26 57.55 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 114.772 1.397 . . . . 0.0 114.772 -178.304 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -106.27 -22.35 12.85 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.002 0.921 . . . . 0.0 113.317 -169.122 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 33.7 t -127.96 -51.68 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 C-N-CA 123.234 0.614 . . . . 0.0 111.207 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.7 t -67.72 -62.34 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.206 0.602 . . . . 0.0 110.566 -174.431 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 55.6 t -57.19 -50.62 76.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 124.375 1.07 . . . . 0.0 110.222 173.138 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm -57.03 -43.49 81.98 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 118.658 0.663 . . . . 0.0 112.407 -174.261 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 56.4 m -69.4 -47.62 63.6 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 117.956 0.344 . . . . 0.0 111.901 176.576 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 70.9 mt -61.43 -33.85 74.41 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.43 0.692 . . . . 0.0 112.313 178.806 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' TRP . . . . . 0.445 ' CZ3' ' HE3' ' A' ' 87' ' ' LYS . 22.2 t-105 -70.07 -29.64 66.69 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.828 1.651 . . . . 0.0 113.413 176.218 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.4 mtmp? -82.7 -7.1 59.67 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.012 0.925 . . . . 0.0 113.403 177.761 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 41.0 t-80 -64.76 152.86 41.53 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.707 1.203 . . . . 0.0 113.018 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 26.8 mp0 -60.85 -19.29 59.73 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.578 1.551 . . . . 0.0 113.948 175.781 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -119.78 15.24 12.64 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.56 1.544 . . . . 0.0 113.672 -175.162 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.93 -26.21 63.09 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.184 1.394 . . . . 0.0 114.345 178.245 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 68.1 p-90 -57.54 -33.89 21.62 Favored Pre-proline 0 CA--C 1.549 0.938 0 N-CA-C 117.967 2.58 . . . . 0.0 117.967 -170.694 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -77.24 -1.28 11.44 Favored 'Trans proline' 0 CA--C 1.543 0.972 0 CA-C-N 123.437 2.263 . . . . 0.0 113.281 174.755 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 88.4 m-85 -112.03 -4.87 14.37 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.576 1.55 . . . . 0.0 113.411 179.372 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -65.02 -14.76 61.22 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 176.4 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 69.8 mt-30 -142.91 157.7 60.68 Favored Pre-proline 0 CA--C 1.547 0.861 0 C-N-CA 126.252 1.821 . . . . 0.0 111.069 -176.394 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -65.65 157.06 60.58 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 123.336 2.691 . . . . 0.0 113.309 176.082 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 21.8 t -77.09 85.8 0.84 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 125.085 1.354 . . . . 0.0 110.015 178.511 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -71.31 86.11 0.8 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.025 1.33 . . . . 0.0 111.303 177.394 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.37 -27.88 26.23 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 124.893 1.277 . . . . 0.0 114.395 -178.492 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 82.0 mt -65.77 -49.96 73.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 124.831 1.252 . . . . 0.0 111.109 173.664 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 85.5 mttt -67.3 -40.37 86.03 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.932 1.293 . . . . 0.0 112.4 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.9 mp -82.65 -3.59 56.51 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.869 1.667 . . . . 0.0 112.7 -179.44 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 51.76 56.35 7.97 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.977 1.711 . . . . 0.0 113.123 -178.258 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 28.0 mt -112.76 81.87 4.66 Favored Pre-proline 0 CA--C 1.545 0.751 0 C-N-CA 126.179 1.792 . . . . 0.0 109.926 179.221 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -67.38 -7.82 20.25 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 124.026 3.151 . . . . 0.0 114.827 -170.095 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -132.17 17.49 4.54 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.926 1.691 . . . . 0.0 112.515 -179.156 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -48.12 -51.99 22.38 Favored 'General case' 0 N--CA 1.477 0.911 0 O-C-N 120.86 -1.15 . . . . 0.0 112.985 -175.855 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -76.19 -6.14 49.95 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.633 1.573 . . . . 0.0 114.496 -179.454 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.4 mmmp? -84.4 -37.04 21.97 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.979 0.912 . . . . 0.0 111.269 174.757 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.3 mp -81.31 -48.1 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 124.087 0.955 . . . . 0.0 110.099 171.624 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 22.0 mm -86.8 111.67 21.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 123.824 0.85 . . . . 0.0 111.596 -176.518 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 29.6 mmmt -63.14 -32.66 74.1 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.488 1.515 . . . . 0.0 112.878 175.262 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 21.7 p-10 -157.3 96.81 2.04 Favored Pre-proline 0 CA--C 1.551 0.992 0 C-N-CA 126.089 1.756 . . . . 0.0 111.904 -169.695 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -77.32 149.39 27.78 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 123.557 2.838 . . . . 0.0 111.763 176.791 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 6.7 tpt -158.42 150.33 21.47 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.663 1.185 . . . . 0.0 111.864 179.358 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -150.21 155.21 39.33 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 126.079 1.751 . . . . 0.0 112.172 -178.512 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.9 ttp -65.24 -33.68 76.57 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 113.45 0.908 . . . . 0.0 113.45 -174.696 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.93 -44.41 98.17 Favored Glycine 0 CA--C 1.531 1.094 0 C-N-CA 124.594 1.093 . . . . 0.0 112.909 175.242 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 65.0 m -67.2 -42.98 83.25 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 118.382 -0.818 . . . . 0.0 111.597 172.093 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 76.2 mt -52.84 -53.85 19.23 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 CA-C-N 119.801 1.182 . . . . 0.0 111.667 178.15 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.445 ' HE3' ' CZ3' ' A' ' 51' ' ' TRP . 16.0 ptpt -59.95 -29.18 68.23 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 113.891 1.071 . . . . 0.0 113.891 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.6 tpmt? -69.96 -45.59 67.07 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.421 1.089 . . . . 0.0 112.453 177.343 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 5.4 ptp180 -73.07 -27.09 61.53 Favored 'General case' 0 N--CA 1.481 1.095 0 N-CA-C 113.874 1.065 . . . . 0.0 113.874 174.116 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 33.2 mt -67.91 -43.19 79.8 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 113.161 0.8 . . . . 0.0 113.161 168.563 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -64.67 -46.58 81.81 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 119.006 0.821 . . . . 0.0 112.305 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 64.2 m-80 -75.08 173.91 10.11 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.409 1.484 . . . . 0.0 112.337 174.117 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 60.4 t-20 -87.11 114.17 23.49 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 121.364 -0.835 . . . . 0.0 109.01 168.15 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -137.09 -33.77 0.75 Allowed 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.363 1.065 . . . . 0.0 113.676 179.019 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -139.45 164.84 28.8 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.765 1.626 . . . . 0.0 111.824 177.416 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 5.6 t-105 -91.63 -22.56 20.22 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.736 1.214 . . . . 0.0 112.829 -179.734 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 7.5 t -143.9 149.01 36.22 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.561 1.144 . . . . 0.0 113.285 -169.353 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -70.96 -18.59 62.62 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 115.764 1.764 . . . . 0.0 115.764 -172.103 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 11.4 t -60.51 -25.72 66.31 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.403 1.002 . . . . 0.0 113.004 178.491 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -67.08 -42.25 84.98 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 121.31 -0.869 . . . . 0.0 111.87 173.068 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 42.3 t -65.1 -35.4 81.03 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.819 0.847 . . . . 0.0 112.248 172.556 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 80.8 mtp -63.69 -41.43 98.13 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 121.453 -0.78 . . . . 0.0 112.003 173.924 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -62.17 -39.36 92.39 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 171.373 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 92.4 m-20 -65.0 -42.19 94.7 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 119.414 1.007 . . . . 0.0 112.303 175.454 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -61.33 -45.79 92.98 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 121.236 -0.915 . . . . 0.0 112.635 172.098 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 31.9 t30 -58.63 -41.11 85.18 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.653 -0.654 . . . . 0.0 111.752 173.878 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 85.6 m -66.01 -36.56 83.61 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.055 1.342 . . . . 0.0 112.672 178.737 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 17.3 ttm -58.67 -57.79 11.42 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.025 0.93 . . . . 0.0 111.365 174.179 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 19.3 m-85 -64.86 -38.18 90.11 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 122.831 0.452 . . . . 0.0 112.141 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 92.6 m -64.63 -48.09 76.14 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.502 0.721 . . . . 0.0 112.167 178.414 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -64.23 -30.14 71.21 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 119.785 1.175 . . . . 0.0 112.578 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 98.8 m -61.39 -43.68 98.45 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.356 0.663 . . . . 0.0 112.66 170.052 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 -68.3 -32.26 72.27 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 177.773 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 73.5 mt -73.24 -57.51 6.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 123.214 0.606 . . . . 0.0 111.091 179.86 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -68.59 -27.18 65.82 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 114.111 1.152 . . . . 0.0 114.111 -172.242 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 -113.74 164.61 13.49 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.479 1.112 . . . . 0.0 112.506 -171.373 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -71.06 146.02 92.16 Favored Pre-proline 0 N--CA 1.474 0.741 0 C-N-CA 123.918 0.887 . . . . 0.0 110.513 175.629 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -66.87 -5.25 12.89 Favored 'Trans proline' 0 CA--C 1.543 0.97 0 C-N-CA 123.839 3.026 . . . . 0.0 114.659 -176.14 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 45.3 p -112.98 -3.55 14.03 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 126.999 2.12 . . . . 0.0 113.169 -179.652 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 37.1 t0 -68.91 152.38 45.35 Favored 'General case' 0 CA--C 1.542 0.658 0 O-C-N 121.462 -0.774 . . . . 0.0 111.319 174.099 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -54.65 -48.28 72.49 Favored 'General case' 0 N--CA 1.47 0.546 0 O-C-N 121.625 -0.672 . . . . 0.0 111.927 -179.085 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.5 tp -55.94 -31.98 31.9 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 -177.011 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 49.0 t -71.05 -51.21 36.89 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 C-N-CA 123.362 0.665 . . . . 0.0 110.647 173.406 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 75.5 mt -61.13 -37.46 82.92 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 119.082 0.856 . . . . 0.0 112.005 179.715 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 37.3 mtp -60.59 -49.52 77.21 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 126.183 1.793 . . . . 0.0 111.672 171.416 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -62.1 -39.61 93.07 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 175.043 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 90.6 mt-30 -61.88 -44.47 96.75 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 119.209 0.913 . . . . 0.0 111.98 175.465 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.62 -42.76 95.29 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.656 0.782 . . . . 0.0 112.785 176.851 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 85.3 mt -63.26 -44.89 93.84 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.282 0.633 . . . . 0.0 111.634 172.708 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -60.85 -41.43 95.86 Favored 'General case' 0 CA--C 1.538 0.483 0 O-C-N 121.145 -0.972 . . . . 0.0 112.744 -177.936 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 55.5 mtmt -60.06 -28.49 67.84 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 175.297 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 58.5 mt -84.9 -39.89 14.56 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 C-N-CA 123.481 0.712 . . . . 0.0 111.901 173.251 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -51.88 -51.34 57.49 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.134 -0.978 . . . . 0.0 110.554 172.034 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 99.3 mt -62.35 -40.88 97.84 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.596 0.758 . . . . 0.0 113.006 179.229 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -70.83 -28.4 64.59 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.663 1.119 . . . . 0.0 112.996 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 70.8 mmtt -76.14 -47.09 25.61 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 117.925 -1.036 . . . . 0.0 112.74 173.723 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 9.1 m -68.41 -24.92 30.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 CA-C-N 121.024 1.738 . . . . 0.0 112.187 176.024 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -60.19 -28.08 67.66 Favored 'General case' 0 CA--C 1.541 0.633 0 O-C-N 121.523 -0.736 . . . . 0.0 112.682 171.058 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 93.7 mt-30 -98.58 2.75 47.69 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.358 1.463 . . . . 0.0 112.769 177.709 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 8.1 ttm -53.45 141.76 42.48 Favored Pre-proline 0 CA--C 1.545 0.769 0 C-N-CA 124.863 1.265 . . . . 0.0 112.78 175.265 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -68.95 111.34 2.62 Favored 'Trans proline' 0 CA--C 1.537 0.666 0 C-N-CA 123.111 2.541 . . . . 0.0 109.02 168.729 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 -69.3 -22.1 63.82 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 -172.619 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -84.81 156.77 21.2 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.649 1.579 . . . . 0.0 111.662 175.355 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -131.09 128.84 41.01 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.739 1.216 . . . . 0.0 112.547 -168.964 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 7.7 p -150.46 146.0 16.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 125.134 1.374 . . . . 0.0 111.88 -178.521 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -63.22 140.66 58.9 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.008 1.323 . . . . 0.0 112.383 175.745 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 83.3 mt . . . . . 0 N--CA 1.472 0.643 0 N-CA-C 114.202 1.186 . . . . 0.0 114.202 -177.633 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.164 0 N-CA-C 112.621 -0.191 . . . . 0.0 112.621 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 36.0 ptt180 -144.86 154.43 42.63 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.198 1.399 . . . . 0.0 110.58 169.44 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.6 tptm -81.93 130.73 35.16 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.365 1.066 . . . . 0.0 110.279 177.438 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 65.3 p -135.24 165.22 25.93 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.972 1.309 . . . . 0.0 111.936 -169.459 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -50.31 -35.43 27.41 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 112.354 0.502 . . . . 0.0 112.354 174.617 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 14.2 mp0 -57.91 -65.1 0.69 Allowed 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.137 1.375 . . . . 0.0 111.263 173.601 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 76.1 mt -63.37 -32.71 74.21 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -175.984 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 -62.22 -54.65 37.81 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 118.473 0.578 . . . . 0.0 110.77 169.777 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 65.4 t80 -56.86 -38.26 72.46 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.881 0.872 . . . . 0.0 112.632 -179.657 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 86.1 mmm -55.07 -49.39 71.77 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 172.386 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -82.92 -18.03 41.57 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 120.385 1.448 . . . . 0.0 114.524 179.206 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 59.5 t30 -99.09 -24.56 14.85 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.77 1.228 . . . . 0.0 112.767 -170.405 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 39.9 t -130.38 -49.83 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 C-N-CA 123.945 0.898 . . . . 0.0 111.576 -179.035 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 17.1 t -72.17 -68.14 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 CA-C-N 118.943 0.792 . . . . 0.0 111.058 -170.667 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 60.4 t -58.54 -40.57 79.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 124.578 1.151 . . . . 0.0 110.199 172.702 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.4 tppt? -52.84 -51.03 62.49 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 118.837 0.744 . . . . 0.0 112.262 177.151 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 72.5 m -70.52 -43.42 69.64 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.191 0.596 . . . . 0.0 111.82 179.253 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 46.5 mt -63.71 -32.04 73.41 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.396 0.679 . . . . 0.0 112.333 179.216 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 14.3 t-105 -74.33 -30.73 62.16 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.887 1.675 . . . . 0.0 113.058 173.038 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp -79.12 -8.8 59.28 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.135 0.974 . . . . 0.0 113.402 175.619 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 38.6 t-80 -63.02 156.05 25.84 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.278 1.431 . . . . 0.0 113.436 -178.764 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 19.1 mm100 -60.34 -22.16 62.92 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.052 1.341 . . . . 0.0 114.039 174.723 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -124.31 21.24 8.76 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.155 1.382 . . . . 0.0 113.666 -172.577 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.01 -24.77 62.44 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.093 1.357 . . . . 0.0 113.95 174.377 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 64.4 p-90 -59.38 -33.88 19.39 Favored Pre-proline 0 CA--C 1.547 0.827 0 N-CA-C 117.538 2.421 . . . . 0.0 117.538 -170.898 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -79.31 2.47 8.3 Favored 'Trans proline' 0 CA--C 1.547 1.132 0 CA-C-N 122.985 2.102 . . . . 0.0 113.058 172.697 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -117.9 9.89 13.0 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.273 1.829 . . . . 0.0 113.206 178.077 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 22.5 m-30 -74.6 -17.02 60.78 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 120.396 -1.44 . . . . 0.0 113.538 174.436 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 31.4 mm-40 -149.21 148.58 27.15 Favored Pre-proline 0 CA--C 1.546 0.805 0 C-N-CA 126.495 1.918 . . . . 0.0 110.753 -178.685 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -68.05 163.26 36.54 Favored 'Trans proline' 0 CA--C 1.537 0.627 0 C-N-CA 124.085 3.19 . . . . 0.0 113.572 -177.482 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 46.9 t -72.59 89.12 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 124.685 1.194 . . . . 0.0 110.012 173.661 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -69.57 78.77 0.41 Allowed 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.824 1.25 . . . . 0.0 109.96 169.165 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -52.28 -24.92 8.22 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.677 1.362 . . . . 0.0 114.677 -174.739 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 84.9 mt -62.94 -48.89 85.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 125.204 1.401 . . . . 0.0 111.32 170.651 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 56.5 mttm -76.01 -40.97 52.44 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 125.912 1.685 . . . . 0.0 112.836 -179.159 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -72.12 -11.03 60.56 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.244 1.018 . . . . 0.0 113.555 172.43 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.5 t30 58.46 54.07 5.8 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 126.697 1.999 . . . . 0.0 112.71 178.652 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 37.2 mt -114.61 81.29 6.91 Favored Pre-proline 0 CA--C 1.543 0.691 0 C-N-CA 126.289 1.836 . . . . 0.0 110.17 -178.274 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -66.15 -12.66 36.44 Favored 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 123.325 2.683 . . . . 0.0 113.296 -177.383 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 35.0 m-20 -111.42 6.01 20.02 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 126.074 1.75 . . . . 0.0 113.365 177.598 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -54.26 -52.22 62.07 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 120.472 1.487 . . . . 0.0 112.15 -178.335 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -76.75 -15.26 59.81 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.692 1.197 . . . . 0.0 114.121 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 9.5 mptt -69.41 -44.52 71.21 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 121.304 -0.873 . . . . 0.0 110.731 174.869 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.4 mp -81.87 -51.67 14.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 C-N-CA 123.524 0.73 . . . . 0.0 110.151 173.965 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 22.7 mm -83.41 101.79 8.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 CA-C-O 122.328 1.061 . . . . 0.0 111.599 -177.683 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -65.7 -30.88 71.62 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 126.046 1.738 . . . . 0.0 113.473 178.063 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -148.6 111.72 3.66 Favored Pre-proline 0 CA--C 1.546 0.819 0 C-N-CA 125.996 1.719 . . . . 0.0 110.488 174.991 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -87.84 160.23 7.55 Favored 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 124.306 3.337 . . . . 0.0 112.016 172.968 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.5 tpt -159.3 155.71 27.36 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.84 1.256 . . . . 0.0 111.88 175.578 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -149.65 151.16 33.28 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.103 1.361 . . . . 0.0 113.42 -175.888 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 4.3 ttp -65.67 -33.24 75.42 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.244 1.017 . . . . 0.0 112.804 -174.396 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -58.53 -45.65 94.24 Favored Glycine 0 CA--C 1.528 0.875 0 C-N-CA 124.327 0.965 . . . . 0.0 112.163 176.012 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 25.4 m -70.13 -43.68 70.47 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.104 0.962 . . . . 0.0 111.885 176.308 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 83.3 mt -52.97 -52.71 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.182 0 CA-C-N 119.428 1.013 . . . . 0.0 111.413 177.994 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 6.5 ttpm? -56.43 -32.59 65.03 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.424 1.489 . . . . 0.0 113.201 177.548 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.1 tpmt? -72.72 -45.33 59.29 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.936 1.294 . . . . 0.0 113.275 177.394 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 3.1 ptp180 -69.04 -31.09 69.63 Favored 'General case' 0 N--CA 1.483 1.218 0 CA-C-N 119.49 1.041 . . . . 0.0 113.421 174.448 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 55.4 mt -64.94 -41.31 95.62 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 113.774 1.027 . . . . 0.0 113.774 169.255 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -62.3 -33.44 74.66 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 118.809 0.731 . . . . 0.0 112.756 176.709 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 52.5 m-80 -79.52 -176.49 5.31 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 125.624 1.569 . . . . 0.0 112.511 171.617 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -105.39 42.54 1.22 Allowed 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 125.555 1.542 . . . . 0.0 110.394 174.08 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 45.5 t80 -66.61 -32.99 74.67 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 114.046 1.128 . . . . 0.0 114.046 -168.921 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -139.04 -177.26 4.81 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.531 1.932 . . . . 0.0 112.755 -177.269 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 4.5 t-105 -107.57 -25.73 11.22 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.41 1.484 . . . . 0.0 112.848 -177.013 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 47.0 t -136.55 143.08 43.49 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.709 1.204 . . . . 0.0 112.162 -170.902 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -57.56 -19.3 24.5 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.625 1.17 . . . . 0.0 113.839 169.94 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 10.4 m -53.17 -36.57 61.04 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 119.098 0.863 . . . . 0.0 112.65 177.416 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -71.85 -40.92 68.67 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 123.75 0.82 . . . . 0.0 112.731 176.384 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 43.0 t -61.06 -36.51 79.8 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 123.912 0.885 . . . . 0.0 112.572 170.301 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 78.8 mtp -68.33 -39.8 81.81 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.335 1.054 . . . . 0.0 111.95 175.641 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -61.0 -40.82 95.01 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 123.236 0.614 . . . . 0.0 112.006 169.909 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -64.03 -43.11 96.55 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 121.535 -0.728 . . . . 0.0 112.245 175.53 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -61.0 -41.72 97.06 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 121.301 -0.874 . . . . 0.0 112.912 172.375 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 13.9 t30 -57.53 -50.47 72.98 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 118.398 0.544 . . . . 0.0 111.193 172.852 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 53.7 m -57.84 -38.59 75.92 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 176.571 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 19.3 ttm -59.96 -62.4 1.9 Allowed 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.515 1.052 . . . . 0.0 111.611 176.152 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -63.02 -39.82 95.91 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -176.479 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 60.8 m -66.25 -44.39 83.83 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 118.272 -0.871 . . . . 0.0 112.572 178.176 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -64.29 -32.63 74.31 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 120.921 1.691 . . . . 0.0 112.398 178.126 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 57.5 m -60.82 -43.98 97.51 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.229 0.612 . . . . 0.0 112.433 169.537 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -67.66 -32.99 74.05 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 176.604 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 80.0 mt -72.58 -58.01 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 123.613 0.765 . . . . 0.0 111.038 178.25 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -69.71 -19.53 63.56 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 114.381 1.252 . . . . 0.0 114.381 -170.861 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 36.5 m-80 -123.25 160.15 27.24 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.724 1.21 . . . . 0.0 112.144 -173.764 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.85 148.72 96.51 Favored Pre-proline 0 N--CA 1.472 0.642 0 C-N-CA 124.242 1.017 . . . . 0.0 110.641 176.918 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -65.32 -8.52 19.02 Favored 'Trans proline' 0 CA--C 1.543 0.947 0 C-N-CA 123.67 2.913 . . . . 0.0 114.723 -175.655 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 44.8 p -107.92 -4.08 18.28 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.745 2.018 . . . . 0.0 113.471 179.071 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -67.09 145.99 54.75 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 118.909 0.777 . . . . 0.0 111.11 175.838 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -52.68 -45.32 66.76 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.682 0.793 . . . . 0.0 112.736 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 9.1 tp -57.37 -35.19 48.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 124.387 1.075 . . . . 0.0 113.785 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 48.0 t -68.51 -44.38 83.07 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 C-N-CA 123.393 0.677 . . . . 0.0 110.534 174.515 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 68.9 mt -62.7 -36.43 82.92 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 118.848 0.749 . . . . 0.0 112.094 176.762 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 1.1 mmt -57.61 -52.27 66.12 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 118.241 0.473 . . . . 0.0 111.004 170.999 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -63.17 -37.37 86.95 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.582 0.753 . . . . 0.0 112.758 179.322 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 83.2 mt-30 -62.08 -40.61 96.4 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 119.607 1.094 . . . . 0.0 112.861 173.945 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -69.81 -45.46 67.83 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.545 -0.722 . . . . 0.0 112.107 176.502 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 83.1 mt -64.54 -43.97 92.31 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.622 0.769 . . . . 0.0 112.234 177.193 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -63.27 -40.95 98.83 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 119.81 1.186 . . . . 0.0 112.874 -175.647 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 36.0 mtmm -59.77 -39.62 85.49 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 121.528 -0.733 . . . . 0.0 111.954 175.831 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 77.0 mt -72.75 -41.11 61.91 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 C-N-CA 122.947 0.499 . . . . 0.0 111.424 176.467 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 16.7 t80 -51.06 -51.24 55.19 Favored 'General case' 0 CA--C 1.538 0.511 0 O-C-N 121.491 -0.756 . . . . 0.0 110.53 172.822 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 98.1 mt -65.14 -41.28 94.91 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 178.301 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -65.53 -32.16 73.61 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 120.118 1.327 . . . . 0.0 112.293 179.678 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 70.3 mmtt -75.5 -48.67 21.53 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 117.536 -1.221 . . . . 0.0 112.146 177.849 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 6.1 m -67.06 -26.76 37.42 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 CA-C-N 121.13 1.786 . . . . 0.0 112.3 177.12 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -61.22 -30.96 70.75 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 172.041 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 99.5 mt-30 -89.58 -7.92 53.76 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.992 1.317 . . . . 0.0 112.955 175.723 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 46.2 ttp -65.49 144.32 98.91 Favored Pre-proline 0 CA--C 1.547 0.84 0 CA-C-N 119.141 0.882 . . . . 0.0 111.301 173.725 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -53.69 142.94 60.0 Favored 'Trans proline' 0 CA--C 1.539 0.738 0 C-N-CA 122.548 2.165 . . . . 0.0 111.904 168.889 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -91.29 -24.0 19.97 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 112.581 0.586 . . . . 0.0 112.581 176.553 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -86.74 155.33 20.39 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.662 1.185 . . . . 0.0 111.508 172.562 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -103.09 138.56 39.77 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.196 1.398 . . . . 0.0 111.558 -174.151 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 69.2 t -137.85 124.65 28.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 125.529 1.532 . . . . 0.0 109.129 177.51 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -69.84 128.73 37.41 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.52 1.128 . . . . 0.0 111.084 169.697 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 49.8 mt . . . . . 0 N--CA 1.471 0.586 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -176.126 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.935 0 CA-C-O 120.832 0.129 . . . . 0.0 113.311 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -173.49 165.12 4.64 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 127.289 2.236 . . . . 0.0 110.983 175.737 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 5.5 mmtp -64.64 136.22 56.75 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.609 1.164 . . . . 0.0 111.959 173.833 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 71.0 p -142.0 161.84 36.97 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 126.307 1.843 . . . . 0.0 109.899 177.451 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 16.0 t30 -52.7 -33.61 48.38 Favored 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 114.622 1.341 . . . . 0.0 114.622 177.837 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -72.25 -47.15 52.45 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.084 -1.01 . . . . 0.0 112.208 174.002 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 86.1 mt -62.56 -30.88 71.63 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 121.223 -0.923 . . . . 0.0 112.33 174.903 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -58.98 -54.33 48.3 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.816 1.247 . . . . 0.0 109.947 169.126 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 63.3 t80 -58.49 -41.61 85.72 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.966 0.907 . . . . 0.0 112.909 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 96.2 mmm -54.78 -52.33 62.93 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 118.348 0.522 . . . . 0.0 111.834 173.333 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.1 tp60 -71.09 -31.79 68.24 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 113.793 1.034 . . . . 0.0 113.793 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 42.9 t30 -98.89 -16.27 18.88 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 114.658 1.355 . . . . 0.0 114.658 -166.653 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 17.2 t -132.81 -50.26 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 122.8 0.44 . . . . 0.0 111.271 -179.75 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 17.9 t -69.86 -66.41 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 123.645 0.778 . . . . 0.0 110.423 -174.291 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 48.7 t -55.1 -47.74 76.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 125.836 1.654 . . . . 0.0 110.303 173.266 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 52.0 tttt -59.8 -37.94 80.55 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.89 0.876 . . . . 0.0 113.176 -175.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 22.2 m -83.52 -38.54 21.61 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 118.542 0.61 . . . . 0.0 112.37 177.947 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 67.9 mt -60.86 -35.49 76.73 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 121.585 -0.697 . . . . 0.0 112.343 172.684 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 20.2 t-105 -70.55 -29.69 66.21 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.201 1.4 . . . . 0.0 113.543 176.507 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 55.0 mttm -71.15 -17.59 62.54 Favored 'General case' 0 N--CA 1.484 1.261 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 172.926 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 44.5 t-80 -62.37 151.15 37.64 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.58 1.152 . . . . 0.0 113.596 -171.736 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 26.4 mp0 -59.28 -16.77 23.62 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.018 1.727 . . . . 0.0 114.167 176.91 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 -124.63 17.85 8.78 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.721 1.608 . . . . 0.0 113.747 -177.403 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.24 -28.57 66.46 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 176.139 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' TRP . . . . . 0.411 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 42.9 p-90 -57.42 -38.05 63.63 Favored Pre-proline 0 CA--C 1.547 0.86 0 N-CA-C 117.613 2.449 . . . . 0.0 117.613 -170.201 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.411 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 73.3 Cg_endo -70.97 -6.26 18.8 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 CA-C-N 123.115 2.148 . . . . 0.0 114.225 173.485 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 56.6 m-85 -109.61 -4.32 16.28 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.343 1.457 . . . . 0.0 112.921 178.646 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 21.0 m-30 -62.43 -18.26 61.28 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 114.343 1.238 . . . . 0.0 114.343 178.764 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 86.5 mt-30 -143.79 155.75 59.46 Favored Pre-proline 0 CA--C 1.544 0.727 0 C-N-CA 125.787 1.635 . . . . 0.0 110.559 -175.165 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -64.84 146.36 87.96 Favored 'Trans proline' 0 CA--C 1.539 0.773 0 C-N-CA 122.733 2.289 . . . . 0.0 111.862 173.436 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 95.9 t -62.13 120.54 8.6 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 123.932 0.893 . . . . 0.0 111.732 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 38.2 m-20 -89.02 89.45 7.99 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.505 1.122 . . . . 0.0 109.952 169.646 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.95 -28.11 48.85 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 113.603 0.964 . . . . 0.0 113.603 178.54 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 81.8 mt -64.86 -50.08 76.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 124.876 1.27 . . . . 0.0 111.039 172.963 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -66.86 -41.17 87.76 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.039 1.336 . . . . 0.0 112.807 -179.223 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.4 mp -80.2 -3.78 50.44 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.124 0.969 . . . . 0.0 113.21 176.359 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 61.8 t30 54.89 55.73 7.45 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 126.259 1.824 . . . . 0.0 113.448 -179.422 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 44.1 mt -115.2 80.43 7.26 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 126.587 1.955 . . . . 0.0 110.594 -176.301 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -68.88 -4.7 13.91 Favored 'Trans proline' 0 CA--C 1.544 1.023 0 C-N-CA 123.992 3.128 . . . . 0.0 114.418 -175.203 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -124.54 15.11 8.84 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.524 1.929 . . . . 0.0 111.951 179.195 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -51.12 -57.12 9.54 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 120.727 -1.233 . . . . 0.0 112.788 -176.345 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -73.54 -2.41 22.63 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.962 1.305 . . . . 0.0 114.194 178.0 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -84.52 -43.23 14.74 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.395 1.078 . . . . 0.0 110.611 176.807 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.3 mp -82.14 -47.57 19.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 C-N-CA 124.397 1.079 . . . . 0.0 110.423 172.823 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.593 HD11 ' HB2' ' A' ' 115' ' ' TYR . 34.4 mm -78.6 113.7 18.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 123.549 0.74 . . . . 0.0 111.254 -179.04 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -77.01 -31.05 56.14 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.947 1.299 . . . . 0.0 112.575 174.302 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 18.4 p30 -149.88 83.29 6.29 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 125.609 1.564 . . . . 0.0 112.215 -168.806 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -70.34 138.42 35.93 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 123.179 2.586 . . . . 0.0 110.932 178.902 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 8.5 tpt -156.32 137.58 13.81 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.863 1.265 . . . . 0.0 110.017 -174.673 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -146.17 148.31 32.41 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 125.316 1.446 . . . . 0.0 111.364 -175.356 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 9.4 ttp -57.54 -36.98 72.33 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.173 1.389 . . . . 0.0 113.181 -171.668 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.56 -27.05 65.45 Favored Glycine 0 CA--C 1.533 1.206 0 C-N-CA 124.989 1.28 . . . . 0.0 114.366 173.584 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 26.0 m -87.36 -37.28 17.23 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.457 1.103 . . . . 0.0 111.215 172.916 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 66.5 mt -56.43 -51.14 68.08 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 CA-C-N 119.61 1.096 . . . . 0.0 110.892 176.184 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 15.0 ptmm? -59.39 -37.07 77.04 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 175.919 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.71 -36.41 80.85 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.473 1.109 . . . . 0.0 112.842 -178.634 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 5.7 ptp180 -80.59 -30.62 36.89 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 114.114 1.153 . . . . 0.0 114.114 172.289 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 76.2 mt -63.74 -30.9 71.94 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-N 119.759 1.163 . . . . 0.0 113.794 168.588 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -66.16 -15.0 62.76 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 114.618 1.34 . . . . 0.0 114.618 -178.659 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -138.56 177.85 7.58 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 125.397 1.479 . . . . 0.0 113.592 -174.991 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 4.0 p30 -78.34 97.65 5.68 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 124.431 1.092 . . . . 0.0 111.78 173.356 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 78.7 t80 -131.24 -37.78 1.24 Allowed 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.54 1.136 . . . . 0.0 113.023 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -132.9 173.44 11.4 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.896 1.678 . . . . 0.0 111.098 169.831 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.6 t-105 -106.78 -19.07 13.76 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.306 1.042 . . . . 0.0 112.544 -177.894 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 78.6 p -137.63 145.71 43.05 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.487 1.115 . . . . 0.0 114.009 -170.251 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -63.53 -22.22 66.77 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 114.847 1.425 . . . . 0.0 114.847 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 15.3 p -51.54 -35.29 40.18 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.273 1.029 . . . . 0.0 113.452 174.612 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -70.01 -43.52 71.2 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.117 0.967 . . . . 0.0 112.105 176.997 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 51.0 t -63.32 -39.33 94.25 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.245 1.018 . . . . 0.0 112.298 173.04 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 86.7 mtp -61.75 -42.14 98.58 Favored 'General case' 0 N--CA 1.47 0.546 0 O-C-N 121.291 -0.881 . . . . 0.0 112.279 174.097 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 90.8 mm-40 -62.93 -38.57 91.51 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 172.27 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -63.77 -42.45 97.78 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 119.347 0.976 . . . . 0.0 112.421 174.503 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -59.66 -45.28 92.51 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.21 -0.931 . . . . 0.0 112.356 171.313 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -57.97 -46.03 85.8 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.82 -0.55 . . . . 0.0 112.222 174.63 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 84.0 m -63.75 -38.31 90.64 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.177 0.991 . . . . 0.0 112.669 176.415 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 51.0 ttp -59.13 -53.07 62.55 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 119.385 0.993 . . . . 0.0 112.03 176.214 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -68.33 -39.53 81.91 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 121.996 -0.44 . . . . 0.0 112.081 179.367 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 86.4 m -64.24 -48.26 76.5 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.65 0.78 . . . . 0.0 112.063 -179.719 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -64.06 -32.18 73.64 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 119.055 0.843 . . . . 0.0 112.067 -179.7 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 88.7 m -61.16 -44.24 97.63 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.731 0.812 . . . . 0.0 112.885 170.406 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 17.0 m-85 -67.63 -29.45 68.76 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 114.031 1.122 . . . . 0.0 114.031 178.326 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 87.5 mt -68.83 -56.91 10.43 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 123.136 0.574 . . . . 0.0 110.648 175.655 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' TYR . . . . . 0.593 ' HB2' HD11 ' A' ' 77' ' ' ILE . 25.8 t80 -69.61 -37.83 77.03 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 -173.028 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 52.3 m-80 -103.55 151.88 22.36 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.408 1.083 . . . . 0.0 111.164 -172.468 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.34 153.87 93.97 Favored Pre-proline 0 N--CA 1.469 0.493 0 C-N-CA 123.804 0.842 . . . . 0.0 111.135 178.909 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -64.02 -3.28 5.71 Favored 'Trans proline' 0 CA--C 1.547 1.133 0 C-N-CA 124.288 3.325 . . . . 0.0 114.79 -178.67 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 62.1 p -122.22 0.02 9.47 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 126.944 2.097 . . . . 0.0 113.256 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 65.5 m-20 -67.93 146.1 53.93 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 118.886 0.766 . . . . 0.0 110.759 170.534 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -56.45 -46.46 80.31 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 121.537 -0.727 . . . . 0.0 112.36 -176.555 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.5 tp -55.38 -29.84 24.48 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 125.008 1.323 . . . . 0.0 114.321 177.857 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 40.3 t -72.31 -47.22 53.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 O-C-N 121.272 -0.893 . . . . 0.0 110.431 173.308 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 71.0 mt -61.03 -36.97 80.94 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 118.943 0.792 . . . . 0.0 111.617 176.467 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 9.4 mtt -58.92 -51.88 68.13 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.957 1.303 . . . . 0.0 112.081 169.941 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.6 -40.08 90.51 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.349 0.659 . . . . 0.0 112.702 176.825 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 89.1 mt-30 -61.73 -45.92 91.85 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 119.072 0.851 . . . . 0.0 111.975 173.765 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -67.65 -28.72 67.96 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.55 1.14 . . . . 0.0 113.794 178.756 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 77.1 mt -76.72 -46.84 23.87 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.513 0.725 . . . . 0.0 111.455 169.517 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -61.4 -40.36 94.1 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.186 0.903 . . . . 0.0 113.084 -174.548 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -60.52 -33.72 73.05 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 113.187 0.81 . . . . 0.0 113.187 177.254 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 48.1 mt -78.75 -43.21 25.36 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 124.026 0.93 . . . . 0.0 111.415 173.463 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -49.33 -50.06 41.28 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 120.036 1.289 . . . . 0.0 110.907 172.168 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 99.9 mt -62.99 -42.72 99.92 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 113.126 0.788 . . . . 0.0 113.126 179.25 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -69.7 -28.44 65.83 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.793 1.179 . . . . 0.0 112.782 178.823 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 33.9 mmtm -72.8 -52.03 16.6 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 125.423 1.489 . . . . 0.0 111.639 175.93 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.9 m -68.89 -25.09 29.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 CA-C-N 119.88 1.218 . . . . 0.0 112.382 178.237 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -59.15 -29.01 67.11 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 173.071 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -92.57 -4.11 53.97 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.637 1.175 . . . . 0.0 112.866 176.371 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 40.7 ttp -65.87 139.14 96.7 Favored Pre-proline 0 CA--C 1.546 0.814 0 O-C-N 121.189 -0.945 . . . . 0.0 110.371 170.557 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -65.74 133.25 33.32 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 122.929 2.419 . . . . 0.0 110.896 176.103 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -69.1 -30.8 69.16 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 178.317 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -76.57 162.04 28.1 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.651 1.58 . . . . 0.0 111.153 169.383 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -134.81 145.19 48.11 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.678 1.191 . . . . 0.0 111.802 -176.741 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 54.9 t -131.55 134.17 60.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 125.311 1.444 . . . . 0.0 110.622 -174.472 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -69.19 120.61 15.29 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.599 1.559 . . . . 0.0 111.399 171.004 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 91.2 mt . . . . . 0 N--CA 1.472 0.65 0 C-N-CA 124.115 0.966 . . . . 0.0 112.986 -179.347 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.82 0 N-CA-C 115.34 0.896 . . . . 0.0 115.34 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 47.7 mtm180 -145.75 179.47 7.42 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 127.129 2.172 . . . . 0.0 111.681 -172.939 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 40.1 tttm -128.49 69.89 1.37 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 127.196 2.198 . . . . 0.0 109.063 172.389 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 50.3 p -82.71 170.54 14.98 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.313 1.445 . . . . 0.0 113.501 -175.64 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 27.6 p-10 -48.47 -37.43 17.31 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 125.084 1.354 . . . . 0.0 114.503 169.666 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -72.82 -49.58 29.51 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 121.481 -0.762 . . . . 0.0 111.539 178.761 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 93.5 mt -63.53 -30.98 72.02 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 121.552 -0.717 . . . . 0.0 112.386 175.945 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.465 ' HB2' HD11 ' A' ' 147' ' ' LEU . 52.3 tt0 -58.79 -53.78 54.47 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 123.635 0.774 . . . . 0.0 110.498 168.835 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -59.67 -39.76 85.56 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.794 0.838 . . . . 0.0 112.772 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 93.0 mmm -55.89 -49.19 74.08 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 121.559 -0.713 . . . . 0.0 111.668 171.257 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -85.65 -3.79 58.98 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 115.046 1.499 . . . . 0.0 115.046 -175.777 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 37.1 m-80 -122.08 -16.76 7.42 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.305 1.442 . . . . 0.0 114.46 -176.628 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 54.8 t -134.07 -50.26 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 123.77 0.828 . . . . 0.0 111.359 -179.399 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 22.0 t -69.65 -63.19 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 CA-C-N 119.16 0.891 . . . . 0.0 110.594 -174.36 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 85.1 t -58.65 -44.66 90.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 123.946 0.898 . . . . 0.0 110.405 172.967 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? -56.91 -45.01 82.92 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.949 0.9 . . . . 0.0 112.614 -177.462 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 56.4 m -72.75 -45.04 60.74 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 122.813 0.445 . . . . 0.0 111.679 177.805 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 69.8 mt -62.97 -33.54 75.6 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.137 0.575 . . . . 0.0 112.237 179.331 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 19.5 t-105 -71.55 -29.85 65.21 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.288 1.435 . . . . 0.0 113.339 174.073 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -80.49 -7.8 59.32 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 176.032 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 40.2 t-80 -64.02 154.28 34.71 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.691 1.196 . . . . 0.0 113.357 -179.451 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -61.95 -17.59 57.44 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.143 1.377 . . . . 0.0 114.179 175.721 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -122.9 17.33 10.14 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.557 1.543 . . . . 0.0 113.664 -174.837 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.53 -27.99 65.64 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 114.165 1.172 . . . . 0.0 114.165 177.466 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' TRP . . . . . 0.408 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 43.3 p-90 -57.65 -37.81 60.44 Favored Pre-proline 0 CA--C 1.548 0.882 0 N-CA-C 117.808 2.521 . . . . 0.0 117.808 -169.636 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.408 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 97.9 Cg_endo -74.09 -3.46 13.83 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 CA-C-N 123.143 2.158 . . . . 0.0 113.9 173.609 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -109.96 -4.67 15.79 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.475 1.51 . . . . 0.0 112.969 178.094 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 22.5 m-30 -63.11 -16.39 59.83 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 114.143 1.164 . . . . 0.0 114.143 175.788 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 90.3 mt-30 -145.73 157.96 50.47 Favored Pre-proline 0 CA--C 1.546 0.817 0 C-N-CA 126.175 1.79 . . . . 0.0 110.837 -175.567 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -66.53 155.35 70.63 Favored 'Trans proline' 0 C--N 1.35 0.63 0 C-N-CA 122.933 2.422 . . . . 0.0 111.844 171.917 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 37.1 t -76.61 99.72 2.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 124.202 1.001 . . . . 0.0 109.879 177.974 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -71.6 88.63 0.95 Allowed 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.319 1.048 . . . . 0.0 111.351 175.193 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.64 -31.16 46.29 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.576 1.15 . . . . 0.0 114.094 -179.154 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 84.3 mt -66.12 -49.33 77.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 124.702 1.201 . . . . 0.0 111.075 174.476 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -65.42 -37.01 85.67 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 125.464 1.505 . . . . 0.0 113.376 -179.026 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.8 mp -88.25 -2.97 58.91 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.431 1.493 . . . . 0.0 112.558 177.921 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 24.1 m120 52.55 57.97 5.86 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.015 1.726 . . . . 0.0 113.255 -178.237 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 47.0 mt -114.29 81.75 6.82 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 126.625 1.97 . . . . 0.0 109.992 -179.369 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -67.19 -8.65 22.54 Favored 'Trans proline' 0 CA--C 1.543 0.963 0 C-N-CA 123.969 3.113 . . . . 0.0 113.684 -175.183 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 18.7 p-10 -118.21 8.2 12.27 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 127.988 2.515 . . . . 0.0 113.078 179.781 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 86.3 t80 -52.25 -57.24 10.31 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 120.164 1.347 . . . . 0.0 112.124 -179.215 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 99.8 m-70 -75.89 -5.93 48.39 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.21 1.404 . . . . 0.0 114.104 178.126 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -78.08 -32.65 50.84 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.974 0.909 . . . . 0.0 111.419 174.579 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.1 mp -98.26 -44.85 12.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 125.734 1.613 . . . . 0.0 111.296 175.371 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 21.3 mm -71.48 114.65 10.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 123.552 0.741 . . . . 0.0 110.929 176.904 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.69 -35.9 51.73 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 124.709 1.204 . . . . 0.0 113.226 172.448 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 15.2 p30 -145.34 83.81 8.9 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 125.213 1.405 . . . . 0.0 112.119 -167.906 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -68.63 138.58 42.02 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 123.482 2.788 . . . . 0.0 110.927 178.993 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.9 tpt -159.58 145.55 16.03 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 125.352 1.461 . . . . 0.0 110.116 -175.43 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -149.77 152.42 35.2 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.869 1.267 . . . . 0.0 112.005 -177.798 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 6.8 ttp -59.72 -33.87 72.18 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.524 1.129 . . . . 0.0 112.564 -177.51 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.51 -23.45 60.5 Favored Glycine 0 CA--C 1.536 1.366 0 C-N-CA 125.86 1.695 . . . . 0.0 114.977 172.123 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 89.8 m -97.11 -37.04 10.28 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.393 1.077 . . . . 0.0 111.372 173.178 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 98.7 mt -53.45 -49.75 52.59 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 CA-C-N 119.877 1.217 . . . . 0.0 111.088 175.368 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.7 -30.3 65.4 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 113.828 1.048 . . . . 0.0 113.828 175.846 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.449 ' HE3' ' HA ' ' A' ' 88' ' ' LYS . 1.2 tpmt? -80.17 -35.61 36.21 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.099 0.96 . . . . 0.0 112.992 -175.811 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 9.4 ptp180 -70.27 -29.84 66.73 Favored 'General case' 0 N--CA 1.482 1.138 0 CA-C-N 119.399 0.999 . . . . 0.0 113.03 169.457 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 70.3 mt -63.58 -43.32 97.32 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.664 0.786 . . . . 0.0 112.341 169.213 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -71.93 -2.22 17.25 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 114.662 1.356 . . . . 0.0 114.662 175.082 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 39.4 m-80 -124.77 15.05 8.67 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.667 1.587 . . . . 0.0 113.565 -177.539 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 40.62 47.83 2.45 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 126.247 1.819 . . . . 0.0 114.287 -179.478 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 85.8 t80 -63.17 -20.64 65.59 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 126.243 1.817 . . . . 0.0 114.179 -170.318 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -143.18 164.82 29.14 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 128.158 2.583 . . . . 0.0 111.729 -171.009 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 23.9 t-105 -87.6 -25.38 23.61 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.804 1.242 . . . . 0.0 112.703 -179.184 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 6.4 t -145.68 152.52 39.76 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 125.418 1.487 . . . . 0.0 111.981 -169.547 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -67.38 -15.76 63.86 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 115.248 1.574 . . . . 0.0 115.248 -176.622 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 32.0 p -54.06 -34.93 61.37 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 177.844 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -72.36 -41.36 66.49 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.669 0.787 . . . . 0.0 111.989 176.651 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 48.0 t -62.71 -40.48 97.27 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 123.914 0.886 . . . . 0.0 111.838 172.99 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 88.2 mtp -60.63 -41.69 95.38 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.9 0.88 . . . . 0.0 112.075 172.657 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 43.2 mm-40 -66.82 -30.32 70.48 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 173.617 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 80.3 m-20 -69.8 -39.95 76.24 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 119.702 1.137 . . . . 0.0 112.075 172.601 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -60.98 -47.99 83.89 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 121.631 -0.668 . . . . 0.0 111.959 169.658 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 33.0 t30 -55.45 -44.54 76.45 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.616 0.766 . . . . 0.0 111.805 173.895 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 96.0 m -61.49 -46.8 88.48 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.207 1.003 . . . . 0.0 111.884 177.358 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 50.7 ttp -56.75 -52.91 63.18 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.1 0.96 . . . . 0.0 112.439 177.567 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -67.16 -39.48 86.5 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.744 -0.597 . . . . 0.0 112.139 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 96.8 m -64.32 -47.89 77.69 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.951 0.9 . . . . 0.0 112.013 178.769 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.3 p30 -63.72 -30.66 71.73 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 118.814 0.734 . . . . 0.0 112.382 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 67.4 m -64.25 -42.24 96.59 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.279 1.031 . . . . 0.0 112.54 172.427 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 15.0 m-85 -68.23 -29.75 68.64 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 177.704 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 88.1 mt -69.73 -56.34 11.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 123.331 0.652 . . . . 0.0 110.557 176.569 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 57.4 t80 -70.49 -38.43 74.37 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 114.595 1.332 . . . . 0.0 114.595 -172.004 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 59.9 m-80 -97.36 159.26 15.02 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.262 1.025 . . . . 0.0 111.939 -175.103 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -68.85 150.55 97.59 Favored Pre-proline 0 N--CA 1.473 0.676 0 O-C-N 121.299 -0.875 . . . . 0.0 109.721 173.282 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -65.66 -1.75 5.35 Favored 'Trans proline' 0 CA--C 1.546 1.115 0 C-N-CA 123.854 3.036 . . . . 0.0 114.722 -179.119 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 56.2 p -120.88 -0.33 10.13 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 126.947 2.099 . . . . 0.0 113.198 -179.301 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -66.75 145.77 55.17 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.601 -0.687 . . . . 0.0 110.805 170.478 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -56.45 -45.42 80.85 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.445 -0.784 . . . . 0.0 112.441 -176.955 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.6 tp -55.7 -29.93 26.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 124.955 1.302 . . . . 0.0 114.171 177.148 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 42.3 t -72.81 -45.97 54.65 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 O-C-N 121.314 -0.866 . . . . 0.0 110.519 173.398 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 68.5 mt -61.44 -36.76 81.27 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 119.137 0.88 . . . . 0.0 111.675 176.231 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 11.5 mtt -59.39 -52.48 65.42 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.581 1.152 . . . . 0.0 111.994 169.72 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -59.56 -40.26 86.73 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.589 0.755 . . . . 0.0 112.431 177.165 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -61.21 -50.39 73.3 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.977 0.911 . . . . 0.0 111.745 174.437 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -63.07 -40.0 96.38 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.434 0.693 . . . . 0.0 112.823 179.573 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 73.7 mt -65.53 -46.88 77.86 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.485 0.714 . . . . 0.0 111.72 172.167 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -62.78 -37.4 86.5 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.11 -0.994 . . . . 0.0 112.908 -177.912 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 23.5 mmmt -55.79 -41.82 74.66 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.234 1.014 . . . . 0.0 112.214 172.175 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 78.2 mt -78.18 -39.06 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 C-N-CA 123.921 0.888 . . . . 0.0 111.288 178.386 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 31.9 t80 -50.85 -51.99 45.82 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.53 -0.731 . . . . 0.0 110.302 172.08 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.9 mt -62.53 -41.8 99.11 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 178.25 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -67.64 -30.15 69.64 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 119.885 1.221 . . . . 0.0 112.664 179.807 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 69.8 mmtt -76.65 -50.18 14.37 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 117.646 -1.168 . . . . 0.0 112.505 175.509 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 6.6 m -66.71 -25.34 34.56 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 CA-C-N 121.084 1.765 . . . . 0.0 112.329 178.515 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -58.93 -28.25 66.05 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 171.284 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 95.0 mm-40 -95.95 -4.73 42.82 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.07 1.348 . . . . 0.0 112.925 177.129 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 41.6 ttp -64.96 137.3 97.11 Favored Pre-proline 0 CA--C 1.545 0.779 0 O-C-N 121.402 -0.811 . . . . 0.0 109.994 169.629 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -67.85 131.3 23.74 Favored 'Trans proline' 0 CA--C 1.535 0.538 0 C-N-CA 122.642 2.228 . . . . 0.0 110.72 178.947 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 83.0 mt-30 -70.35 -24.95 63.07 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -76.72 154.82 33.76 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.187 0.995 . . . . 0.0 112.469 169.807 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -132.4 133.22 43.65 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.363 1.065 . . . . 0.0 110.827 -172.216 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 7.8 p -150.47 142.73 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 124.678 1.191 . . . . 0.0 111.56 -177.736 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -65.11 142.3 58.42 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-O 121.554 0.692 . . . . 0.0 111.179 171.801 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 147' ' ' LEU . . . . . 0.465 HD11 ' HB2' ' A' ' 40' ' ' GLN . 98.6 mt . . . . . 0 CA--C 1.543 0.699 0 N-CA-C 113.882 1.067 . . . . 0.0 113.882 -178.975 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.001 0 CA-C-O 121.109 0.283 . . . . 0.0 113.705 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 12.4 ptm180 -163.34 162.05 24.85 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 126.602 1.961 . . . . 0.0 110.974 172.23 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 47.8 pttt -61.48 142.4 57.04 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 170.299 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 69.7 p -148.22 165.34 31.23 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 126.763 2.025 . . . . 0.0 110.895 179.661 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 19.7 p-10 -51.41 -35.37 38.8 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 114.561 1.319 . . . . 0.0 114.561 175.781 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -69.37 -50.64 44.3 Favored 'General case' 0 CA--C 1.531 0.243 0 O-C-N 121.899 -0.501 . . . . 0.0 110.531 178.875 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 86.9 mt -61.44 -34.88 76.16 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.983 0.913 . . . . 0.0 112.052 175.879 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.5 ' HB2' HD11 ' A' ' 147' ' ' LEU . 7.5 tp60 -59.41 -52.73 64.35 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.253 1.021 . . . . 0.0 111.516 171.736 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 73.3 t80 -55.04 -42.54 72.8 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.128 0.971 . . . . 0.0 112.269 177.019 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.413 ' HG3' ' HB1' ' A' ' 98' ' ' ALA . 96.0 mmm -58.27 -51.11 71.15 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.291 0.636 . . . . 0.0 112.615 174.865 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -79.33 -15.02 58.6 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 114.952 1.464 . . . . 0.0 114.952 179.455 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 35.5 m-20 -103.52 -19.5 14.36 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 119.644 1.111 . . . . 0.0 113.902 -174.72 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 39.3 t -133.64 -48.55 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 123.926 0.89 . . . . 0.0 111.506 -178.876 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.424 HG22 ' HB3' ' A' ' 136' ' ' LYS . 19.9 t -72.3 -64.42 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 CA-C-N 119.015 0.825 . . . . 0.0 110.908 -171.865 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 86.5 t -57.06 -43.3 80.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 124.098 0.959 . . . . 0.0 109.939 171.335 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 12.2 tppt? -58.89 -34.48 71.7 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.195 0.998 . . . . 0.0 113.341 -178.328 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 78.1 m -84.01 -42.97 15.64 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 118.716 0.689 . . . . 0.0 111.555 175.673 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 67.9 mt -61.85 -33.04 73.44 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.567 0.747 . . . . 0.0 112.313 177.693 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 19.8 t-105 -74.71 -28.73 60.93 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.782 1.633 . . . . 0.0 113.303 175.335 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 32.5 mtmm -74.71 -13.55 60.63 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 114.001 1.112 . . . . 0.0 114.001 171.843 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 36.1 t-80 -61.92 154.5 26.11 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.386 1.075 . . . . 0.0 113.507 -175.141 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 65.4 mt-30 -59.87 -18.27 43.13 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.345 1.458 . . . . 0.0 114.148 176.019 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -126.36 20.51 7.38 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.372 1.469 . . . . 0.0 113.882 -174.221 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.1 -28.08 65.11 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 113.774 1.028 . . . . 0.0 113.774 175.177 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' TRP . . . . . 0.408 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 49.7 p-90 -57.89 -37.14 52.56 Favored Pre-proline 0 CA--C 1.548 0.878 0 N-CA-C 117.689 2.477 . . . . 0.0 117.689 -170.171 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.408 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 87.4 Cg_endo -73.02 -5.32 16.99 Favored 'Trans proline' 0 CA--C 1.542 0.924 0 CA-C-N 123.048 2.124 . . . . 0.0 113.925 173.606 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 72.0 m-85 -109.01 -4.87 16.33 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.312 1.445 . . . . 0.0 113.135 178.476 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -61.97 -18.24 59.73 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 114.327 1.232 . . . . 0.0 114.327 179.388 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -141.44 154.41 66.87 Favored Pre-proline 0 CA--C 1.544 0.718 0 C-N-CA 125.995 1.718 . . . . 0.0 110.348 179.36 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -67.67 150.19 79.37 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 122.755 2.303 . . . . 0.0 112.626 176.732 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 89.2 t -62.59 142.24 16.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 123.892 0.877 . . . . 0.0 110.904 171.375 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -125.06 96.0 4.7 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.467 1.507 . . . . 0.0 109.767 174.214 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.8 -29.18 59.29 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -178.15 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 85.3 mt -64.88 -49.04 81.8 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 124.652 1.181 . . . . 0.0 110.831 173.816 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -68.19 -42.05 80.5 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.092 1.357 . . . . 0.0 112.731 -179.501 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.6 mp -78.79 -5.15 52.61 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 124.418 1.087 . . . . 0.0 113.231 176.274 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 61.5 t30 55.34 53.67 9.63 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.213 1.805 . . . . 0.0 113.647 -179.224 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 25.7 mt -113.43 86.39 10.0 Favored Pre-proline 0 CA--C 1.544 0.715 0 C-N-CA 126.285 1.834 . . . . 0.0 110.094 -177.374 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_endo -67.82 -4.1 11.66 Favored 'Trans proline' 0 CA--C 1.543 0.965 0 C-N-CA 123.548 2.832 . . . . 0.0 113.247 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 16.9 p-10 -123.7 1.25 8.8 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 127.35 2.26 . . . . 0.0 114.277 -178.436 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -54.42 -51.1 65.97 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 120.288 1.404 . . . . 0.0 112.034 178.056 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 99.7 m-70 -77.26 1.99 16.95 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.607 1.563 . . . . 0.0 114.281 177.912 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.6 mmtp -95.92 -42.55 8.24 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.835 1.254 . . . . 0.0 110.553 177.0 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.9 mp -76.59 -48.33 26.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 C-N-CA 124.05 0.94 . . . . 0.0 110.279 171.357 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 36.6 mm -96.3 128.7 47.25 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 124.318 1.047 . . . . 0.0 111.35 -177.985 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -95.86 -37.86 10.54 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.831 1.252 . . . . 0.0 111.588 -178.597 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 42.2 m-20 -130.13 78.73 74.17 Favored Pre-proline 0 CA--C 1.547 0.863 0 C-N-CA 125.421 1.488 . . . . 0.0 109.963 -173.063 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -71.13 143.96 45.65 Favored 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 123.948 3.099 . . . . 0.0 111.6 -179.514 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 8.5 tpt -156.88 141.09 16.47 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.316 1.046 . . . . 0.0 111.875 -171.587 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -148.99 150.8 33.45 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 125.765 1.626 . . . . 0.0 112.409 -175.792 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 7.0 ttp -59.04 -36.84 75.68 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.893 1.277 . . . . 0.0 113.77 -171.355 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -59.99 -21.27 55.62 Favored Glycine 0 CA--C 1.533 1.183 0 C-N-CA 125.591 1.567 . . . . 0.0 114.739 175.025 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 35.1 m -90.18 -42.04 11.27 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.724 0.81 . . . . 0.0 111.196 173.367 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 66.4 mt -56.15 -48.28 79.43 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 124.215 1.006 . . . . 0.0 111.407 -178.854 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.78 -33.59 66.78 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 178.531 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 2.5 tppp? -74.31 -41.89 60.41 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.483 1.113 . . . . 0.0 112.362 -178.944 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 4.6 ptp180 -71.52 -30.9 66.46 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 172.882 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 23.7 mt -61.31 -39.16 89.47 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.292 0.951 . . . . 0.0 113.404 169.547 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -67.58 -13.13 61.8 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 115.354 1.613 . . . . 0.0 115.354 -174.889 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -132.67 175.36 9.39 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.426 1.49 . . . . 0.0 113.727 -178.357 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -77.69 80.84 4.14 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 125.0 1.32 . . . . 0.0 111.999 -178.259 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 49.3 t80 -114.79 -36.5 4.48 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.815 1.246 . . . . 0.0 113.097 -175.889 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -137.92 169.95 16.9 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 127.431 2.292 . . . . 0.0 110.925 171.769 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.1 t-105 -102.19 -23.84 13.99 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.675 1.19 . . . . 0.0 112.763 -175.975 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 35.3 t -139.34 146.51 40.36 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.897 1.279 . . . . 0.0 111.003 177.937 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' ALA . . . . . 0.413 ' HB1' ' HG3' ' A' ' 42' ' ' MET . . . -59.74 -13.99 12.49 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.789 2.036 . . . . 0.0 115.133 176.14 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 53.5 p -52.23 -33.0 39.33 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 120.564 1.529 . . . . 0.0 113.353 172.503 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -74.86 -39.56 61.49 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.608 1.163 . . . . 0.0 112.479 176.412 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -71.89 -31.05 66.03 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 124.142 0.977 . . . . 0.0 112.391 178.157 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 86.2 mtp -62.18 -40.72 96.98 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 125.114 1.365 . . . . 0.0 111.875 170.414 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -66.31 -31.08 71.65 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 174.658 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -67.85 -42.77 80.86 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 119.42 1.009 . . . . 0.0 111.659 170.439 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -59.96 -44.7 94.27 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 121.072 -1.018 . . . . 0.0 112.646 171.818 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 19.3 t30 -57.45 -44.58 84.87 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 121.57 -0.706 . . . . 0.0 111.656 172.806 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 63.7 m -65.66 -35.76 81.71 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.333 1.053 . . . . 0.0 112.528 178.939 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 16.5 ttm -58.89 -60.27 4.13 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.982 0.913 . . . . 0.0 111.475 173.953 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -63.63 -38.58 91.65 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 122.612 0.365 . . . . 0.0 111.781 -177.684 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 72.9 m -64.8 -47.85 76.58 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.377 0.671 . . . . 0.0 112.133 178.036 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -64.64 -30.98 72.01 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 120.155 1.343 . . . . 0.0 112.406 178.754 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 85.5 m -62.35 -45.98 90.75 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.356 0.662 . . . . 0.0 112.229 170.072 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -66.12 -34.45 78.08 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 177.126 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 77.4 mt -69.78 -57.6 7.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 C-N-CA 123.407 0.683 . . . . 0.0 110.782 177.583 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 48.7 t80 -69.45 -26.71 64.73 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -171.069 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 46.0 m-80 -114.76 161.04 18.7 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.091 0.956 . . . . 0.0 112.45 -171.9 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -66.26 146.01 99.01 Favored Pre-proline 0 N--CA 1.473 0.695 0 C-N-CA 124.228 1.011 . . . . 0.0 110.341 176.398 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -65.89 -7.84 17.99 Favored 'Trans proline' 0 CA--C 1.542 0.924 0 C-N-CA 123.659 2.906 . . . . 0.0 114.595 -175.946 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 56.8 p -115.26 0.96 13.67 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 126.703 2.001 . . . . 0.0 113.175 179.133 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -65.83 148.0 52.47 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 121.476 -0.765 . . . . 0.0 110.844 172.956 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -51.55 -49.55 61.78 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 123.417 0.687 . . . . 0.0 112.203 178.895 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 9.7 tp -57.28 -30.14 34.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 -179.221 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 42.7 t -73.15 -47.08 48.76 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 O-C-N 121.515 -0.74 . . . . 0.0 110.588 173.832 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 80.3 mt -61.29 -37.39 83.01 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 119.11 0.868 . . . . 0.0 111.649 176.801 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 8.8 mtt -59.12 -51.14 71.32 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.993 1.317 . . . . 0.0 111.915 169.898 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.09 -39.67 86.93 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 176.196 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -62.49 -45.32 93.54 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 119.502 1.046 . . . . 0.0 111.872 174.094 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -66.57 -29.61 69.72 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.304 1.042 . . . . 0.0 113.724 179.637 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 80.4 mt -78.05 -47.61 17.99 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.976 0.91 . . . . 0.0 111.65 169.91 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -62.1 -38.65 89.69 Favored 'General case' 0 N--CA 1.468 0.45 0 O-C-N 121.05 -1.032 . . . . 0.0 113.128 -174.486 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 19.7 pttp -58.26 -42.88 87.44 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 118.783 0.72 . . . . 0.0 111.874 176.179 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 77.0 mt -67.74 -46.49 82.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 C-N-CA 124.3 1.04 . . . . 0.0 110.743 176.073 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 44.8 t80 -50.94 -50.63 57.44 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.142 0.883 . . . . 0.0 111.237 173.753 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.1 mt -62.98 -41.21 99.5 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 179.151 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -61.43 -37.96 85.41 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 119.409 1.004 . . . . 0.0 112.955 173.154 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 136' ' ' LYS . . . . . 0.424 ' HB3' HG22 ' A' ' 46' ' ' VAL . 71.6 mmtt -72.47 -49.5 32.79 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.175 0.99 . . . . 0.0 112.616 179.709 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 7.1 m -69.21 -25.79 30.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 CA-C-N 119.955 1.252 . . . . 0.0 112.126 177.96 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -59.37 -31.02 68.83 Favored 'General case' 0 CA--C 1.541 0.596 0 O-C-N 121.607 -0.683 . . . . 0.0 112.208 171.377 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 29.1 mm100 -97.0 3.84 51.79 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.239 1.415 . . . . 0.0 113.106 177.729 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 9.6 ttm -54.26 140.89 53.32 Favored Pre-proline 0 CA--C 1.546 0.826 0 C-N-CA 124.642 1.177 . . . . 0.0 112.164 174.392 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -68.82 112.62 2.95 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 122.901 2.401 . . . . 0.0 109.008 168.184 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -68.81 -20.13 64.31 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 -173.654 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -82.41 157.7 23.59 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.547 1.539 . . . . 0.0 112.269 176.92 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -117.65 128.22 54.71 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.608 1.563 . . . . 0.0 110.865 -174.848 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 63.4 t -141.88 135.07 29.1 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 126.472 1.909 . . . . 0.0 109.901 -171.972 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -70.55 131.29 43.76 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.534 1.534 . . . . 0.0 112.404 175.602 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 147' ' ' LEU . . . . . 0.5 HD11 ' HB2' ' A' ' 40' ' ' GLN . 93.9 mt . . . . . 0 N--CA 1.474 0.767 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 177.89 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.164 0 N-CA-C 112.165 -0.374 . . . . 0.0 112.165 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 7.2 ptp180 -160.1 165.46 31.7 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 126.072 1.749 . . . . 0.0 110.44 178.881 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.0 ttpt -75.4 132.52 40.94 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 166.352 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 66.6 p -124.85 170.14 11.35 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 126.115 1.766 . . . . 0.0 108.829 177.915 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 23.8 p-10 -52.03 -32.09 32.71 Favored 'General case' 0 N--CA 1.475 0.819 0 O-C-N 121.161 -0.962 . . . . 0.0 113.349 173.94 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.9 mm-40 -70.7 -53.44 15.63 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 123.846 0.859 . . . . 0.0 111.745 177.974 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.8 mt -64.25 -32.75 74.46 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.067 0.848 . . . . 0.0 112.551 176.657 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 22.8 tt0 -59.65 -50.22 74.71 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.144 0.977 . . . . 0.0 111.146 170.126 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 62.5 t80 -57.83 -40.9 81.13 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.625 0.77 . . . . 0.0 112.376 176.63 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 82.0 mmm -56.64 -52.44 64.86 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 122.765 0.426 . . . . 0.0 112.007 174.106 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -78.24 -18.1 55.82 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 -178.837 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 42.3 m-20 -99.47 -21.56 15.9 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.594 0.961 . . . . 0.0 113.594 -173.241 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 29.3 t -135.89 -48.45 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 CA-C-O 118.511 -0.757 . . . . 0.0 111.915 -177.898 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 18.4 t -68.23 -63.67 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 CA-C-N 119.151 0.887 . . . . 0.0 110.669 -173.811 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 81.7 t -57.83 -47.13 86.83 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 C-N-CA 124.454 1.101 . . . . 0.0 110.13 173.348 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -57.41 -44.09 84.32 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 118.682 0.674 . . . . 0.0 112.703 -176.341 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 48.1 m -69.87 -46.72 64.9 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 121.977 -0.452 . . . . 0.0 111.654 176.856 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 66.7 mt -61.63 -33.46 73.97 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.236 0.614 . . . . 0.0 112.157 178.658 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 24.0 t-105 -71.29 -29.36 64.96 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.88 1.672 . . . . 0.0 113.413 176.013 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 54.2 mtmt -83.83 -8.34 59.24 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.066 0.947 . . . . 0.0 113.503 177.442 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 43.2 t-80 -62.69 154.67 28.64 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.719 1.208 . . . . 0.0 113.152 -178.249 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -60.29 -17.14 40.45 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.307 1.443 . . . . 0.0 114.176 174.865 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -124.14 15.24 9.13 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.735 1.614 . . . . 0.0 113.984 -174.562 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.82 -30.2 67.66 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.802 1.241 . . . . 0.0 114.14 178.716 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' TRP . . . . . 0.428 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 38.6 p-90 -56.26 -37.85 61.95 Favored Pre-proline 0 CA--C 1.548 0.9 0 N-CA-C 117.466 2.395 . . . . 0.0 117.466 -170.471 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.428 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 72.1 Cg_endo -72.05 -5.71 17.65 Favored 'Trans proline' 0 CA--C 1.544 0.976 0 CA-C-N 123.164 2.166 . . . . 0.0 114.179 173.434 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -108.91 -4.83 16.46 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.352 1.461 . . . . 0.0 113.057 178.323 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 21.3 m-30 -64.29 -16.17 61.63 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 113.927 1.084 . . . . 0.0 113.927 176.107 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -143.37 158.61 57.42 Favored Pre-proline 0 CA--C 1.546 0.826 0 C-N-CA 126.437 1.895 . . . . 0.0 110.726 -177.123 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -64.81 157.67 55.05 Favored 'Trans proline' 0 CA--C 1.536 0.6 0 C-N-CA 123.052 2.501 . . . . 0.0 112.75 175.716 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 36.0 t -75.71 87.3 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 C-N-CA 124.679 1.192 . . . . 0.0 109.434 174.991 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 58.4 m-20 -69.87 85.81 0.5 Allowed 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.837 1.255 . . . . 0.0 111.78 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.3 -28.24 27.19 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.913 1.285 . . . . 0.0 114.128 178.621 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 82.7 mt -66.44 -49.89 71.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 125.177 1.391 . . . . 0.0 111.152 173.265 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -66.69 -38.63 87.18 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.93 1.292 . . . . 0.0 112.543 178.999 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 84.7 mt -85.24 -5.29 59.33 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 126.439 1.896 . . . . 0.0 113.205 -178.118 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 51.37 54.88 10.32 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.907 1.683 . . . . 0.0 113.174 -176.948 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 45.0 mt -114.41 81.5 6.79 Favored Pre-proline 0 N--CA 1.474 0.742 0 C-N-CA 125.803 1.641 . . . . 0.0 110.676 -179.655 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -66.57 -14.14 42.79 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 123.423 2.748 . . . . 0.0 113.583 -175.8 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 34.4 m-20 -106.95 5.07 27.89 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.615 1.566 . . . . 0.0 113.269 177.005 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -53.54 -51.65 62.22 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 120.321 1.419 . . . . 0.0 112.788 -175.244 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -76.8 -16.05 59.56 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.857 1.263 . . . . 0.0 113.839 -179.813 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 9.4 mptt -68.37 -42.22 79.48 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.875 0.87 . . . . 0.0 110.363 174.808 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.9 mp -81.1 -55.34 8.37 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 C-N-CA 124.534 1.133 . . . . 0.0 110.431 173.637 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 50.5 mm -85.44 100.69 8.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 CA-C-O 122.322 1.058 . . . . 0.0 111.295 -176.386 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -66.93 -29.38 69.23 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 126.121 1.769 . . . . 0.0 114.091 179.328 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -145.51 78.34 12.06 Favored Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 125.689 1.596 . . . . 0.0 110.909 -171.349 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -68.66 149.67 73.85 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 124.157 3.238 . . . . 0.0 112.087 -178.441 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 8.7 tpt -158.22 148.83 20.46 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.771 1.228 . . . . 0.0 111.1 -171.777 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -152.75 152.08 31.24 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.069 1.348 . . . . 0.0 112.278 178.774 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 6.6 ttp -60.24 -33.73 72.69 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.632 1.173 . . . . 0.0 112.477 -176.541 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -61.52 -23.52 62.82 Favored Glycine 0 CA--C 1.536 1.397 0 C-N-CA 125.734 1.635 . . . . 0.0 114.769 172.577 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 93.3 m -93.98 -38.95 10.91 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 118.363 1.081 . . . . 0.0 111.387 172.079 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 89.9 mt -53.07 -50.03 47.27 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 CA-C-N 119.69 1.132 . . . . 0.0 111.108 176.462 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -57.89 -35.78 71.49 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 176.414 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 22.5 ttmm -70.86 -38.51 73.13 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.229 1.012 . . . . 0.0 113.208 -177.842 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -72.78 -30.48 64.14 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-N 119.122 0.874 . . . . 0.0 113.189 171.062 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 48.8 mt -63.7 -39.09 93.45 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-N 119.744 1.156 . . . . 0.0 113.243 168.62 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -77.52 14.42 1.0 Allowed 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.88 1.272 . . . . 0.0 113.732 176.685 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 32.6 m-80 -137.08 167.51 21.39 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 127.006 2.122 . . . . 0.0 111.317 177.705 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -75.94 37.0 0.15 Allowed 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 125.514 1.526 . . . . 0.0 111.952 173.908 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 30.0 t80 -70.82 -31.03 67.64 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 120.438 -1.413 . . . . 0.0 113.324 -169.254 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -144.12 -178.31 5.88 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 127.127 2.171 . . . . 0.0 110.389 175.196 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 6.6 t-105 -113.99 -25.17 8.68 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.565 1.146 . . . . 0.0 111.485 177.002 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.1 m -130.27 136.45 49.19 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.165 1.386 . . . . 0.0 111.775 -168.493 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -66.24 -16.48 64.04 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 115.669 1.729 . . . . 0.0 115.669 -173.927 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 16.5 m -53.76 -32.31 51.81 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.381 0.991 . . . . 0.0 112.909 175.089 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -69.87 -44.13 70.44 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.822 0.849 . . . . 0.0 112.442 175.632 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 43.4 t -61.72 -37.55 84.62 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.165 0.986 . . . . 0.0 112.466 171.277 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 83.2 mtp -65.96 -40.04 90.95 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.037 0.935 . . . . 0.0 112.155 176.395 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -63.44 -36.31 83.32 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 112.716 0.635 . . . . 0.0 112.716 170.913 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 91.8 m-20 -65.47 -43.67 89.57 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 119.445 1.02 . . . . 0.0 112.12 173.29 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -57.72 -45.78 85.29 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 121.374 -0.829 . . . . 0.0 112.445 171.482 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 13.6 t30 -55.92 -52.43 64.15 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.385 0.674 . . . . 0.0 111.779 174.293 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 53.5 m -57.86 -43.43 85.96 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.831 0.852 . . . . 0.0 112.476 178.715 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 53.2 ttp -56.72 -53.42 57.92 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 118.996 0.817 . . . . 0.0 112.9 177.407 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -69.25 -35.54 76.22 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 179.689 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.7 m -58.75 -49.96 75.68 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.372 1.069 . . . . 0.0 111.983 172.946 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -57.86 -38.72 76.22 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.316 0.646 . . . . 0.0 112.108 -178.335 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 24.0 m -56.1 -42.22 76.46 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.027 0.931 . . . . 0.0 112.707 172.612 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 7.0 m-85 -71.18 -29.34 65.06 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 176.961 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 79.3 mt -75.26 -57.75 5.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 123.617 0.767 . . . . 0.0 110.654 179.546 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -71.44 -27.06 63.02 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 114.362 1.245 . . . . 0.0 114.362 -171.739 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 36.6 m-80 -113.1 161.68 16.82 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.591 1.156 . . . . 0.0 111.729 -173.1 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -71.82 151.45 93.19 Favored Pre-proline 0 N--CA 1.471 0.621 0 C-N-CA 123.998 0.919 . . . . 0.0 109.79 176.557 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -65.38 -1.03 4.07 Favored 'Trans proline' 0 CA--C 1.547 1.134 0 C-N-CA 123.763 2.976 . . . . 0.0 114.691 -179.668 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 53.8 p -118.8 -2.28 10.92 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 127.176 2.191 . . . . 0.0 113.167 -179.752 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 58.4 m-20 -68.56 145.87 53.59 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 118.929 0.786 . . . . 0.0 110.804 170.598 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -56.74 -45.1 82.2 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.413 -0.805 . . . . 0.0 112.589 -176.318 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.6 tp -55.88 -29.37 25.96 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 124.946 1.298 . . . . 0.0 114.214 178.725 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 37.3 t -71.07 -48.3 56.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 O-C-N 121.364 -0.835 . . . . 0.0 110.416 172.779 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 66.4 mt -61.41 -36.59 80.72 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 118.829 0.74 . . . . 0.0 111.697 177.623 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 10.8 mtt -58.93 -51.73 68.8 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 124.854 1.261 . . . . 0.0 112.048 170.153 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.82 -39.35 91.46 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.358 0.663 . . . . 0.0 112.681 176.9 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 90.1 mt-30 -61.51 -47.06 87.3 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 119.107 0.867 . . . . 0.0 111.817 174.767 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -63.16 -45.2 92.97 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 123.802 0.841 . . . . 0.0 112.512 178.112 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 81.7 mt -64.96 -45.02 87.43 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.742 0.817 . . . . 0.0 112.084 175.525 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -63.71 -37.46 87.43 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 121.093 -1.004 . . . . 0.0 112.751 -177.071 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -58.53 -40.03 81.81 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 121.399 -0.813 . . . . 0.0 112.272 172.377 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 78.5 mt -74.3 -40.92 50.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 C-N-CA 123.243 0.617 . . . . 0.0 111.349 177.086 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -51.16 -51.36 54.46 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.456 -0.778 . . . . 0.0 110.364 171.894 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 96.1 mt -62.92 -41.31 99.43 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 112.904 0.705 . . . . 0.0 112.904 177.581 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -67.16 -29.98 69.82 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 120.199 1.363 . . . . 0.0 112.845 -179.737 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 71.5 mmtt -74.86 -52.43 11.35 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.953 0.901 . . . . 0.0 112.285 174.34 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.8 m -65.96 -24.81 34.66 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 120.316 1.416 . . . . 0.0 112.151 179.126 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -61.84 -28.54 69.56 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 121.475 -0.765 . . . . 0.0 112.933 171.207 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -96.51 -3.34 43.39 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.462 1.505 . . . . 0.0 112.599 177.849 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 5.9 ttm -57.24 142.01 76.21 Favored Pre-proline 0 CA--C 1.548 0.898 0 C-N-CA 124.298 1.039 . . . . 0.0 110.727 169.686 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_endo -63.16 145.96 93.89 Favored 'Trans proline' 0 CA--C 1.537 0.675 0 C-N-CA 122.563 2.175 . . . . 0.0 110.252 169.707 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -77.75 -17.66 57.32 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 120.827 -1.171 . . . . 0.0 113.344 177.468 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -94.45 154.11 17.6 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.32 1.448 . . . . 0.0 112.605 -177.64 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -128.91 133.28 47.83 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.247 1.419 . . . . 0.0 111.335 -172.168 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 9.1 p -147.87 145.13 18.98 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 124.184 0.994 . . . . 0.0 112.914 -174.289 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -64.15 132.93 51.88 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.304 1.841 . . . . 0.0 111.684 171.121 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 92.8 mt . . . . . 0 CA--C 1.545 0.786 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 178.722 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.974 0 CA-C-O 121.081 0.267 . . . . 0.0 113.314 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.5 ptt180 -157.53 164.84 36.94 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.39 1.876 . . . . 0.0 110.601 174.019 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 8.3 mmmt -71.48 121.02 17.9 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.878 1.271 . . . . 0.0 111.419 170.259 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 34.3 p -135.02 160.01 39.67 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 125.027 1.331 . . . . 0.0 112.376 -179.254 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 36.1 t30 -53.69 -33.21 54.69 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.808 1.643 . . . . 0.0 114.53 174.92 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 70.1 mm-40 -62.93 -56.94 12.81 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.041 0.936 . . . . 0.0 111.148 170.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 89.8 mt -65.42 -31.37 72.43 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 179.306 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.47 ' HB2' HD11 ' A' ' 147' ' ' LEU . 21.9 tt0 -58.44 -55.25 37.4 Favored 'General case' 0 C--O 1.223 -0.298 0 C-N-CA 123.332 0.653 . . . . 0.0 110.082 169.693 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -57.29 -40.61 78.17 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 118.819 0.736 . . . . 0.0 112.305 -178.74 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 95.3 mmm -56.8 -52.36 65.35 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 121.856 -0.527 . . . . 0.0 112.373 172.426 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -83.64 -10.31 58.3 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 114.904 1.446 . . . . 0.0 114.904 -174.323 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -116.75 -18.6 10.21 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.477 1.511 . . . . 0.0 112.744 -170.069 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 10.9 t -133.03 -53.08 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 C-N-CA 123.574 0.75 . . . . 0.0 111.628 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.7 t -66.0 -63.99 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 CA-C-N 118.856 0.753 . . . . 0.0 110.599 -175.41 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 82.8 t -57.15 -47.59 83.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 124.022 0.929 . . . . 0.0 109.757 172.021 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.0 tptp -57.34 -43.12 83.16 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 113.442 0.904 . . . . 0.0 113.442 -171.554 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 91.2 m -77.67 -42.95 32.83 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 118.915 0.78 . . . . 0.0 112.556 174.843 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 79.7 mt -58.31 -30.85 66.99 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.397 0.998 . . . . 0.0 112.258 175.994 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 40.9 t-105 -75.77 -35.51 60.1 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 126.521 1.929 . . . . 0.0 114.129 179.171 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 21.6 pttp -88.93 -3.64 58.68 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 114.244 1.202 . . . . 0.0 114.244 178.937 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 60.1 t-80 -54.31 152.67 6.1 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.99 2.116 . . . . 0.0 113.318 173.088 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 22.8 tp60 -56.8 -21.39 28.44 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 126.158 1.783 . . . . 0.0 114.738 177.308 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -123.19 15.2 9.81 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.43 1.492 . . . . 0.0 114.077 -173.507 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.06 -27.39 62.65 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 114.444 1.276 . . . . 0.0 114.444 179.832 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' TRP . . . . . 0.401 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 38.0 p-90 -55.64 -37.14 53.72 Favored Pre-proline 0 CA--C 1.55 0.958 0 N-CA-C 117.725 2.491 . . . . 0.0 117.725 -170.853 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.401 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 85.5 Cg_endo -73.28 -5.49 17.24 Favored 'Trans proline' 0 CA--C 1.543 0.949 0 CA-C-N 123.249 2.196 . . . . 0.0 114.022 174.219 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 62.0 m-85 -107.47 -5.53 17.59 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.479 1.512 . . . . 0.0 112.918 179.086 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -64.29 -14.79 58.04 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.673 1.36 . . . . 0.0 114.673 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -138.87 153.98 72.4 Favored Pre-proline 0 CA--C 1.543 0.688 0 C-N-CA 125.597 1.559 . . . . 0.0 110.146 -179.377 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -65.41 149.11 88.4 Favored 'Trans proline' 0 CA--C 1.537 0.632 0 C-N-CA 122.595 2.197 . . . . 0.0 111.898 174.685 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 74.0 t -58.58 138.04 20.14 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 123.505 0.722 . . . . 0.0 110.991 171.702 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -128.7 106.62 9.06 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 125.547 1.539 . . . . 0.0 108.841 171.593 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.08 -28.0 64.16 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.276 1.03 . . . . 0.0 113.576 -178.874 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 79.7 mt -66.94 -50.91 60.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 124.751 1.22 . . . . 0.0 110.913 172.863 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 56.6 mttm -66.09 -39.33 89.9 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.771 1.228 . . . . 0.0 112.854 -177.587 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 55.3 mt -91.29 1.0 57.43 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.851 1.26 . . . . 0.0 113.745 179.624 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 65.0 t30 51.42 53.54 12.65 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 126.237 1.815 . . . . 0.0 113.768 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 36.0 mt -107.47 98.26 22.94 Favored Pre-proline 0 CA--C 1.544 0.718 0 C-N-CA 125.802 1.641 . . . . 0.0 109.769 -177.886 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -69.11 -10.55 29.4 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 122.984 2.456 . . . . 0.0 114.744 -171.318 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -139.95 17.54 2.47 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.261 1.424 . . . . 0.0 113.384 -173.337 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -47.99 -52.01 21.57 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-N 120.025 1.284 . . . . 0.0 113.729 -172.248 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -75.37 -9.62 58.72 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.166 1.387 . . . . 0.0 114.38 -178.7 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 29.4 mmmt -78.7 -44.85 22.63 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 121.229 -0.92 . . . . 0.0 110.59 174.337 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.3 mp -74.14 -45.35 48.13 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 124.111 0.964 . . . . 0.0 110.426 173.999 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 35.3 mm -101.24 109.97 26.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 CA-C-O 122.252 1.025 . . . . 0.0 111.896 -175.6 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.5 mptp? -79.49 -29.77 41.74 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.754 1.622 . . . . 0.0 113.0 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -138.06 85.1 19.65 Favored Pre-proline 0 CA--C 1.544 0.737 0 C-N-CA 125.207 1.403 . . . . 0.0 110.463 -178.836 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -73.15 144.89 38.28 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 123.529 2.82 . . . . 0.0 111.058 176.369 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.8 tpt -155.0 142.18 19.38 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.969 1.307 . . . . 0.0 110.508 -178.575 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 20.4 m-20 -146.36 150.44 35.69 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.639 1.576 . . . . 0.0 111.422 -175.964 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.9 ttp -61.13 -35.73 77.86 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.331 1.052 . . . . 0.0 112.743 -173.169 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -59.93 -21.86 56.5 Favored Glycine 0 CA--C 1.537 1.428 0 C-N-CA 125.625 1.583 . . . . 0.0 114.433 171.883 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 19.2 m -98.27 -34.08 10.84 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.208 1.403 . . . . 0.0 111.81 174.134 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 90.0 mt -55.36 -50.38 65.75 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 CA-C-N 119.538 1.063 . . . . 0.0 110.655 172.467 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -60.16 -37.04 78.94 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 113.218 0.822 . . . . 0.0 113.218 176.943 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.435 ' HA ' ' HE2' ' A' ' 88' ' ' LYS . 0.5 OUTLIER -62.09 -36.32 81.35 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.319 1.048 . . . . 0.0 113.008 -177.761 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 6.2 ptp180 -80.53 -32.35 36.8 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 173.83 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 65.0 mt -62.01 -32.1 72.55 Favored 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 114.447 1.277 . . . . 0.0 114.447 169.225 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -64.38 -12.23 40.64 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 114.745 1.387 . . . . 0.0 114.745 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 6.9 p30 -134.89 176.27 8.81 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.781 1.632 . . . . 0.0 112.851 177.033 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -78.03 44.94 0.5 Allowed 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 125.286 1.435 . . . . 0.0 113.126 -177.919 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 50.9 t80 -65.18 -30.69 71.62 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 121.278 -0.889 . . . . 0.0 112.977 -174.7 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -141.01 172.16 13.06 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 127.249 2.22 . . . . 0.0 111.479 176.796 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 15.8 t-105 -95.45 -22.25 17.81 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.42 1.088 . . . . 0.0 113.23 177.815 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 24.2 t -145.07 153.22 41.21 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.581 1.152 . . . . 0.0 113.448 -169.889 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -65.18 -21.24 66.74 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 116.285 1.957 . . . . 0.0 116.285 -175.442 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 15.2 m -58.84 -32.7 69.65 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 119.485 1.039 . . . . 0.0 113.24 -175.858 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -63.85 -44.07 94.24 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.408 -0.808 . . . . 0.0 112.17 173.601 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 50.5 t -64.21 -38.07 89.74 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.036 0.935 . . . . 0.0 112.117 175.143 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 78.3 mtp -62.43 -41.12 98.47 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.272 -0.892 . . . . 0.0 112.393 173.581 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -61.39 -39.65 91.46 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 112.27 0.471 . . . . 0.0 112.27 170.975 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -65.81 -39.85 91.3 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 118.963 0.801 . . . . 0.0 112.713 177.343 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 -60.05 -45.37 93.08 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 121.51 -0.744 . . . . 0.0 112.369 170.485 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 18.1 t30 -57.72 -46.81 83.9 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 121.875 -0.516 . . . . 0.0 112.023 174.628 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 93.1 m -65.36 -34.45 78.36 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.888 0.875 . . . . 0.0 112.764 177.398 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 50.9 ttp -61.21 -55.21 34.77 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 119.608 1.095 . . . . 0.0 111.844 174.495 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 24.0 m-85 -65.18 -38.36 90.24 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 122.004 -0.435 . . . . 0.0 111.977 179.536 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 88.6 m -64.69 -47.78 77.13 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 123.601 0.761 . . . . 0.0 112.397 179.009 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.1 p30 -64.67 -31.28 72.43 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 119.774 1.17 . . . . 0.0 112.568 -179.726 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 56.1 m -60.95 -44.24 97.57 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.542 0.737 . . . . 0.0 112.547 169.522 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -67.84 -31.32 71.07 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 113.736 1.013 . . . . 0.0 113.736 177.291 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 80.9 mt -72.17 -56.65 9.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 123.343 0.657 . . . . 0.0 110.617 177.042 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 41.9 t80 -67.31 -30.54 70.41 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 114.152 1.168 . . . . 0.0 114.152 -173.953 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -113.47 156.35 23.69 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.03 0.932 . . . . 0.0 112.361 -171.577 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 3.0 mppt? -67.43 148.68 98.64 Favored Pre-proline 0 N--CA 1.471 0.576 0 C-N-CA 124.684 1.194 . . . . 0.0 110.666 176.213 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -65.46 -7.23 15.42 Favored 'Trans proline' 0 CA--C 1.544 0.976 0 C-N-CA 123.749 2.966 . . . . 0.0 114.674 -176.243 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 43.5 p -108.55 -4.74 16.94 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 127.123 2.169 . . . . 0.0 113.268 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -67.79 146.55 53.61 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 118.883 0.765 . . . . 0.0 110.821 174.953 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -53.27 -47.76 68.85 Favored 'General case' 0 N--CA 1.469 0.519 0 O-C-N 121.59 -0.694 . . . . 0.0 112.258 179.097 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.2 tp -57.39 -30.03 34.79 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 C-N-CA 124.298 1.039 . . . . 0.0 113.786 -178.778 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 42.5 t -71.99 -48.52 49.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 O-C-N 121.535 -0.728 . . . . 0.0 110.442 174.004 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 79.8 mt -61.13 -36.96 81.16 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 118.978 0.808 . . . . 0.0 111.857 177.508 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 13.5 mtt -58.55 -52.73 64.43 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.919 1.288 . . . . 0.0 111.965 169.888 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.61 -38.75 88.76 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.464 0.706 . . . . 0.0 112.704 177.761 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -59.48 -51.11 71.27 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 119.229 0.922 . . . . 0.0 111.687 173.26 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.57 -43.28 99.19 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.752 0.821 . . . . 0.0 112.844 179.725 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 80.0 mt -62.95 -43.75 97.94 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.718 0.807 . . . . 0.0 111.748 173.569 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -60.9 -39.13 88.14 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 121.018 -1.051 . . . . 0.0 112.699 -179.111 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 7.2 mmpt? -61.69 -37.99 86.15 Favored 'General case' 0 N--CA 1.476 0.871 0 O-C-N 121.191 -0.943 . . . . 0.0 111.304 178.027 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 77.7 mt -74.41 -39.95 48.79 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 C-N-CA 123.685 0.794 . . . . 0.0 111.312 176.611 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -51.53 -51.36 55.95 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 118.943 0.792 . . . . 0.0 110.411 172.229 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 93.1 mt -63.67 -40.79 97.71 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 118.532 -0.747 . . . . 0.0 112.819 177.918 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -67.18 -32.69 73.95 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 120.327 1.421 . . . . 0.0 112.426 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 65.3 mmtt -71.23 -53.4 14.49 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.952 0.901 . . . . 0.0 111.753 175.49 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.4 m -65.48 -25.15 36.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 CA-C-N 120.326 1.421 . . . . 0.0 112.222 179.662 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -64.42 -34.9 79.26 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 171.588 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -84.3 -13.28 52.9 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.475 1.11 . . . . 0.0 113.087 173.532 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 48.0 ttp -61.62 141.97 94.6 Favored Pre-proline 0 CA--C 1.543 0.704 0 CA-C-N 119.262 0.937 . . . . 0.0 110.564 172.99 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -60.53 152.2 69.87 Favored 'Trans proline' 0 CA--C 1.538 0.705 0 C-N-CA 122.716 2.277 . . . . 0.0 111.205 172.504 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -88.8 -21.17 23.9 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 121.777 -0.577 . . . . 0.0 112.388 172.23 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -84.75 167.16 16.37 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.835 1.254 . . . . 0.0 112.396 172.901 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -137.13 146.76 45.42 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.76 1.224 . . . . 0.0 111.175 -176.848 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 8.2 p -144.16 145.18 21.99 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 C-N-CA 124.899 1.279 . . . . 0.0 110.437 176.344 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -69.38 137.92 53.23 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.429 0.692 . . . . 0.0 111.246 173.12 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 147' ' ' LEU . . . . . 0.47 HD11 ' HB2' ' A' ' 40' ' ' GLN . 83.4 mt . . . . . 0 CA--C 1.544 0.734 0 N-CA-C 113.886 1.069 . . . . 0.0 113.886 -175.666 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.998 0 CA-C-O 121.005 0.225 . . . . 0.0 113.251 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 8.0 ptm180 -164.63 165.44 21.01 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.761 2.025 . . . . 0.0 110.87 175.232 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 30.7 tttp -61.83 132.23 52.4 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.143 1.377 . . . . 0.0 110.938 173.96 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 48.9 p -139.38 165.04 28.26 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.967 1.707 . . . . 0.0 110.141 178.876 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 24.8 t30 -52.6 -32.49 41.69 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 175.929 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 63.4 mm-40 -60.68 -59.92 4.62 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.535 1.134 . . . . 0.0 111.616 169.663 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 94.5 mt -67.12 -32.21 73.2 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.215 1.006 . . . . 0.0 112.911 -177.297 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 -58.8 -51.34 70.42 Favored 'General case' 0 C--O 1.225 -0.225 0 C-N-CA 124.362 1.065 . . . . 0.0 110.223 170.031 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 49.8 t80 -58.07 -39.34 78.27 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 118.909 0.777 . . . . 0.0 112.347 178.366 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 89.0 mmm -57.08 -55.04 39.89 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 121.662 -0.649 . . . . 0.0 112.266 172.308 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -82.32 -4.44 57.23 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 115.108 1.521 . . . . 0.0 115.108 -175.2 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -117.21 -19.64 9.56 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.247 1.419 . . . . 0.0 112.778 -174.041 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.6 t -133.47 -52.72 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 CA-C-O 118.757 -0.64 . . . . 0.0 112.266 179.202 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.8 t -69.08 -67.71 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 CA-C-N 118.794 0.724 . . . . 0.0 110.848 -172.621 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 99.3 t -57.07 -46.11 84.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.928 1.291 . . . . 0.0 109.743 171.587 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 40.3 tptt -58.77 -22.22 57.56 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 114.301 1.222 . . . . 0.0 114.301 -176.233 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 34.2 m -99.43 -41.09 7.56 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.196 0.998 . . . . 0.0 113.151 172.717 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 62.3 mt -60.05 -28.95 68.2 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.257 0.935 . . . . 0.0 112.682 173.842 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 36.0 t-105 -79.04 -33.85 44.38 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 127.123 2.169 . . . . 0.0 113.843 178.959 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 61.2 pttt -86.56 -5.18 59.21 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 175.682 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 57.4 t-80 -54.28 152.53 6.19 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.507 1.923 . . . . 0.0 113.473 174.526 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 22.7 tp60 -56.83 -21.13 26.66 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 126.029 1.732 . . . . 0.0 114.676 176.934 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -124.35 19.66 8.91 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.409 1.484 . . . . 0.0 113.916 -175.068 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -74.0 -24.69 59.62 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 114.106 1.151 . . . . 0.0 114.106 175.837 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' TRP . . . . . 0.423 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 49.4 p-90 -57.17 -36.4 46.1 Favored Pre-proline 0 CA--C 1.548 0.876 0 N-CA-C 117.206 2.299 . . . . 0.0 117.206 -173.508 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.423 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 85.0 Cg_endo -74.82 0.02 9.33 Favored 'Trans proline' 0 CA--C 1.545 1.039 0 CA-C-N 123.013 2.112 . . . . 0.0 113.934 171.514 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -117.98 6.19 12.15 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.96 1.704 . . . . 0.0 113.321 -178.83 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 23.3 m-30 -72.31 -14.22 61.69 Favored 'General case' 0 CA--C 1.545 0.758 0 O-C-N 120.28 -1.512 . . . . 0.0 114.059 176.735 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 89.1 mt-30 -151.57 145.99 18.41 Favored Pre-proline 0 CA--C 1.544 0.724 0 C-N-CA 125.233 1.413 . . . . 0.0 110.536 -177.835 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -65.36 151.65 84.49 Favored 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 123.383 2.722 . . . . 0.0 112.765 -178.218 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 41.6 t -64.17 135.79 27.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 124.737 1.215 . . . . 0.0 111.071 -178.703 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 52.8 m-20 -112.71 92.41 4.01 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.925 1.29 . . . . 0.0 110.163 175.33 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.57 -27.42 38.79 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.286 1.034 . . . . 0.0 113.682 175.651 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 81.8 mt -65.71 -49.6 76.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 C-N-CA 125.392 1.477 . . . . 0.0 111.104 173.806 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -65.99 -38.92 89.73 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.48 1.112 . . . . 0.0 112.589 179.21 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 90.3 mt -87.35 -3.6 59.03 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.893 1.677 . . . . 0.0 113.518 -177.268 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 51.14 56.55 7.81 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 125.584 1.554 . . . . 0.0 113.01 -176.424 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 58.0 mt -113.87 78.36 4.05 Favored Pre-proline 0 CA--C 1.543 0.7 0 C-N-CA 126.157 1.783 . . . . 0.0 110.651 -179.811 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -66.28 -17.2 53.87 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 123.323 2.682 . . . . 0.0 113.101 -177.68 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 -100.35 7.13 44.52 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.884 1.674 . . . . 0.0 113.184 175.681 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 85.8 t80 -52.28 -57.62 9.16 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 120.015 1.28 . . . . 0.0 112.117 -177.474 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -74.81 -11.65 60.2 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.888 1.275 . . . . 0.0 114.33 179.606 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 10.1 mptt -72.7 -32.54 65.83 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 121.263 -0.898 . . . . 0.0 111.296 176.349 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.2 mp -99.07 -48.71 11.86 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 125.439 1.496 . . . . 0.0 111.088 175.003 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 28.0 mm -67.18 110.95 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 C-N-CA 123.66 0.784 . . . . 0.0 110.082 178.48 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -68.25 -44.87 74.65 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.972 0.909 . . . . 0.0 112.113 -178.441 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 71.5 m-80 -150.22 117.83 3.56 Favored Pre-proline 0 CA--C 1.546 0.789 0 C-N-CA 126.5 1.92 . . . . 0.0 109.075 173.839 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -74.24 146.95 36.76 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 123.116 2.544 . . . . 0.0 111.478 177.346 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.0 tpt -156.25 146.68 21.63 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.984 1.314 . . . . 0.0 110.52 176.678 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -152.11 153.22 33.48 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.258 1.423 . . . . 0.0 112.099 -171.881 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 2.7 ttp -64.74 -38.3 90.53 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.197 0.599 . . . . 0.0 112.456 -175.426 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -59.26 -34.09 78.49 Favored Glycine 0 CA--C 1.53 1.02 0 C-N-CA 124.63 1.11 . . . . 0.0 113.056 173.552 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 24.2 m -76.23 -47.17 24.91 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 117.868 0.834 . . . . 0.0 111.278 172.056 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 86.7 mt -52.66 -53.14 21.98 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.197 0 C-N-CA 124.568 1.147 . . . . 0.0 111.247 178.128 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.37 -30.42 71.24 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -178.964 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.402 ' HE3' ' HA ' ' A' ' 88' ' ' LYS . 0.1 OUTLIER -65.02 -40.0 94.21 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 117.712 -1.137 . . . . 0.0 113.413 171.012 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . 0.275 6.4 ptp180 -72.68 -30.03 63.9 Favored 'General case' 0 N--CA 1.484 1.24 0 CA-C-N 120.544 1.52 . . . . 0.0 114.135 172.712 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 86.9 mt -66.87 -36.14 81.63 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 119.763 1.165 . . . . 0.0 112.949 167.679 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 88.5 mt-10 -78.02 9.33 3.74 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.685 1.594 . . . . 0.0 113.704 178.308 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 38.8 m-80 -138.42 166.79 23.35 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 127.023 2.129 . . . . 0.0 111.788 179.671 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 13.9 p-10 -79.96 108.41 13.51 Favored 'General case' 0 CA--C 1.544 0.719 0 O-C-N 121.4 -0.813 . . . . 0.0 109.773 168.777 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 49.4 t80 -140.36 -46.26 0.42 Allowed 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -178.277 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -133.15 177.0 8.01 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.836 2.054 . . . . 0.0 111.625 178.427 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.3 t-105 -112.99 -21.86 10.89 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.898 1.279 . . . . 0.0 112.787 -177.598 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 28.2 t -138.07 142.95 40.27 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.046 -1.034 . . . . 0.0 112.337 -172.74 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -68.89 -13.55 62.49 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 115.316 1.599 . . . . 0.0 115.316 -173.647 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 23.2 m -55.45 -29.97 59.66 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 119.412 1.006 . . . . 0.0 112.775 173.873 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 40.0 mm-40 -72.5 -41.37 66.01 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.202 -0.936 . . . . 0.0 112.258 174.953 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 42.2 t -62.23 -38.24 88.45 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.025 0.93 . . . . 0.0 111.998 172.209 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 82.9 mtp -65.6 -40.67 92.92 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 124.124 0.969 . . . . 0.0 112.171 174.885 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 62.6 mt-30 -59.96 -44.5 94.39 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 122.895 0.478 . . . . 0.0 111.606 171.072 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -64.44 -38.56 91.46 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 118.797 0.726 . . . . 0.0 112.663 178.173 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -61.21 -45.04 96.22 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 121.265 -0.897 . . . . 0.0 112.357 170.002 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 33.2 t30 -59.22 -43.05 92.32 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 121.506 -0.747 . . . . 0.0 111.963 174.722 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 85.0 m -62.69 -39.51 94.21 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.192 0.997 . . . . 0.0 112.414 174.835 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 12.9 ttm -58.2 -60.88 3.07 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 119.485 1.039 . . . . 0.0 111.272 174.993 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -61.01 -41.0 95.68 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.035 0.534 . . . . 0.0 111.966 -177.506 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 77.3 m -64.46 -47.93 77.18 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.294 0.638 . . . . 0.0 112.083 178.706 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -64.7 -31.93 73.38 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 119.493 1.042 . . . . 0.0 112.643 -178.687 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 40.8 m -59.91 -43.7 94.73 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.906 0.883 . . . . 0.0 112.516 169.647 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -68.9 -29.17 67.39 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 179.106 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 86.1 mt -72.25 -57.47 7.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 123.256 0.622 . . . . 0.0 110.906 178.787 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -71.62 -35.03 70.32 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -171.221 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 59.5 m-80 -95.99 162.65 13.47 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.456 1.103 . . . . 0.0 111.733 -178.651 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -73.45 152.07 89.74 Favored Pre-proline 0 N--CA 1.474 0.764 0 O-C-N 121.261 -0.9 . . . . 0.0 110.426 170.545 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -65.87 -1.67 5.45 Favored 'Trans proline' 0 CA--C 1.544 1.019 0 C-N-CA 123.569 2.846 . . . . 0.0 114.922 -178.803 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 65.0 p -118.06 -0.62 11.58 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.703 2.001 . . . . 0.0 113.063 -179.609 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 58.5 m-20 -68.48 144.98 54.45 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 118.719 0.69 . . . . 0.0 110.709 170.791 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -55.87 -45.77 78.43 Favored 'General case' 0 N--CA 1.471 0.625 0 O-C-N 121.682 -0.636 . . . . 0.0 112.504 -175.529 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.5 tp -55.32 -30.4 25.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 124.918 1.287 . . . . 0.0 114.058 177.957 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 48.3 t -73.31 -46.56 49.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 O-C-N 121.427 -0.796 . . . . 0.0 110.582 174.06 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 72.4 mt -61.39 -37.15 82.39 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 119.103 0.865 . . . . 0.0 111.523 177.008 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 8.9 mtt -59.63 -51.21 70.77 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.963 1.305 . . . . 0.0 112.04 169.928 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.97 -38.75 87.03 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.387 0.675 . . . . 0.0 112.701 176.425 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 90.0 mt-30 -62.5 -45.51 92.69 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 119.329 0.968 . . . . 0.0 112.094 173.795 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.25 -44.28 96.91 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.543 0.737 . . . . 0.0 112.473 177.045 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 85.2 mt -65.4 -45.67 83.06 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.913 0.885 . . . . 0.0 112.042 174.842 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.94 -37.68 88.02 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.138 -0.976 . . . . 0.0 113.075 -176.502 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 55.7 mtmt -58.85 -46.16 88.37 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 121.744 -0.598 . . . . 0.0 111.727 172.883 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 89.6 mt -67.6 -43.9 86.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 123.429 0.692 . . . . 0.0 110.702 178.142 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 34.0 t80 -50.57 -51.09 51.42 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.851 0.861 . . . . 0.0 111.095 174.608 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 99.6 mt -64.0 -40.26 95.96 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 178.766 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 82.8 mm-40 -62.64 -37.25 85.6 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 119.42 1.009 . . . . 0.0 113.004 173.576 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 33.2 mmtm -70.99 -52.66 18.35 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.111 1.364 . . . . 0.0 111.47 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.5 m -67.44 -25.16 32.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 CA-C-N 119.603 1.092 . . . . 0.0 112.366 178.395 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -62.22 -30.4 71.06 Favored 'General case' 0 CA--C 1.54 0.582 0 O-C-N 121.573 -0.705 . . . . 0.0 112.703 172.043 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -88.77 -9.16 52.86 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.478 1.111 . . . . 0.0 112.844 174.92 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 40.1 ttp -67.26 145.2 98.55 Favored Pre-proline 0 CA--C 1.545 0.786 0 C-N-CA 124.074 0.95 . . . . 0.0 110.347 170.033 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -60.13 156.75 38.0 Favored 'Trans proline' 0 CA--C 1.539 0.737 0 C-N-CA 123.23 2.62 . . . . 0.0 111.63 170.159 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.25 -26.74 19.91 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.503 0.721 . . . . 0.0 112.893 172.152 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -85.7 170.38 12.56 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 126.254 1.822 . . . . 0.0 111.333 171.743 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -132.57 171.72 13.45 Favored 'General case' 0 CA--C 1.533 0.304 0 O-C-N 120.683 -1.261 . . . . 0.0 112.294 173.992 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 15.0 p -152.2 142.74 15.5 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 C-N-CA 124.033 0.933 . . . . 0.0 110.656 174.05 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -64.88 136.88 57.36 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.701 1.6 . . . . 0.0 111.686 173.615 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 59.8 mt . . . . . 0 N--CA 1.47 0.539 0 C-N-CA 124.069 0.947 . . . . 0.0 113.327 -174.054 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.119 0 CA-C-O 121.097 0.276 . . . . 0.0 113.59 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 32.3 ptt180 -163.23 159.55 22.94 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 126.739 2.016 . . . . 0.0 110.721 172.717 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.2 tttm -71.11 137.25 48.72 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.192 0.997 . . . . 0.0 111.244 174.828 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 76.0 p -144.44 167.24 22.96 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 125.817 1.647 . . . . 0.0 110.922 -175.319 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 25.5 p-10 -51.13 -36.01 38.53 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 113.51 0.929 . . . . 0.0 113.51 169.359 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.5 mm100 -64.67 -54.09 37.24 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.269 1.028 . . . . 0.0 110.762 178.882 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.1 mt -66.97 -34.36 77.59 Favored 'General case' 0 CA--C 1.537 0.442 0 N-CA-C 112.524 0.564 . . . . 0.0 112.524 178.647 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.1 tp60 -57.55 -53.86 53.42 Favored 'General case' 0 C--O 1.222 -0.354 0 C-N-CA 123.036 0.534 . . . . 0.0 110.498 169.957 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 60.5 t80 -56.58 -41.89 77.72 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.348 0.976 . . . . 0.0 112.626 179.701 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 94.8 mmm -57.62 -51.24 70.32 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.69 -0.631 . . . . 0.0 112.184 172.421 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -85.32 -5.29 59.32 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 -173.998 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 60.0 t30 -124.72 -14.48 6.75 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.764 1.626 . . . . 0.0 113.294 -171.549 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 21.4 t -133.15 -52.8 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 C-N-CA 123.192 0.597 . . . . 0.0 111.058 177.985 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.4 t -68.95 -65.63 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 123.34 0.656 . . . . 0.0 110.696 -174.488 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 89.9 t -57.8 -46.7 87.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 C-N-CA 124.093 0.957 . . . . 0.0 110.322 173.24 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 69.7 tttt -58.62 -39.19 79.8 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.357 0.663 . . . . 0.0 112.552 -174.734 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 40.9 m -78.03 -43.56 29.05 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 118.461 0.573 . . . . 0.0 112.212 175.651 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 62.8 mt -61.6 -33.32 73.69 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 118.821 0.737 . . . . 0.0 112.411 177.67 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 30.9 t-105 -71.27 -31.44 67.51 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.701 1.6 . . . . 0.0 113.346 176.12 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.7 mtmp? -80.49 -7.42 59.17 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 175.942 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 53.0 t-80 -63.56 152.94 37.28 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.701 1.2 . . . . 0.0 112.981 -179.853 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 99.9 mm-40 -61.54 -19.63 62.35 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.072 1.349 . . . . 0.0 114.394 177.299 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -117.85 13.06 14.0 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.34 1.456 . . . . 0.0 113.706 -176.289 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.14 -25.93 64.63 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.815 1.246 . . . . 0.0 114.12 177.866 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 69.2 p-90 -56.5 -35.49 35.77 Favored Pre-proline 0 CA--C 1.547 0.865 0 N-CA-C 118.113 2.635 . . . . 0.0 118.113 -169.911 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -78.71 -6.94 15.54 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 CA-C-N 123.33 2.225 . . . . 0.0 112.985 176.565 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 57.7 m-85 -103.09 -7.67 21.15 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.307 1.443 . . . . 0.0 112.382 179.311 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 20.3 m-30 -62.42 -17.61 59.67 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 114.559 1.318 . . . . 0.0 114.559 179.814 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 89.5 mt-30 -139.7 150.88 64.63 Favored Pre-proline 0 CA--C 1.544 0.727 0 C-N-CA 124.947 1.299 . . . . 0.0 111.127 -179.088 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -70.67 143.89 47.66 Favored 'Trans proline' 0 CA--C 1.537 0.645 0 C-N-CA 123.151 2.567 . . . . 0.0 112.672 178.397 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 63.8 t -64.64 145.32 13.99 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 C-N-CA 124.309 1.043 . . . . 0.0 110.56 169.152 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -130.04 109.51 10.91 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.315 1.446 . . . . 0.0 110.116 173.913 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.32 -29.12 60.86 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.478 1.111 . . . . 0.0 113.645 179.082 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 84.4 mt -66.33 -48.87 79.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 125.227 1.411 . . . . 0.0 110.882 174.488 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 45.9 mmtm -68.46 -39.16 81.54 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.767 1.227 . . . . 0.0 113.126 -178.707 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.5 mp -87.89 -3.97 58.88 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.611 1.164 . . . . 0.0 112.774 179.482 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 52.29 58.15 5.7 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 126.083 1.753 . . . . 0.0 113.243 -177.007 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 44.7 mt -115.63 82.67 10.33 Favored Pre-proline 0 CA--C 1.544 0.749 0 C-N-CA 126.135 1.774 . . . . 0.0 110.512 -177.157 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -67.04 -8.31 21.37 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 123.911 3.074 . . . . 0.0 114.108 -173.419 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 24.9 p-10 -116.02 2.58 13.48 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 127.566 2.346 . . . . 0.0 113.737 179.24 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 58.7 t80 -49.65 -50.68 42.28 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 119.933 1.242 . . . . 0.0 113.199 -175.167 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 99.7 m-70 -76.39 -18.47 58.85 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.878 1.271 . . . . 0.0 114.115 -178.788 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 10.7 mmpt? -69.7 -45.13 68.94 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.071 0.948 . . . . 0.0 110.563 174.654 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.6 mp -72.37 -51.71 27.83 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 C-N-CA 123.44 0.696 . . . . 0.0 109.929 171.241 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 37.7 mm -99.54 103.66 15.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 CA-C-O 122.586 1.184 . . . . 0.0 112.156 -171.774 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 40.3 mmtm -65.47 -32.91 74.78 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.318 1.447 . . . . 0.0 113.146 175.689 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -137.01 76.77 44.87 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 125.217 1.407 . . . . 0.0 111.561 -170.03 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -70.78 128.51 15.19 Favored 'Trans proline' 0 CA--C 1.537 0.658 0 C-N-CA 124.102 3.202 . . . . 0.0 111.052 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 17.7 tpp -155.41 140.99 17.9 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.078 1.751 . . . . 0.0 109.455 -173.461 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -141.26 148.34 39.68 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 127.561 2.344 . . . . 0.0 109.161 172.752 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 13.0 ttp -49.45 -33.11 13.34 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 115.341 1.608 . . . . 0.0 115.341 -170.077 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -57.49 -20.07 36.49 Favored Glycine 0 CA--C 1.538 1.502 0 C-N-CA 125.382 1.468 . . . . 0.0 115.271 173.977 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 28.7 m -85.58 -40.13 16.6 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.51 1.124 . . . . 0.0 111.694 172.743 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 34.5 mt -56.39 -49.5 76.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 C-N-CA 124.431 1.092 . . . . 0.0 110.945 -177.472 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -58.32 -33.74 69.82 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 178.352 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -70.73 -45.6 64.56 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.415 1.086 . . . . 0.0 112.214 -178.748 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 3.8 ptp180 -69.47 -26.87 64.79 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 113.76 1.022 . . . . 0.0 113.76 172.121 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 45.7 mt -68.97 -42.47 76.56 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 119.339 0.972 . . . . 0.0 113.344 168.922 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -71.73 -36.37 70.45 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.666 0.786 . . . . 0.0 112.83 178.231 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 -74.17 167.62 21.21 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.004 0.922 . . . . 0.0 111.43 169.251 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 61.3 t-20 -89.6 96.51 10.73 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 121.064 -1.022 . . . . 0.0 109.139 168.074 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 57.8 t80 -123.6 -25.61 4.32 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.317 1.047 . . . . 0.0 113.74 -178.313 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -145.61 179.97 7.07 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.737 1.215 . . . . 0.0 113.565 175.814 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 2.3 t-105 -113.0 -27.5 8.04 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 126.057 1.743 . . . . 0.0 112.361 -177.796 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 21.0 p -135.9 137.0 40.95 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 125.164 1.386 . . . . 0.0 112.688 -168.975 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -58.27 -19.88 37.86 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 115.588 1.699 . . . . 0.0 115.588 -178.308 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 11.1 m -56.2 -34.43 66.26 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 119.466 1.03 . . . . 0.0 113.173 176.305 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -67.0 -44.03 81.39 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.508 0.671 . . . . 0.0 111.437 173.447 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 1.9 m -66.53 -33.39 75.57 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 126.046 1.738 . . . . 0.0 112.279 178.953 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 76.0 mtp -68.25 -43.58 77.53 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 125.138 1.375 . . . . 0.0 112.376 172.209 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -63.49 -30.8 71.87 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 118.02 0.373 . . . . 0.0 111.704 176.206 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 93.2 m-20 -68.36 -44.04 76.11 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.727 0.811 . . . . 0.0 112.116 173.212 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -60.54 -45.1 95.11 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 118.936 0.789 . . . . 0.0 112.528 171.956 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 16.8 t30 -56.33 -45.98 80.09 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.241 0.617 . . . . 0.0 111.402 172.985 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 71.6 m -63.33 -33.36 75.37 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.462 1.105 . . . . 0.0 112.581 176.428 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 12.1 tmm? -68.99 -55.44 10.87 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 124.59 1.156 . . . . 0.0 111.906 -177.751 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 29.6 m-85 -62.58 -39.13 92.74 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.392 0.677 . . . . 0.0 112.423 173.884 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 97.0 m -66.08 -47.19 75.07 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 121.427 -0.796 . . . . 0.0 112.287 -179.662 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -62.98 -30.71 71.8 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 119.891 1.223 . . . . 0.0 112.479 179.473 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 92.1 m -63.45 -43.5 97.21 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.059 0.944 . . . . 0.0 112.54 170.996 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 15.2 m-30 -65.18 -35.76 82.1 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 175.98 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 77.6 mt -70.27 -56.83 9.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 C-N-CA 123.214 0.606 . . . . 0.0 110.923 -178.504 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.3 t80 -69.28 -32.5 71.71 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 114.087 1.143 . . . . 0.0 114.087 -172.198 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 60.2 m-80 -101.39 164.76 11.61 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.232 1.013 . . . . 0.0 112.546 -174.235 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -67.07 140.88 96.13 Favored Pre-proline 0 N--CA 1.472 0.659 0 C-N-CA 123.816 0.846 . . . . 0.0 109.831 173.538 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -67.48 -5.32 13.78 Favored 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 123.669 2.912 . . . . 0.0 114.634 -174.637 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 51.7 p -116.6 -0.29 12.45 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.573 1.949 . . . . 0.0 113.187 179.69 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -67.08 151.7 47.13 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 121.601 -0.687 . . . . 0.0 111.222 172.59 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -50.45 -49.88 53.78 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.499 0.719 . . . . 0.0 112.257 178.472 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.5 tp -56.55 -33.18 38.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 -176.843 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 54.6 t -71.25 -49.3 49.14 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 CA-C-O 118.868 -0.586 . . . . 0.0 110.583 173.679 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 76.0 mt -61.47 -37.06 82.24 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.499 1.045 . . . . 0.0 112.115 178.659 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 32.0 mtp -61.97 -48.57 79.77 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 126.027 1.731 . . . . 0.0 111.543 172.281 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.6 -39.72 92.23 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 173.319 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -63.66 -38.7 92.11 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 119.37 0.986 . . . . 0.0 112.696 175.273 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -66.4 -46.32 76.98 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.629 0.772 . . . . 0.0 111.874 175.311 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 86.6 mt -63.73 -44.43 93.58 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.186 0.994 . . . . 0.0 112.308 175.748 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -65.18 -37.06 86.17 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.045 -1.035 . . . . 0.0 113.056 -175.655 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 36.1 mtmm -61.0 -41.94 97.48 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 121.341 -0.85 . . . . 0.0 111.719 172.798 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 81.4 mt -65.62 -45.55 91.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 CA-C-O 118.785 -0.626 . . . . 0.0 110.464 174.669 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 34.1 t80 -50.2 -51.08 47.0 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 119.226 0.921 . . . . 0.0 111.427 174.385 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.4 mt -63.19 -42.24 99.31 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 121.652 -0.655 . . . . 0.0 112.643 179.075 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 93.3 mm-40 -61.56 -36.12 79.73 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 119.341 0.973 . . . . 0.0 113.022 174.086 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 34.5 mmtm -70.98 -53.57 14.38 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.99 1.316 . . . . 0.0 111.409 179.435 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 4.7 m -68.92 -25.54 30.41 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 CA-C-N 119.654 1.115 . . . . 0.0 112.647 179.707 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -59.14 -28.37 66.51 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 173.06 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -93.52 -4.96 50.14 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.943 1.297 . . . . 0.0 112.569 177.603 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 38.8 ttp -67.2 139.16 94.87 Favored Pre-proline 0 CA--C 1.548 0.901 0 C-N-CA 124.028 0.931 . . . . 0.0 110.532 171.577 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -64.91 156.08 64.26 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 123.045 2.497 . . . . 0.0 112.269 175.609 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 62.2 mm-40 -85.37 -16.04 41.2 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.98 0.912 . . . . 0.0 113.172 177.489 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 13.6 mp0 -103.82 146.56 28.46 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.587 1.155 . . . . 0.0 113.097 -175.673 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.43 146.09 27.14 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.305 1.042 . . . . 0.0 111.715 174.056 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 82.4 t -141.46 125.47 16.58 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 C-N-CA 127.338 2.255 . . . . 0.0 108.71 174.071 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -65.61 125.07 24.09 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.84 1.656 . . . . 0.0 111.329 169.921 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 90.6 mt . . . . . 0 CA--C 1.541 0.6 0 C-N-CA 123.485 0.714 . . . . 0.0 112.75 177.719 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.367 0 N-CA-C 110.99 -0.844 . . . . 0.0 110.99 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.9 p -68.51 156.18 38.49 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.565 1.146 . . . . 0.0 113.394 176.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 50.2 m -68.08 134.41 50.56 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.323 1.049 . . . . 0.0 112.107 176.839 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 176.22 27.81 0.03 OUTLIER Glycine 0 CA--C 1.536 1.399 0 C-N-CA 123.976 0.798 . . . . 0.0 114.914 179.442 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 50.4 m -145.82 170.09 17.25 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.497 1.519 . . . . 0.0 111.958 -169.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.5 m -127.21 22.19 6.62 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 125.627 1.571 . . . . 0.0 112.675 178.454 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 83.71 -171.87 49.63 Favored Glycine 0 CA--C 1.536 1.346 0 C-N-CA 124.954 1.264 . . . . 0.0 113.401 -174.352 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -127.04 176.39 7.38 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.854 1.262 . . . . 0.0 112.062 -176.658 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 18.6 m -123.7 -15.52 5.27 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 C-N-CA 124.491 1.116 . . . . 0.0 113.819 -172.649 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 10.9 t -150.99 160.35 43.99 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 125.816 1.647 . . . . 0.0 109.171 169.49 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -155.52 121.42 2.6 Favored Pre-proline 0 CA--C 1.546 0.796 0 O-C-N 121.684 -0.635 . . . . 0.0 111.68 -176.817 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -81.75 -28.37 2.18 Favored 'Trans proline' 0 CA--C 1.542 0.898 0 C-N-CA 123.441 2.761 . . . . 0.0 113.419 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.8 t -77.64 -44.94 26.56 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.047 0.939 . . . . 0.0 112.281 -177.257 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 52.4 tttm -72.94 133.65 81.77 Favored Pre-proline 0 N--CA 1.473 0.702 0 C-N-CA 124.53 1.132 . . . . 0.0 110.375 174.788 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -70.89 147.5 55.71 Favored 'Trans proline' 0 CA--C 1.535 0.55 0 C-N-CA 122.08 1.853 . . . . 0.0 111.89 177.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 178.82 150.47 8.87 Favored Glycine 0 CA--C 1.528 0.896 0 N-CA-C 114.715 0.646 . . . . 0.0 114.715 178.428 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 19.7 ptt180 -161.42 166.49 27.22 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 126.901 2.08 . . . . 0.0 110.678 175.626 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.486 ' HG3' HD12 ' A' ' 147' ' ' LEU . 0.2 OUTLIER -71.42 117.33 12.82 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.378 1.471 . . . . 0.0 111.882 -177.014 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 69.4 p -126.99 163.21 24.21 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.667 1.187 . . . . 0.0 112.089 -179.252 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -56.54 -35.41 68.09 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.302 1.441 . . . . 0.0 113.636 174.496 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -67.38 -50.21 60.69 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 122.874 0.47 . . . . 0.0 111.255 177.719 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 89.3 mt -62.05 -35.77 79.64 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.443 -0.786 . . . . 0.0 112.178 173.197 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 19.1 tp60 -58.75 -49.17 78.62 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 119.012 -0.518 . . . . 0.0 111.201 173.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 55.4 t80 -58.28 -42.57 86.86 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 119.437 1.017 . . . . 0.0 112.402 177.664 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 97.0 mmm -55.82 -51.42 67.54 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.128 0.571 . . . . 0.0 112.142 173.779 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.418 ' HB3' HD13 ' A' ' 90' ' ' LEU . 9.5 pt20 -83.46 -12.68 56.07 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 114.971 1.471 . . . . 0.0 114.971 -175.506 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 59.0 t30 -107.4 -22.77 12.45 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.545 1.138 . . . . 0.0 112.869 -172.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 13.5 t -129.69 -49.69 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 C-N-CA 123.361 0.664 . . . . 0.0 112.081 -179.103 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.5 t -69.6 -64.16 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 CA-C-N 118.694 0.679 . . . . 0.0 110.586 -173.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 73.3 t -57.04 -45.08 83.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.675 0 C-N-CA 124.703 1.201 . . . . 0.0 110.259 172.779 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.3 tppp? -53.15 -47.34 68.84 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.179 0.991 . . . . 0.0 112.066 -179.472 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 32.6 m -76.68 -40.95 47.3 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -179.4 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 59.6 mt -63.25 -33.4 75.41 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.264 0.626 . . . . 0.0 112.329 176.328 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 22.3 t-105 -73.2 -31.06 63.96 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.56 1.544 . . . . 0.0 113.274 174.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 54.8 mtmt -77.65 -9.52 59.02 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 174.501 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 47.0 t-80 -63.29 149.38 45.79 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.746 1.218 . . . . 0.0 113.221 -179.139 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 17.1 pt20 -61.31 -12.53 14.06 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 115.265 1.58 . . . . 0.0 115.265 176.607 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 20.2 m-85 -124.22 17.04 9.13 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.96 1.704 . . . . 0.0 113.645 -179.341 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.51 -27.81 65.51 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 114.168 1.173 . . . . 0.0 114.168 176.777 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 41.5 p-90 -56.62 -37.78 61.37 Favored Pre-proline 0 CA--C 1.547 0.831 0 N-CA-C 118.096 2.628 . . . . 0.0 118.096 -169.58 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -75.17 -5.81 17.16 Favored 'Trans proline' 0 CA--C 1.544 0.988 0 CA-C-N 123.221 2.186 . . . . 0.0 113.623 174.859 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -106.49 -5.61 18.74 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.432 1.493 . . . . 0.0 112.877 178.514 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -61.24 -18.07 56.52 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 114.392 1.256 . . . . 0.0 114.392 178.214 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -143.48 155.98 60.46 Favored Pre-proline 0 CA--C 1.545 0.755 0 C-N-CA 125.868 1.667 . . . . 0.0 110.677 -175.718 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -65.67 151.32 84.92 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 122.752 2.302 . . . . 0.0 111.912 171.61 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 60.8 t -66.78 104.67 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 124.051 0.94 . . . . 0.0 110.773 176.3 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 -74.88 85.59 2.23 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.202 1.001 . . . . 0.0 110.089 169.501 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -51.84 -25.91 8.82 Favored 'General case' 0 CA--C 1.548 0.904 0 N-CA-C 114.053 1.131 . . . . 0.0 114.053 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 81.7 mt -64.17 -49.9 79.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 C-N-CA 125.618 1.567 . . . . 0.0 111.436 171.488 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -73.88 -40.52 63.15 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 125.239 1.416 . . . . 0.0 112.87 -178.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -74.29 -10.71 59.86 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.928 1.291 . . . . 0.0 113.132 174.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 68.3 m-20 56.11 56.53 5.8 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.48 1.912 . . . . 0.0 112.503 -179.283 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 46.6 mt -115.67 80.51 8.39 Favored Pre-proline 0 CA--C 1.545 0.77 0 C-N-CA 126.318 1.847 . . . . 0.0 110.35 -177.734 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -68.1 -6.26 16.77 Favored 'Trans proline' 0 CA--C 1.543 0.937 0 C-N-CA 123.977 3.118 . . . . 0.0 114.361 -174.195 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 29.4 m-20 -122.29 12.44 10.2 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.06 1.744 . . . . 0.0 112.53 178.526 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 80.0 t80 -48.5 -55.44 11.01 Favored 'General case' 0 N--CA 1.476 0.859 0 O-C-N 120.915 -1.116 . . . . 0.0 113.319 -175.258 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -73.95 -12.17 60.57 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.825 1.25 . . . . 0.0 114.353 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.61 -34.69 67.54 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 121.123 -0.986 . . . . 0.0 111.807 174.072 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.4 mp -92.28 -47.42 14.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 124.68 1.192 . . . . 0.0 110.906 174.68 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.556 HD11 ' HB2' ' A' ' 115' ' ' TYR . 38.6 mm -76.99 110.51 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 123.511 0.724 . . . . 0.0 111.335 -177.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -71.31 -35.87 71.41 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.805 1.242 . . . . 0.0 112.836 174.747 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 13.2 p30 -147.69 83.14 7.66 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 125.534 1.534 . . . . 0.0 111.721 -168.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -69.37 131.66 22.27 Favored 'Trans proline' 0 CA--C 1.535 0.566 0 C-N-CA 123.467 2.778 . . . . 0.0 110.919 -177.763 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 6.4 tpt -156.49 133.73 10.62 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.004 1.322 . . . . 0.0 110.28 -170.202 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -146.79 151.06 36.53 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.631 1.572 . . . . 0.0 111.22 -176.729 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.6 ttp -56.23 -36.78 68.86 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.462 1.505 . . . . 0.0 113.284 -170.298 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -58.94 -25.77 59.86 Favored Glycine 0 CA--C 1.533 1.188 0 C-N-CA 125.014 1.292 . . . . 0.0 114.77 174.505 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 39.8 m -92.96 -33.63 14.09 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.572 1.149 . . . . 0.0 111.634 175.133 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 44.7 mt -56.78 -50.84 73.32 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 CA-C-N 119.196 0.907 . . . . 0.0 110.497 174.553 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -62.07 -33.06 73.7 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 177.185 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.431 ' HE3' ' HA ' ' A' ' 88' ' ' LYS . 0.6 OUTLIER -67.45 -27.73 67.29 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -176.501 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 5.1 ptp180 -84.06 -31.93 25.1 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 113.839 1.051 . . . . 0.0 113.839 169.583 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.418 HD13 ' HB3' ' A' ' 43' ' ' GLN . 87.4 mt -62.04 -33.71 74.87 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 119.541 1.064 . . . . 0.0 113.311 168.075 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -67.73 1.92 2.22 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 125.603 1.561 . . . . 0.0 113.805 172.463 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 57.8 m-80 -137.57 -169.78 2.6 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 128.494 2.718 . . . . 0.0 110.696 -177.285 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 75.1 m-80 -113.73 44.21 1.66 Allowed 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.537 1.535 . . . . 0.0 111.051 -178.507 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 41.2 t80 -64.4 -35.95 82.56 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.553 0.741 . . . . 0.0 111.92 -175.713 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -137.6 176.43 8.71 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 127.098 2.159 . . . . 0.0 111.842 -178.303 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 2.5 t-105 -108.89 -25.29 10.84 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.882 1.673 . . . . 0.0 112.283 -178.35 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 51.9 p -133.05 145.73 51.06 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.25 1.42 . . . . 0.0 113.678 -168.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -69.9 -19.66 63.4 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 115.229 1.566 . . . . 0.0 115.229 -175.245 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 18.0 m -56.24 -28.81 59.78 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.785 0.834 . . . . 0.0 113.067 174.662 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -71.98 -44.12 64.03 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.554 0.742 . . . . 0.0 112.299 174.569 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 42.5 t -61.16 -38.97 88.38 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.713 0.805 . . . . 0.0 111.797 172.32 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 83.5 mtp -61.42 -43.17 99.33 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 121.44 -0.787 . . . . 0.0 112.387 172.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . 0.253 2.4 pt20 -67.43 -30.4 70.13 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 175.763 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -68.03 -43.62 78.34 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.374 -0.829 . . . . 0.0 111.961 170.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -59.36 -45.44 91.41 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 121.202 -0.936 . . . . 0.0 112.312 172.277 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 18.6 t30 -56.83 -47.38 80.44 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 122.965 0.506 . . . . 0.0 111.67 172.561 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 74.6 m -61.05 -37.91 84.32 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.907 0.883 . . . . 0.0 112.508 178.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 51.9 ttp -59.99 -55.9 28.34 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 119.091 0.86 . . . . 0.0 111.983 173.539 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -64.74 -42.47 95.18 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 112.207 0.447 . . . . 0.0 112.207 -177.602 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 98.0 m -64.61 -46.91 80.62 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.444 -0.785 . . . . 0.0 112.355 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -63.56 -32.49 73.97 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 119.909 1.232 . . . . 0.0 112.143 179.317 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 94.8 m -61.97 -43.62 98.46 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.761 0.824 . . . . 0.0 112.927 170.527 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -67.37 -32.71 73.83 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 178.163 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 89.1 mt -65.12 -56.3 16.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 C-N-CA 123.388 0.675 . . . . 0.0 110.825 177.232 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' TYR . . . . . 0.556 ' HB2' HD11 ' A' ' 77' ' ' ILE . 31.9 t80 -69.13 -37.25 78.2 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 -172.483 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 64.7 m-80 -100.79 159.3 15.3 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.862 0.865 . . . . 0.0 112.724 -170.6 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 49.2 mmtm -66.82 146.11 99.03 Favored Pre-proline 0 N--CA 1.476 0.867 0 C-N-CA 123.773 0.829 . . . . 0.0 110.571 172.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -66.24 -7.61 17.9 Favored 'Trans proline' 0 CA--C 1.542 0.919 0 C-N-CA 123.604 2.87 . . . . 0.0 114.656 -175.402 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 50.8 p -113.6 -0.66 14.28 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 126.624 1.969 . . . . 0.0 113.235 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -65.89 147.25 53.67 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.568 -0.708 . . . . 0.0 111.027 173.462 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -51.85 -48.49 63.96 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.568 0.747 . . . . 0.0 112.405 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 9.9 tp -57.02 -30.9 35.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 N-CA-C 114.073 1.138 . . . . 0.0 114.073 -179.792 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 51.9 t -72.76 -47.44 49.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 O-C-N 121.55 -0.719 . . . . 0.0 110.394 174.121 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 75.0 mt -61.08 -36.74 80.46 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 118.994 0.816 . . . . 0.0 111.808 176.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 11.2 mtt -59.01 -52.64 64.9 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.892 1.277 . . . . 0.0 112.011 169.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.14 -39.78 87.5 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.254 0.621 . . . . 0.0 112.542 176.716 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 90.3 mt-30 -62.51 -38.36 89.61 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.909 0.884 . . . . 0.0 112.833 174.117 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -75.49 -34.7 60.89 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.196 0.998 . . . . 0.0 113.214 178.027 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 72.0 mt -68.87 -45.51 70.81 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.182 0.593 . . . . 0.0 111.383 170.356 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -62.54 -39.95 95.24 Favored 'General case' 0 N--CA 1.468 0.467 0 O-C-N 121.281 -0.887 . . . . 0.0 112.98 -175.716 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 5.2 ptpp? -61.0 -42.36 98.3 Favored 'General case' 0 N--CA 1.474 0.737 0 O-C-N 121.382 -0.824 . . . . 0.0 112.36 176.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 87.8 mt -66.26 -46.24 87.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 C-N-CA 123.828 0.851 . . . . 0.0 110.632 174.343 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -50.09 -50.22 48.95 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 119.102 0.864 . . . . 0.0 111.188 174.494 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.2 mt -63.01 -42.17 99.76 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 178.216 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -62.0 -35.43 78.52 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 119.444 1.02 . . . . 0.0 112.964 174.143 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 34.6 mmtm -72.98 -52.43 14.52 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.862 1.265 . . . . 0.0 111.635 179.5 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.0 m -67.92 -25.24 31.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 CA-C-N 119.736 1.153 . . . . 0.0 112.447 178.409 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -61.69 -30.32 70.67 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.58 -0.7 . . . . 0.0 112.604 170.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -90.24 -9.45 47.99 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.758 1.223 . . . . 0.0 112.683 175.539 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 40.0 ttp -64.77 141.55 98.35 Favored Pre-proline 0 CA--C 1.547 0.859 0 CA-C-N 119.004 0.82 . . . . 0.0 109.86 169.014 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -51.99 151.69 15.66 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 122.945 2.43 . . . . 0.0 113.43 170.517 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 18.7 mm100 -90.64 -21.05 21.87 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.385 0.674 . . . . 0.0 112.648 172.161 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -93.97 159.39 15.19 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.673 1.589 . . . . 0.0 111.053 173.514 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -125.3 139.11 53.99 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.07 1.348 . . . . 0.0 111.293 -171.111 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 9.9 p -146.01 150.73 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 124.315 1.046 . . . . 0.0 111.438 -175.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 24.6 tp10 -69.35 146.69 51.94 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.109 0.964 . . . . 0.0 111.715 171.593 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 147' ' ' LEU . . . . . 0.486 HD12 ' HG3' ' A' ' 35' ' ' LYS . 88.3 mt -75.64 156.84 34.46 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 113.608 0.966 . . . . 0.0 113.608 173.529 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 96.8 mt -69.03 155.28 93.9 Favored Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 124.315 1.046 . . . . 0.0 110.766 168.428 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -70.15 147.17 59.75 Favored 'Trans proline' 0 CA--C 1.547 1.166 0 C-N-CA 122.549 2.166 . . . . 0.0 111.992 -179.07 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -73.91 160.63 42.93 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 123.51 2.806 . . . . 0.0 112.465 179.135 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -65.79 150.04 96.78 Favored Pre-proline 0 CA--C 1.552 1.051 0 C-N-CA 123.577 0.751 . . . . 0.0 111.822 170.027 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -71.86 154.33 58.53 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 123.091 2.528 . . . . 0.0 112.397 178.077 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.43 162.64 17.38 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.381 1.072 . . . . 0.0 113.02 171.853 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . -147.08 6.72 1.14 Allowed Glycine 0 CA--C 1.538 1.487 0 N-CA-C 115.876 1.11 . . . . 0.0 115.876 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 25.8 ttmm . . . . . 0 C--O 1.252 1.22 0 C-N-CA 125.108 1.363 . . . . 0.0 111.741 173.856 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.43 0 N-CA-C 110.69 -0.964 . . . . 0.0 110.69 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 34.1 m -75.08 51.39 0.52 Allowed 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 125.906 1.682 . . . . 0.0 112.901 176.54 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.3 m -71.67 48.33 0.15 Allowed 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 127.789 2.435 . . . . 0.0 114.469 -172.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -163.46 -23.59 0.02 OUTLIER Glycine 0 CA--C 1.538 1.516 0 C-N-CA 125.646 1.593 . . . . 0.0 114.883 -178.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 64.0 p -155.42 142.46 19.17 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 118.931 1.366 . . . . 0.0 112.331 173.337 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.3 m -78.29 -14.94 59.21 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 -178.428 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 169.41 -168.97 41.69 Favored Glycine 0 CA--C 1.535 1.307 0 C-N-CA 125.486 1.517 . . . . 0.0 112.535 -175.39 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -143.71 157.72 44.19 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.013 1.325 . . . . 0.0 112.767 179.25 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 34.1 m -132.69 -15.8 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 C-N-CA 125.963 1.705 . . . . 0.0 113.273 177.138 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 18.6 m -145.7 140.49 27.28 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 127.221 2.208 . . . . 0.0 108.713 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -149.19 134.71 9.68 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 123.786 0.835 . . . . 0.0 111.01 -172.521 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -77.77 -7.65 16.64 Favored 'Trans proline' 0 CA--C 1.543 0.972 0 C-N-CA 123.989 3.126 . . . . 0.0 115.339 -173.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 7.5 t -133.56 -21.07 2.01 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 -172.452 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 60.4 tttp -65.49 128.78 94.08 Favored Pre-proline 0 N--CA 1.476 0.861 0 CA-C-N 119.451 1.023 . . . . 0.0 109.871 169.765 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -71.84 144.32 43.24 Favored 'Trans proline' 0 CA--C 1.534 0.489 0 C-N-CA 122.602 2.202 . . . . 0.0 112.254 -178.753 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 171.4 166.18 29.8 Favored Glycine 0 CA--C 1.528 0.888 0 C-N-CA 123.866 0.746 . . . . 0.0 114.33 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 8.6 ptp180 -164.66 167.83 18.71 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 127.461 2.304 . . . . 0.0 110.175 176.223 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 8.3 tppt? -76.11 114.24 14.54 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 166.859 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 67.2 p -105.84 169.5 8.45 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 125.18 1.392 . . . . 0.0 110.297 174.012 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 24.0 p-10 -50.52 -37.86 41.36 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 174.266 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -71.51 -48.07 51.26 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.519 0.727 . . . . 0.0 111.595 178.431 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 75.9 mt -65.54 -30.78 71.57 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.472 -0.767 . . . . 0.0 112.753 177.047 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 39.3 tt0 -59.56 -52.62 64.76 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 123.913 0.885 . . . . 0.0 109.681 168.879 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 64.9 t80 -58.73 -42.35 88.54 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.025 0.93 . . . . 0.0 112.755 179.453 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 96.7 mmm -53.95 -51.71 62.95 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 118.514 0.597 . . . . 0.0 112.008 174.258 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 4.3 tp60 -75.08 -34.06 61.72 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 121.17 -0.956 . . . . 0.0 113.496 -178.735 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 52.3 t30 -89.81 -22.67 21.99 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.512 1.125 . . . . 0.0 113.479 -168.035 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 6.0 t -130.64 -50.13 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 CA-C-N 118.103 0.411 . . . . 0.0 111.195 -175.531 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 17.0 t -68.19 -62.93 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 122.783 0.433 . . . . 0.0 110.189 -175.4 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 43.1 t -56.4 -48.47 79.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 C-N-CA 125.368 1.467 . . . . 0.0 110.387 173.463 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 24.6 ttpt -60.37 -43.01 96.98 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -173.442 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 53.1 m -71.42 -44.96 63.9 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 119.01 0.823 . . . . 0.0 112.22 173.13 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 70.0 mt -60.4 -35.09 74.95 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.315 0.961 . . . . 0.0 112.325 178.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 26.0 t-105 -69.77 -30.1 67.59 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.538 1.535 . . . . 0.0 113.494 176.409 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -84.38 -6.21 59.36 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 124.302 1.041 . . . . 0.0 113.756 177.54 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 45.7 t-80 -63.15 154.73 30.21 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.74 1.216 . . . . 0.0 113.154 -179.33 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 60.9 tt0 -56.47 -24.54 46.52 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.598 1.559 . . . . 0.0 113.931 175.084 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 -122.0 19.28 10.86 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.326 1.451 . . . . 0.0 113.841 -173.132 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.79 -26.74 63.47 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 176.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 61.3 p-90 -59.58 -35.45 30.05 Favored Pre-proline 0 CA--C 1.548 0.893 0 N-CA-C 117.861 2.541 . . . . 0.0 117.861 -169.789 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -74.93 -3.42 13.89 Favored 'Trans proline' 0 CA--C 1.544 0.986 0 CA-C-N 123.232 2.19 . . . . 0.0 113.558 174.23 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 56.5 m-85 -109.98 -6.48 15.16 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.472 1.509 . . . . 0.0 113.066 178.259 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 20.4 m-30 -62.87 -16.53 59.04 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 178.84 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -142.02 156.52 65.08 Favored Pre-proline 0 CA--C 1.544 0.739 0 C-N-CA 126.372 1.869 . . . . 0.0 110.239 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -64.65 152.96 79.91 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 122.673 2.249 . . . . 0.0 112.054 173.45 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 54.6 t -66.38 101.12 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 C-N-CA 124.088 0.955 . . . . 0.0 110.675 176.295 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 52.7 m-20 -75.5 84.67 2.58 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.512 1.125 . . . . 0.0 110.613 172.37 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.97 -28.29 36.65 Favored 'General case' 0 CA--C 1.547 0.827 0 N-CA-C 113.987 1.106 . . . . 0.0 113.987 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 81.9 mt -65.37 -50.1 74.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 124.766 1.226 . . . . 0.0 111.097 172.54 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -66.33 -41.83 89.05 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.217 1.407 . . . . 0.0 112.56 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.6 mp -80.13 -4.76 54.24 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.631 1.173 . . . . 0.0 113.22 177.278 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 60.3 t30 54.8 55.05 8.28 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 126.107 1.763 . . . . 0.0 113.48 -179.239 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 34.8 mt -114.62 83.13 8.57 Favored Pre-proline 0 CA--C 1.543 0.673 0 C-N-CA 126.387 1.875 . . . . 0.0 110.343 -178.117 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -68.07 -3.44 10.66 Favored 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 123.884 3.056 . . . . 0.0 114.337 -175.562 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -127.34 9.86 6.71 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 126.174 1.79 . . . . 0.0 112.821 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 65.7 t80 -51.93 -51.86 54.07 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-N 120.284 1.402 . . . . 0.0 112.89 -175.838 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -76.17 -10.88 59.75 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.16 1.384 . . . . 0.0 113.89 179.432 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -72.44 -42.95 64.45 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.82 0.848 . . . . 0.0 110.267 175.402 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.9 mp -79.11 -55.54 9.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 C-N-CA 124.708 1.203 . . . . 0.0 110.262 172.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 47.9 mm -85.01 104.22 12.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 CA-C-O 122.153 0.978 . . . . 0.0 111.387 -175.489 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -71.24 -29.46 65.15 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.955 1.702 . . . . 0.0 114.058 -179.26 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -143.75 77.42 15.0 Favored Pre-proline 0 CA--C 1.542 0.639 0 C-N-CA 125.486 1.514 . . . . 0.0 110.712 -172.582 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -67.06 142.84 63.11 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 123.983 3.122 . . . . 0.0 111.648 -179.254 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 8.0 tpt -157.46 137.87 12.86 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.555 1.542 . . . . 0.0 109.846 -176.593 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -146.54 150.04 34.77 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.955 1.302 . . . . 0.0 111.401 -176.351 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 9.7 ttp -56.78 -36.72 70.18 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.992 1.317 . . . . 0.0 113.511 -169.83 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -61.31 -21.59 59.98 Favored Glycine 0 CA--C 1.536 1.405 0 C-N-CA 124.888 1.233 . . . . 0.0 114.77 173.857 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 24.3 m -97.08 -34.1 11.28 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.807 1.243 . . . . 0.0 111.523 172.817 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 76.8 mt -55.42 -50.37 66.24 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 119.467 1.031 . . . . 0.0 110.653 173.568 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 14.1 ptmm? -61.81 -29.71 70.34 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 113.976 1.102 . . . . 0.0 113.976 176.368 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.413 ' HE3' ' HA ' ' A' ' 88' ' ' LYS . 1.5 tpmt? -70.64 -32.9 70.37 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.748 1.219 . . . . 0.0 113.301 -175.735 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 3.8 ptp180 -77.95 -31.43 50.91 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 169.571 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 80.8 mt -67.6 -28.47 67.78 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 114.04 1.126 . . . . 0.0 114.04 169.262 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -65.92 -8.48 22.63 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 125.271 1.428 . . . . 0.0 114.149 174.894 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 -135.17 163.64 29.49 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.702 1.601 . . . . 0.0 112.819 -171.032 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 -81.12 105.39 12.29 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 169.071 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -140.53 -40.71 0.42 Allowed 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.308 1.043 . . . . 0.0 112.675 -172.519 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -130.81 175.53 8.96 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 126.603 1.961 . . . . 0.0 111.25 172.67 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 3.1 t-105 -115.24 -21.2 10.04 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.602 1.161 . . . . 0.0 112.833 -174.308 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 91.7 p -127.19 149.16 50.1 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.387 1.075 . . . . 0.0 112.783 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -64.32 -20.32 66.02 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 114.212 1.19 . . . . 0.0 114.212 175.227 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 83.1 p -51.13 -38.38 51.66 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.022 0.929 . . . . 0.0 113.255 177.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -67.19 -43.16 82.84 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.357 1.063 . . . . 0.0 111.782 179.241 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 49.6 t -66.92 -36.35 82.06 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.23 1.012 . . . . 0.0 112.742 174.656 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 88.1 mtp -62.42 -41.66 98.87 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 121.425 -0.797 . . . . 0.0 111.964 176.615 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 61.8 mm-40 -64.68 -33.93 77.11 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 112.767 0.655 . . . . 0.0 112.767 173.341 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 87.5 m-20 -67.69 -41.86 82.98 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 120.967 -1.083 . . . . 0.0 111.78 174.447 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -59.38 -47.58 84.91 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.208 0.603 . . . . 0.0 112.308 169.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.75 -42.0 92.22 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 121.776 -0.577 . . . . 0.0 111.297 177.029 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 62.4 m -62.49 -45.47 92.85 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.72 0.808 . . . . 0.0 111.547 178.095 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 57.5 ttp -55.68 -52.4 63.99 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.157 0.983 . . . . 0.0 112.778 176.235 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -68.46 -37.28 80.04 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.0 m -59.28 -50.15 75.1 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.226 1.01 . . . . 0.0 111.818 173.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -57.97 -37.46 74.22 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.268 0.627 . . . . 0.0 112.18 -178.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 90.3 m -57.29 -43.16 82.94 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.122 0.969 . . . . 0.0 112.386 173.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -70.18 -29.57 66.47 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.3 1.04 . . . . 0.0 113.632 176.592 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 82.2 mt -75.67 -57.13 6.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 123.804 0.842 . . . . 0.0 110.894 179.663 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -69.74 -23.04 63.33 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 114.507 1.299 . . . . 0.0 114.507 -172.118 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 36.6 m-80 -120.32 165.93 14.21 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.336 1.054 . . . . 0.0 112.724 -170.566 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -70.19 148.47 95.85 Favored Pre-proline 0 N--CA 1.475 0.813 0 C-N-CA 124.178 0.991 . . . . 0.0 110.477 174.794 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -65.99 -6.38 14.25 Favored 'Trans proline' 0 CA--C 1.543 0.963 0 C-N-CA 123.634 2.889 . . . . 0.0 114.568 -178.319 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 67.9 p -116.0 1.32 13.26 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 126.641 1.977 . . . . 0.0 113.099 179.276 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -66.91 147.81 52.75 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 121.478 -0.764 . . . . 0.0 110.833 173.135 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -52.29 -48.55 65.28 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.441 0.696 . . . . 0.0 112.322 178.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.1 tp -58.15 -30.11 38.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 -178.816 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 39.2 t -71.38 -48.3 54.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 O-C-N 121.538 -0.726 . . . . 0.0 110.383 173.226 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 74.3 mt -61.35 -36.65 80.76 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 118.876 0.762 . . . . 0.0 111.701 177.502 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 11.7 mtt -59.23 -51.75 68.63 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 124.735 1.214 . . . . 0.0 111.984 169.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -59.97 -40.9 90.68 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 123.191 0.596 . . . . 0.0 112.474 176.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 89.5 mt-30 -61.71 -45.96 91.71 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 119.085 0.857 . . . . 0.0 111.972 174.382 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -69.0 -28.0 66.2 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.445 1.098 . . . . 0.0 113.862 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 78.7 mt -78.36 -45.09 23.36 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.857 0.863 . . . . 0.0 111.547 169.792 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -61.04 -40.31 93.12 Favored 'General case' 0 N--CA 1.47 0.569 0 O-C-N 121.124 -0.985 . . . . 0.0 112.777 -175.189 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 60.6 pttt -59.22 -39.76 83.71 Favored 'General case' 0 N--CA 1.474 0.741 0 O-C-N 121.535 -0.728 . . . . 0.0 112.282 176.389 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 69.1 mt -72.66 -42.37 62.61 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 C-N-CA 124.457 1.103 . . . . 0.0 111.272 175.686 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -50.85 -51.58 49.9 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.395 0.998 . . . . 0.0 110.384 171.654 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 99.1 mt -62.18 -45.03 95.21 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 177.027 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -62.89 -30.61 71.66 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 119.603 1.092 . . . . 0.0 113.402 179.074 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 70.3 mmtt -75.1 -54.92 6.31 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 124.658 1.183 . . . . 0.0 112.262 174.216 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 6.0 m -66.13 -25.03 34.8 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 CA-C-N 120.691 1.587 . . . . 0.0 112.535 -178.469 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -58.09 -28.47 64.62 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 172.209 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -97.81 -3.18 39.38 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.235 1.414 . . . . 0.0 112.423 178.6 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 42.9 ttp -62.64 138.27 96.71 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 123.994 0.917 . . . . 0.0 110.728 173.637 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.07 125.98 15.62 Favored 'Trans proline' 0 CA--C 1.534 0.516 0 C-N-CA 122.864 2.376 . . . . 0.0 110.365 177.295 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 80.4 mm-40 -76.2 -22.4 55.34 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 113.472 0.915 . . . . 0.0 113.472 -173.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -75.13 159.02 32.14 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.244 1.417 . . . . 0.0 111.585 169.482 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -122.59 129.65 52.14 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.574 1.55 . . . . 0.0 111.208 -174.404 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 78.8 t -141.76 131.5 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 125.545 1.538 . . . . 0.0 110.961 -169.43 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -69.31 125.03 25.42 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.601 1.56 . . . . 0.0 111.074 169.779 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 97.7 mt -76.1 152.59 36.75 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 178.418 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 4.5 pp -73.81 153.94 89.16 Favored Pre-proline 0 CA--C 1.552 1.02 0 C-N-CA 124.165 0.986 . . . . 0.0 111.217 168.264 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -78.21 156.52 29.67 Favored 'Trans proline' 0 CA--C 1.548 1.183 0 C-N-CA 123.179 2.586 . . . . 0.0 113.057 -175.757 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -70.94 170.12 18.77 Favored 'Trans proline' 0 CA--C 1.542 0.911 0 C-N-CA 123.748 2.966 . . . . 0.0 112.752 174.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -144.53 154.83 56.89 Favored Pre-proline 0 CA--C 1.551 0.985 0 C-N-CA 125.326 1.45 . . . . 0.0 111.89 -179.201 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.13 167.86 24.93 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 123.64 2.893 . . . . 0.0 113.116 178.188 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 64.4 pttt -146.5 168.75 20.44 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.971 1.708 . . . . 0.0 112.383 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . -165.19 37.93 0.28 Allowed Glycine 0 CA--C 1.534 1.275 0 C-N-CA 124.611 1.101 . . . . 0.0 113.785 -175.662 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 15.4 ptmm? . . . . . 0 C--O 1.255 1.367 0 C-N-CA 126.502 1.921 . . . . 0.0 112.919 -175.727 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.488 0 N-CA-C 112.13 -0.388 . . . . 0.0 112.13 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 49.2 m -74.29 64.26 1.09 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 126.138 1.775 . . . . 0.0 113.29 179.336 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 78.6 p -62.08 167.04 4.2 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.097 1.359 . . . . 0.0 113.446 172.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -140.31 82.58 0.24 Allowed Glycine 0 CA--C 1.531 1.073 0 C-N-CA 125.088 1.328 . . . . 0.0 112.438 -172.669 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 91.6 p -141.16 171.82 13.53 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 125.644 1.578 . . . . 0.0 112.318 -179.469 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 77.2 p -139.37 13.85 2.58 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.057 1.343 . . . . 0.0 114.366 -169.555 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 88.22 -138.25 14.91 Favored Glycine 0 CA--C 1.533 1.179 0 C-N-CA 124.292 0.948 . . . . 0.0 111.885 -173.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -130.79 166.53 20.61 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.895 1.278 . . . . 0.0 112.576 175.695 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 27.2 m -136.92 -11.31 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.259 0 C-N-CA 125.986 1.714 . . . . 0.0 113.417 -175.154 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 40.3 p -150.18 143.7 25.18 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 126.691 1.997 . . . . 0.0 110.87 -177.742 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -154.55 134.62 8.05 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 124.473 1.109 . . . . 0.0 110.092 -173.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -70.17 -16.73 35.91 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 123.562 2.842 . . . . 0.0 115.309 -173.299 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 44.2 m -159.09 91.12 1.01 Allowed 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 119.859 1.209 . . . . 0.0 111.794 176.461 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.426 ' HE2' ' HA ' ' A' ' 94' ' ' TYR . 0.0 OUTLIER -139.73 159.68 64.11 Favored Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 126.581 1.952 . . . . 0.0 112.604 -176.376 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -70.94 157.72 57.34 Favored 'Trans proline' 0 CA--C 1.539 0.767 0 C-N-CA 122.906 2.404 . . . . 0.0 112.257 176.077 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 129.1 164.03 11.38 Favored Glycine 0 CA--C 1.529 0.96 0 C-N-CA 124.481 1.039 . . . . 0.0 113.299 176.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 34.8 ptt180 -163.79 157.87 19.46 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 126.235 1.814 . . . . 0.0 110.425 175.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 26.0 ttpt -71.45 135.96 47.42 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.451 0.7 . . . . 0.0 110.315 170.627 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 70.9 p -140.22 166.79 23.71 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 125.951 1.701 . . . . 0.0 110.181 -175.455 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 25.1 p-10 -46.63 -37.69 8.59 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 170.429 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 -70.31 -55.57 8.87 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.573 0.749 . . . . 0.0 111.683 179.205 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 86.2 mt -62.67 -34.55 77.34 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 121.534 -0.729 . . . . 0.0 112.597 178.284 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -56.24 -54.3 47.01 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.904 0.882 . . . . 0.0 110.842 170.499 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 75.1 t80 -59.29 -40.54 86.45 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 119.098 0.863 . . . . 0.0 112.925 179.175 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 92.3 mmm -55.48 -50.98 68.47 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 118.754 0.706 . . . . 0.0 111.795 172.453 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -85.56 -3.39 58.86 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 114.874 1.435 . . . . 0.0 114.874 -175.147 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 38.5 m-80 -118.33 -17.48 9.46 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.027 1.331 . . . . 0.0 114.265 -178.659 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 37.9 t -136.99 -50.18 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-N 119.211 0.914 . . . . 0.0 111.866 -178.335 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.4 t -67.75 -62.71 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 CA-C-N 119.378 0.99 . . . . 0.0 110.634 -174.468 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 84.5 t -60.71 -44.46 97.24 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 C-N-CA 123.736 0.814 . . . . 0.0 110.481 174.836 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt -56.68 -44.23 81.23 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 118.688 0.676 . . . . 0.0 112.401 -178.784 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 56.4 m -70.56 -47.14 61.75 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 122.672 0.389 . . . . 0.0 111.815 176.793 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 63.2 mt -61.48 -33.24 73.44 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 123.323 0.649 . . . . 0.0 112.199 179.09 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' TRP . . . . . 0.454 ' CZ3' ' HE3' ' A' ' 87' ' ' LYS . 21.3 t-105 -72.48 -29.18 63.42 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 125.655 1.582 . . . . 0.0 113.475 175.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt -82.04 -8.96 59.69 Favored 'General case' 0 N--CA 1.479 0.984 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 176.48 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 44.2 t-80 -62.17 152.76 32.21 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.638 1.175 . . . . 0.0 113.096 -178.315 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 22.6 tp60 -57.87 -19.84 32.24 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.487 1.515 . . . . 0.0 114.017 174.766 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 15.4 m-85 -122.9 16.09 10.08 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.709 1.604 . . . . 0.0 113.995 -173.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.34 -29.64 66.39 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 114.149 1.166 . . . . 0.0 114.149 178.531 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' TRP . . . . . 0.428 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 39.8 p-90 -56.4 -37.31 56.12 Favored Pre-proline 0 CA--C 1.547 0.841 0 N-CA-C 117.079 2.252 . . . . 0.0 117.079 -171.329 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.428 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 55.8 Cg_endo -67.95 -6.53 17.27 Favored 'Trans proline' 0 C--N 1.356 0.924 0 CA-C-N 122.997 2.106 . . . . 0.0 114.985 172.267 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -113.69 -3.08 13.6 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.424 1.489 . . . . 0.0 113.129 179.119 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.8 m-30 -63.76 -20.61 65.9 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 113.666 0.987 . . . . 0.0 113.666 176.212 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -140.65 157.32 68.2 Favored Pre-proline 0 CA--C 1.545 0.772 0 C-N-CA 126.683 1.993 . . . . 0.0 110.048 -177.541 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -65.08 153.46 78.18 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 122.608 2.205 . . . . 0.0 112.144 174.526 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 63.7 t -65.77 102.51 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 C-N-CA 124.179 0.992 . . . . 0.0 110.963 176.727 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 42.9 m-20 -74.58 86.76 2.11 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.627 1.171 . . . . 0.0 109.855 169.349 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -52.47 -25.75 11.02 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.408 1.262 . . . . 0.0 114.408 -177.041 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 80.7 mt -64.5 -50.58 75.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 125.207 1.403 . . . . 0.0 111.323 171.676 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 55.2 mttm -73.48 -40.64 63.95 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 125.277 1.431 . . . . 0.0 112.937 -178.559 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -74.36 -10.65 59.79 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.19 0.996 . . . . 0.0 113.406 173.552 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 60.3 t30 58.87 54.58 5.05 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 126.7 2.0 . . . . 0.0 112.865 177.809 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 48.4 mt -115.21 81.59 8.29 Favored Pre-proline 0 CA--C 1.545 0.788 0 C-N-CA 126.681 1.993 . . . . 0.0 110.147 -175.253 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -67.68 -5.78 15.11 Favored 'Trans proline' 0 CA--C 1.543 0.956 0 C-N-CA 124.154 3.236 . . . . 0.0 114.925 -171.247 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -128.92 15.47 6.33 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.895 1.678 . . . . 0.0 112.51 179.357 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 63.4 t80 -47.25 -55.14 9.2 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 113.987 1.106 . . . . 0.0 113.987 -172.311 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -74.28 -13.23 60.74 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.783 1.233 . . . . 0.0 114.207 -178.767 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.418 ' HE2' ' HA ' ' A' ' 75' ' ' LYS . 8.9 mmpt? -76.41 -33.12 58.83 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.622 1.169 . . . . 0.0 111.981 175.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.3 mp -91.84 -46.42 14.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 124.687 1.195 . . . . 0.0 110.67 172.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 35.7 mm -84.34 99.01 6.25 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 CA-C-O 122.148 0.975 . . . . 0.0 111.276 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.55 -38.44 87.45 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 126.172 1.789 . . . . 0.0 113.85 177.09 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 -142.52 87.25 9.36 Favored Pre-proline 0 CA--C 1.543 0.706 0 C-N-CA 125.055 1.342 . . . . 0.0 110.616 -176.03 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -68.4 141.98 53.05 Favored 'Trans proline' 0 CA--C 1.538 0.691 0 C-N-CA 123.668 2.912 . . . . 0.0 111.666 -176.875 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.8 tpt -156.25 134.89 11.68 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.498 1.119 . . . . 0.0 110.773 -171.084 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -147.68 152.87 38.55 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.518 1.527 . . . . 0.0 111.237 -176.8 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 6.6 ttp -58.01 -36.89 73.33 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.434 1.094 . . . . 0.0 113.62 -170.404 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -59.49 -29.66 66.94 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 124.497 1.046 . . . . 0.0 114.296 174.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 27.9 m -85.88 -31.31 22.28 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.282 1.033 . . . . 0.0 111.786 176.426 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 62.4 mt -60.57 -52.48 61.04 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 CA-C-N 118.887 0.767 . . . . 0.0 110.661 174.465 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.454 ' HE3' ' CZ3' ' A' ' 51' ' ' TRP . 17.0 ptpt -57.89 -32.84 68.12 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 178.523 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 2.8 tppp? -59.29 -38.55 80.45 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 178.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 5.6 ptp180 -86.46 -19.06 30.15 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 114.213 1.19 . . . . 0.0 114.213 175.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 52.9 mt -70.68 -48.15 56.28 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 119.061 0.846 . . . . 0.0 111.964 167.664 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -62.86 -14.27 44.01 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 115.076 1.51 . . . . 0.0 115.076 -171.847 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 46.2 p30 -124.25 14.04 8.98 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 126.141 1.776 . . . . 0.0 113.133 177.181 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . 0.269 6.3 p30 37.24 65.75 0.49 Allowed 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 127.149 2.18 . . . . 0.0 114.403 -174.043 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' TYR . . . . . 0.426 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 74.1 t80 -59.29 -24.2 63.07 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.013 1.325 . . . . 0.0 114.097 179.73 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -132.42 -174.31 3.41 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 129.101 2.96 . . . . 0.0 111.863 -169.995 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 2.3 t-105 -112.67 -27.47 8.17 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.761 1.224 . . . . 0.0 113.382 -174.353 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 39.9 t -134.15 145.29 49.12 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.627 1.171 . . . . 0.0 111.773 -177.409 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -57.24 -18.86 18.01 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.837 1.655 . . . . 0.0 114.769 172.795 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 10.8 m -53.82 -32.89 54.42 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.206 1.002 . . . . 0.0 113.132 177.191 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -73.91 -42.61 60.4 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.214 1.006 . . . . 0.0 112.757 175.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 49.5 t -60.4 -40.75 92.06 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.271 1.028 . . . . 0.0 112.091 171.526 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 81.7 mtp -61.5 -41.59 97.52 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.099 0.96 . . . . 0.0 112.553 174.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -65.5 -34.04 77.34 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 174.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -67.26 -42.79 83.32 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 121.25 -0.907 . . . . 0.0 111.762 173.019 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -60.75 -45.86 92.67 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.254 -0.904 . . . . 0.0 112.599 172.215 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 35.5 t30 -55.62 -45.06 77.57 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.218 0.607 . . . . 0.0 111.678 173.072 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 88.7 m -62.69 -45.18 93.95 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.389 1.076 . . . . 0.0 112.149 179.104 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 12.7 ttm -55.69 -59.56 4.69 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.537 1.135 . . . . 0.0 112.453 177.787 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 -65.18 -34.98 79.66 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 121.98 -0.45 . . . . 0.0 112.136 -178.53 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 16.5 m -58.92 -51.77 68.62 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.322 1.049 . . . . 0.0 111.92 173.27 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -56.43 -40.08 74.16 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.773 0.829 . . . . 0.0 111.763 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 96.6 m -55.8 -50.72 69.73 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.3 0.64 . . . . 0.0 111.955 171.408 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -62.25 -26.59 68.47 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 114.07 1.137 . . . . 0.0 114.07 178.87 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 74.4 mt -73.63 -59.17 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 C-N-CA 123.75 0.82 . . . . 0.0 110.615 173.45 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -74.29 -46.42 41.28 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 -172.2 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -97.58 152.01 19.48 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.769 1.228 . . . . 0.0 111.305 -179.296 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 49.5 mmtm -81.9 155.87 70.17 Favored Pre-proline 0 N--CA 1.475 0.815 0 C-N-CA 125.343 1.457 . . . . 0.0 111.558 -175.774 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' PRO . . . . . 0.428 ' HA ' HG11 ' A' ' 123' ' ' VAL . 49.9 Cg_endo -62.95 -0.7 2.25 Favored 'Trans proline' 0 CA--C 1.543 0.973 0 C-N-CA 124.181 3.254 . . . . 0.0 115.759 -178.887 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 64.0 p -114.13 -4.23 13.15 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 126.878 2.071 . . . . 0.0 113.097 178.239 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 74.9 m-20 -76.24 142.74 41.33 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.038 0.836 . . . . 0.0 110.814 172.859 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -57.62 -46.27 84.31 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 121.49 -0.756 . . . . 0.0 112.299 -176.808 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.1 tp -53.63 -28.58 16.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 125.823 1.649 . . . . 0.0 114.629 175.789 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.428 HG11 ' HA ' ' A' ' 118' ' ' PRO . 55.8 t -75.66 -44.54 40.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 O-C-N 121.021 -1.049 . . . . 0.0 110.758 173.434 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 67.1 mt -61.11 -36.15 78.94 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 119.058 0.844 . . . . 0.0 111.579 174.787 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 10.4 mtt -58.9 -51.64 69.15 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.582 1.153 . . . . 0.0 111.972 169.753 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.27 -40.55 94.5 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.432 0.693 . . . . 0.0 112.536 177.374 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -61.36 -49.17 78.04 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.793 0.837 . . . . 0.0 111.664 174.405 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.87 -43.43 98.42 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.735 0.814 . . . . 0.0 112.495 179.419 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 87.2 mt -64.66 -45.79 85.22 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.593 0.757 . . . . 0.0 111.893 173.664 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -64.38 -36.42 84.08 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.056 -1.027 . . . . 0.0 113.352 -176.213 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 69.5 mttt -57.65 -49.23 77.16 Favored 'General case' 0 N--CA 1.478 0.937 0 O-C-N 121.453 -0.779 . . . . 0.0 111.179 173.426 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 89.9 mt -66.08 -43.37 92.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 123.918 0.887 . . . . 0.0 111.17 178.238 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -51.4 -53.3 38.1 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.741 0.816 . . . . 0.0 110.783 173.891 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 95.6 mt -61.69 -42.61 99.16 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.01 0.524 . . . . 0.0 112.392 177.837 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.61 -34.59 75.92 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-N 119.084 0.857 . . . . 0.0 113.072 178.506 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -74.69 -54.36 7.55 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.507 1.123 . . . . 0.0 112.401 175.764 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.9 m -64.94 -23.94 34.48 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 CA-C-N 120.306 1.412 . . . . 0.0 112.509 -178.655 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -59.29 -31.26 68.96 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 170.803 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 91.5 mt-30 -90.36 -11.75 39.68 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.016 1.326 . . . . 0.0 112.742 176.023 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 45.3 ttp -64.91 137.32 97.11 Favored Pre-proline 0 CA--C 1.546 0.792 0 CA-C-N 119.066 0.848 . . . . 0.0 110.571 174.3 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -66.65 130.9 24.52 Favored 'Trans proline' 0 CA--C 1.537 0.636 0 C-N-CA 122.911 2.407 . . . . 0.0 111.665 -179.521 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -68.52 -30.52 69.34 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.069 1.347 . . . . 0.0 112.45 178.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -76.35 158.83 31.08 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.655 1.582 . . . . 0.0 113.21 173.566 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -112.68 139.58 48.16 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 124.939 1.296 . . . . 0.0 110.499 177.602 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 10.2 p -143.97 134.62 21.36 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-O 122.245 1.021 . . . . 0.0 110.76 169.548 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 45.9 tt0 -64.28 128.85 37.6 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.412 1.885 . . . . 0.0 111.219 174.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 88.5 mt -75.06 145.37 42.39 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 113.208 0.818 . . . . 0.0 113.208 -177.252 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 4.4 pp -70.13 154.0 94.89 Favored Pre-proline 0 CA--C 1.551 0.998 0 C-N-CA 124.296 1.038 . . . . 0.0 111.718 169.43 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_endo -77.2 150.0 28.73 Favored 'Trans proline' 0 CA--C 1.546 1.111 0 C-N-CA 123.086 2.524 . . . . 0.0 112.346 -178.008 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -71.7 160.94 46.72 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 123.517 2.811 . . . . 0.0 112.561 177.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -64.9 145.84 98.89 Favored Pre-proline 0 CA--C 1.552 1.056 0 C-N-CA 123.712 0.805 . . . . 0.0 112.243 174.648 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -74.17 142.88 31.28 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.229 2.62 . . . . 0.0 112.475 -178.451 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -145.39 166.56 25.25 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 126.787 2.035 . . . . 0.0 110.803 175.106 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . -177.71 -7.16 0.02 OUTLIER Glycine 0 CA--C 1.541 1.663 0 N-CA-C 116.998 1.559 . . . . 0.0 116.998 179.607 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 86.4 tttt . . . . . 0 C--O 1.252 1.235 0 C-N-CA 126.006 1.722 . . . . 0.0 111.139 178.657 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.49 0 N-CA-C 111.78 -0.528 . . . . 0.0 111.78 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 19.7 m -74.51 39.24 0.12 Allowed 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 126.763 2.025 . . . . 0.0 114.885 -174.76 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.5 t 52.57 30.42 8.51 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 126.284 1.834 . . . . 0.0 114.7 -179.418 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 70.79 28.89 70.04 Favored Glycine 0 CA--C 1.537 1.437 0 O-C-N 121.025 -1.047 . . . . 0.0 114.887 179.562 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 65.4 p -52.65 138.15 29.22 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 125.339 1.456 . . . . 0.0 113.803 178.697 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 73.7 m -143.75 156.1 44.4 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.62 1.568 . . . . 0.0 111.744 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -176.36 34.7 0.09 OUTLIER Glycine 0 CA--C 1.534 1.25 0 C-N-CA 124.453 1.025 . . . . 0.0 113.885 -178.559 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -63.64 156.31 27.17 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 114.388 1.255 . . . . 0.0 114.388 -176.511 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 34.4 m -137.73 -17.8 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 C-N-CA 125.373 1.469 . . . . 0.0 113.988 -174.282 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.7 t -150.56 124.83 9.45 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 125.378 1.471 . . . . 0.0 109.875 177.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -155.81 122.12 2.63 Favored Pre-proline 0 CA--C 1.546 0.789 0 C-N-CA 124.511 1.124 . . . . 0.0 110.12 -172.269 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -77.04 -175.48 2.68 Favored 'Trans proline' 0 N--CA 1.454 -0.848 0 C-N-CA 123.938 3.092 . . . . 0.0 110.373 174.537 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 34.3 m 51.18 24.23 1.91 Allowed 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 126.14 1.776 . . . . 0.0 114.582 -170.059 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -130.03 134.43 26.13 Favored Pre-proline 0 N--CA 1.475 0.812 0 C-N-CA 127.374 2.269 . . . . 0.0 109.782 -178.711 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -70.47 143.26 46.92 Favored 'Trans proline' 0 CA--C 1.535 0.54 0 C-N-CA 122.596 2.198 . . . . 0.0 112.493 177.427 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 154.18 157.88 8.37 Favored Glycine 0 CA--C 1.529 0.962 0 C-N-CA 125.636 1.589 . . . . 0.0 112.279 177.436 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -172.22 165.55 6.01 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.965 1.706 . . . . 0.0 111.384 -174.128 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 26.1 pttm -67.11 139.44 57.52 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.013 0.925 . . . . 0.0 112.822 172.814 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 45.7 p -148.78 164.75 33.48 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 126.257 1.823 . . . . 0.0 110.582 178.152 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 23.7 p-10 -50.89 -39.24 53.68 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 178.571 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 66.8 mt-30 -72.62 -44.07 62.44 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 121.561 -0.712 . . . . 0.0 111.634 179.359 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 89.3 mt -64.22 -32.21 73.71 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 118.707 0.685 . . . . 0.0 111.99 174.541 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -61.18 -52.7 63.72 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-N 118.443 0.565 . . . . 0.0 109.924 168.521 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -55.09 -41.03 71.07 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.27 -0.894 . . . . 0.0 112.635 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 88.7 mmm -57.64 -56.43 22.04 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.878 -0.513 . . . . 0.0 112.042 170.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -77.19 -9.14 58.58 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 114.984 1.476 . . . . 0.0 114.984 -173.445 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -117.75 -23.63 7.51 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.353 1.461 . . . . 0.0 112.598 -169.781 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 18.7 t -127.53 -54.65 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 C-N-CA 123.429 0.692 . . . . 0.0 111.295 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.6 t -64.23 -59.95 3.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 CA-C-N 118.446 0.567 . . . . 0.0 110.652 -174.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 72.1 t -59.36 -46.38 92.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 124.457 1.103 . . . . 0.0 110.664 174.319 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 36.0 ttmt -57.39 -49.77 75.13 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.278 0.631 . . . . 0.0 112.357 -174.762 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 61.5 m -67.1 -43.85 81.45 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 118.599 0.636 . . . . 0.0 112.089 176.657 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 82.9 mt -62.28 -35.18 78.21 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 119.021 0.828 . . . . 0.0 112.481 178.82 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 20.7 t-105 -72.17 -27.09 62.36 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.76 1.624 . . . . 0.0 113.385 175.565 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.1 mtmp? -85.94 -4.47 59.17 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 177.328 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 39.7 t-80 -63.93 156.44 27.76 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.98 1.312 . . . . 0.0 113.185 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -57.77 -23.28 51.43 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.503 1.521 . . . . 0.0 113.638 173.536 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 -123.0 18.93 10.08 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.345 1.458 . . . . 0.0 114.137 -171.614 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.11 -26.34 63.92 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 176.608 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 58.9 p-90 -59.22 -35.92 36.41 Favored Pre-proline 0 CA--C 1.547 0.836 0 N-CA-C 117.978 2.585 . . . . 0.0 117.978 -169.729 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -74.52 -3.5 13.96 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 CA-C-N 123.277 2.206 . . . . 0.0 113.691 173.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 55.9 m-85 -110.3 -5.27 15.3 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.428 1.491 . . . . 0.0 113.14 178.849 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -62.84 -16.16 57.38 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 179.475 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -142.18 155.59 64.91 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 125.969 1.708 . . . . 0.0 110.389 -177.206 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -64.48 144.0 83.81 Favored 'Trans proline' 0 CA--C 1.538 0.677 0 C-N-CA 122.641 2.227 . . . . 0.0 111.713 173.778 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 76.5 t -60.6 115.58 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 123.546 0.738 . . . . 0.0 111.261 175.879 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 57.9 m-20 -92.44 103.89 16.27 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.249 1.02 . . . . 0.0 109.019 169.146 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.55 -30.08 60.12 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 113.418 0.896 . . . . 0.0 113.418 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 81.9 mt -65.03 -49.88 77.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 124.85 1.26 . . . . 0.0 111.155 174.721 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -63.84 -37.3 86.89 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.819 1.248 . . . . 0.0 113.403 -177.384 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.4 mp -89.68 -1.76 58.1 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.231 1.413 . . . . 0.0 112.36 178.216 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 23.0 m120 52.78 52.64 13.57 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 126.162 1.785 . . . . 0.0 113.264 -177.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 29.1 mt -107.71 94.28 11.91 Favored Pre-proline 0 CA--C 1.544 0.713 0 C-N-CA 126.26 1.824 . . . . 0.0 109.767 -179.35 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -68.72 -13.81 37.85 Favored 'Trans proline' 0 CA--C 1.542 0.877 0 C-N-CA 123.084 2.523 . . . . 0.0 114.55 -170.668 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 -136.65 21.05 3.1 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.573 1.549 . . . . 0.0 112.921 -173.437 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 64.7 t80 -46.14 -50.49 15.45 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.338 1.055 . . . . 0.0 113.827 -175.727 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 98.8 m-70 -73.48 -17.81 61.19 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 114.454 1.279 . . . . 0.0 114.454 -177.186 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 43.7 mttp -68.15 -39.53 82.63 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 119.343 0.974 . . . . 0.0 111.855 174.339 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.2 mp -81.37 -46.11 20.46 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 C-N-CA 124.8 1.24 . . . . 0.0 110.288 175.444 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 49.4 mm -98.57 98.48 7.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 CA-C-O 122.224 1.011 . . . . 0.0 111.353 -176.494 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.94 -32.5 74.06 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 126.397 1.879 . . . . 0.0 113.868 177.963 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -141.2 75.78 22.82 Favored Pre-proline 0 CA--C 1.542 0.664 0 C-N-CA 125.259 1.423 . . . . 0.0 110.559 -171.317 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -67.08 142.35 61.17 Favored 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 124.174 3.249 . . . . 0.0 111.289 -178.208 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 8.1 tpt -158.09 136.21 10.8 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.61 1.164 . . . . 0.0 110.221 -170.567 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -145.98 149.94 35.11 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.929 1.292 . . . . 0.0 111.563 -176.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.4 ttp -57.99 -37.01 73.45 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.667 1.187 . . . . 0.0 113.079 -171.052 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -61.7 -26.1 66.4 Favored Glycine 0 CA--C 1.533 1.178 0 C-N-CA 125.02 1.295 . . . . 0.0 114.597 174.196 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 20.2 m -82.74 -41.73 18.88 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.178 0.991 . . . . 0.0 110.708 170.455 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 68.4 mt -56.02 -51.9 56.23 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 124.114 0.966 . . . . 0.0 111.39 179.148 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.9 -35.68 71.38 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 113.291 0.848 . . . . 0.0 113.291 176.92 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -69.39 -34.34 74.37 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.089 0.956 . . . . 0.0 113.409 -177.301 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 4.9 ptp180 -76.89 -30.59 56.25 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 170.196 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 74.5 mt -63.9 -37.4 87.27 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 119.643 1.111 . . . . 0.0 113.011 168.759 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -75.87 8.55 2.99 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.495 1.518 . . . . 0.0 114.087 177.511 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 37.0 m-80 -137.3 167.07 22.31 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.652 1.981 . . . . 0.0 111.952 -179.564 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 5.4 p30 -80.62 111.49 17.1 Favored 'General case' 0 CA--C 1.545 0.75 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 168.025 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 56.2 t80 -148.25 -38.12 0.18 Allowed 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.864 0.691 . . . . 0.0 112.864 -171.447 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -138.56 173.12 11.92 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.35 1.86 . . . . 0.0 111.365 169.972 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.4 t-105 -108.86 -20.33 13.09 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 125.293 1.437 . . . . 0.0 112.162 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 40.5 t -130.34 138.48 50.45 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 126.087 1.755 . . . . 0.0 111.623 -171.132 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -65.92 -17.08 64.42 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 114.968 1.47 . . . . 0.0 114.968 178.836 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 35.6 p -53.18 -26.92 19.02 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.073 1.349 . . . . 0.0 114.019 172.785 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 53.7 mm-40 -80.54 -41.89 23.37 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.213 1.005 . . . . 0.0 111.999 177.032 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 52.0 t -60.37 -41.8 94.51 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.417 -0.802 . . . . 0.0 111.994 169.71 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 88.8 mtp -60.07 -43.88 95.13 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 121.305 -0.872 . . . . 0.0 112.827 175.489 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -72.06 -28.3 63.25 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 179.13 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 -66.32 -44.33 83.68 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.217 -0.927 . . . . 0.0 111.071 169.31 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -58.5 -47.53 83.78 Favored 'General case' 0 CA--C 1.539 0.519 0 O-C-N 121.273 -0.892 . . . . 0.0 112.422 172.225 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -61.55 -39.3 90.61 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 118.635 0.652 . . . . 0.0 111.724 177.225 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 89.2 m -63.61 -44.71 93.18 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.88 0.872 . . . . 0.0 111.972 176.292 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 52.0 ttp -56.67 -52.7 63.9 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.011 0.924 . . . . 0.0 112.675 176.826 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -68.48 -34.42 75.9 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 17.5 m -59.34 -52.05 67.31 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.295 1.038 . . . . 0.0 111.807 173.197 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 -57.48 -37.43 72.91 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.89 0.876 . . . . 0.0 112.193 -178.366 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 94.6 m -57.11 -44.12 82.97 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.18 0.992 . . . . 0.0 112.188 173.732 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -69.65 -30.05 67.66 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.393 1.077 . . . . 0.0 113.68 176.868 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 82.3 mt -74.26 -57.57 6.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 123.476 0.711 . . . . 0.0 110.747 178.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 37.4 t80 -68.11 -30.25 69.36 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 114.068 1.136 . . . . 0.0 114.068 -173.132 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 37.9 m-80 -113.74 162.92 15.69 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.981 0.912 . . . . 0.0 112.803 -169.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -68.6 148.12 98.06 Favored Pre-proline 0 N--CA 1.472 0.633 0 C-N-CA 124.635 1.174 . . . . 0.0 110.321 175.707 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -65.85 -6.89 15.18 Favored 'Trans proline' 0 CA--C 1.544 1.016 0 C-N-CA 123.718 2.945 . . . . 0.0 114.654 -176.633 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 53.9 p -114.3 -0.48 13.85 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 126.686 1.994 . . . . 0.0 113.199 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -66.3 147.2 53.66 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 121.528 -0.732 . . . . 0.0 110.967 173.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -52.56 -47.79 66.58 Favored 'General case' 0 CA--C 1.536 0.432 0 O-C-N 121.562 -0.711 . . . . 0.0 112.422 179.154 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.2 tp -58.37 -30.31 40.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -179.224 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 41.0 t -71.56 -47.43 58.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 O-C-N 121.499 -0.751 . . . . 0.0 110.332 173.6 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 76.1 mt -61.86 -36.73 82.09 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.124 0.875 . . . . 0.0 111.844 177.409 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 13.5 mtt -59.15 -51.53 69.63 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 124.638 1.175 . . . . 0.0 111.936 170.025 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.94 -39.07 90.82 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.265 0.626 . . . . 0.0 112.675 177.257 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 88.4 mt-30 -61.33 -47.76 84.42 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 119.121 0.873 . . . . 0.0 111.826 173.726 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -61.61 -45.59 93.44 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.73 0.812 . . . . 0.0 112.48 178.552 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 83.5 mt -65.91 -44.72 84.38 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.761 0.824 . . . . 0.0 112.268 175.568 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -65.08 -36.19 83.54 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 120.972 -1.08 . . . . 0.0 112.755 -177.392 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 55.0 mtmt -58.68 -45.5 89.3 Favored 'General case' 0 N--CA 1.474 0.746 0 O-C-N 121.5 -0.75 . . . . 0.0 111.701 172.045 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 93.2 mt -66.86 -43.51 89.54 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 123.507 0.723 . . . . 0.0 110.927 176.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -51.69 -51.42 56.12 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.757 0.823 . . . . 0.0 111.136 173.768 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 91.9 mt -61.98 -41.77 98.39 Favored 'General case' 0 CA--C 1.541 0.603 0 O-C-N 121.738 -0.601 . . . . 0.0 112.573 178.015 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 91.2 mm-40 -61.44 -36.47 80.49 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 119.392 0.997 . . . . 0.0 113.173 174.269 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 66.9 mmtt -72.62 -51.57 19.09 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.973 0.909 . . . . 0.0 112.435 177.311 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 6.0 m -67.98 -24.85 30.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 CA-C-N 120.333 1.424 . . . . 0.0 112.352 179.245 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -59.14 -27.19 65.39 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.535 -0.728 . . . . 0.0 112.833 171.18 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -99.84 2.22 43.7 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.539 1.536 . . . . 0.0 112.427 178.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 11.2 ttm -55.7 141.05 66.21 Favored Pre-proline 0 CA--C 1.548 0.869 0 C-N-CA 124.671 1.188 . . . . 0.0 111.824 172.553 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -67.24 122.15 9.38 Favored 'Trans proline' 0 CA--C 1.538 0.68 0 C-N-CA 122.996 2.464 . . . . 0.0 109.566 169.238 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -70.63 -17.99 62.87 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -171.453 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 9.8 mp0 -94.39 159.58 15.05 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.551 1.54 . . . . 0.0 111.941 179.774 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -120.96 129.81 53.59 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.113 1.365 . . . . 0.0 110.856 -175.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 9.5 p -152.63 151.41 11.87 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 124.624 1.17 . . . . 0.0 112.338 -179.329 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -57.24 137.91 55.38 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.55 1.54 . . . . 0.0 112.619 169.764 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 52.0 mt -78.32 139.27 38.84 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.486 0.714 . . . . 0.0 112.444 169.635 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 4.5 pp -75.52 153.99 85.68 Favored Pre-proline 0 CA--C 1.552 1.032 0 C-N-CA 123.885 0.874 . . . . 0.0 111.237 168.598 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 80.9 Cg_endo -76.79 151.16 31.45 Favored 'Trans proline' 0 CA--C 1.546 1.078 0 C-N-CA 123.177 2.585 . . . . 0.0 112.132 -178.712 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -71.99 157.64 54.16 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 123.258 2.639 . . . . 0.0 112.648 -179.314 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -71.81 154.14 92.92 Favored Pre-proline 0 CA--C 1.552 1.041 0 C-N-CA 124.371 1.069 . . . . 0.0 112.742 175.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -71.88 170.97 17.52 Favored 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 123.587 2.858 . . . . 0.0 112.403 171.517 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 49.1 mmtm -60.2 152.59 24.25 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.585 1.154 . . . . 0.0 112.609 174.107 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . -93.03 -173.63 40.76 Favored Glycine 0 CA--C 1.536 1.381 0 C-N-CA 125.101 1.334 . . . . 0.0 114.116 179.527 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 155' ' ' LYS . . . . . 0.406 ' HA ' ' HE2' ' A' ' 155' ' ' LYS . 0.4 OUTLIER . . . . . 0 C--O 1.252 1.194 0 C-N-CA 125.707 1.603 . . . . 0.0 112.961 176.039 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.491 0 N-CA-C 111.222 -0.751 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 24.5 t -151.19 68.48 0.93 Allowed 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.023 1.329 . . . . 0.0 111.203 -177.312 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.2 t -142.53 166.71 23.91 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 125.195 1.398 . . . . 0.0 111.845 -178.268 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 78.52 -32.66 1.85 Allowed Glycine 0 CA--C 1.538 1.507 0 C-N-CA 125.917 1.722 . . . . 0.0 115.471 177.211 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 66.9 m -74.41 -35.97 63.46 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 118.407 1.104 . . . . 0.0 112.512 174.325 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.4 m -74.43 152.23 39.51 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.638 1.175 . . . . 0.0 111.335 170.162 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 76.63 38.03 33.35 Favored Glycine 0 CA--C 1.534 1.26 0 O-C-N 121.843 -0.535 . . . . 0.0 112.377 -173.48 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.7 pm0 -53.67 157.94 2.07 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.919 1.688 . . . . 0.0 114.033 178.655 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 20.8 m -94.37 -14.27 8.14 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 C-N-CA 124.429 1.092 . . . . 0.0 113.763 -170.816 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.7 t -133.95 155.37 50.05 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.363 1.465 . . . . 0.0 111.536 -176.833 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 17.6 p-10 -121.99 102.2 41.1 Favored Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 125.617 1.567 . . . . 0.0 112.617 -168.425 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -73.75 -25.61 14.43 Favored 'Trans proline' 0 CA--C 1.543 0.948 0 C-N-CA 122.651 2.234 . . . . 0.0 113.155 173.522 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 42.2 m -141.82 -24.92 0.69 Allowed 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 115.165 1.543 . . . . 0.0 115.165 -174.673 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 25.1 ttmm -63.66 131.71 94.96 Favored Pre-proline 0 N--CA 1.478 0.964 0 CA-C-N 119.507 1.049 . . . . 0.0 110.907 177.344 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -74.14 155.11 47.22 Favored 'Trans proline' 0 CA--C 1.54 0.778 0 C-N-CA 123.011 2.474 . . . . 0.0 112.849 -178.251 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 171.2 173.41 38.21 Favored Glycine 0 CA--C 1.534 1.232 0 C-N-CA 125.5 1.524 . . . . 0.0 112.056 178.769 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 37.7 ptt180 -155.11 156.8 36.45 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.569 1.548 . . . . 0.0 110.74 172.074 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 36.3 mtpt -76.02 143.16 41.61 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 121.285 0.564 . . . . 0.0 110.053 168.714 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 67.0 p -139.45 165.41 27.31 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 125.134 1.373 . . . . 0.0 109.953 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 27.1 p-10 -52.49 -31.33 34.58 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 171.471 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.5 mm100 -67.91 -50.43 56.25 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.775 0.83 . . . . 0.0 111.377 176.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.0 mt -65.51 -32.65 74.37 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.736 -0.603 . . . . 0.0 112.519 175.255 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -61.6 -50.63 71.82 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 118.341 0.518 . . . . 0.0 110.77 169.878 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 65.4 t80 -57.61 -41.26 80.91 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.624 0.77 . . . . 0.0 112.313 178.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 91.0 mmm -56.91 -50.41 72.65 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 121.886 -0.509 . . . . 0.0 112.115 171.783 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -83.2 -10.07 58.8 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.704 1.372 . . . . 0.0 114.704 -174.532 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 61.9 t30 -119.79 -15.87 8.82 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.196 1.399 . . . . 0.0 113.297 -169.849 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 42.0 t -130.28 -53.56 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 C-N-CA 123.281 0.632 . . . . 0.0 110.96 176.698 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.6 t -69.83 -65.72 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 123.119 0.568 . . . . 0.0 110.77 -172.033 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 79.4 t -57.19 -46.0 84.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 124.398 1.079 . . . . 0.0 110.368 173.02 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.8 tttt -59.84 -40.05 87.19 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.386 0.674 . . . . 0.0 112.734 -175.245 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 62.7 m -73.85 -45.45 50.99 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 118.343 0.52 . . . . 0.0 111.801 174.589 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 67.9 mt -62.03 -33.46 74.41 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.295 0.638 . . . . 0.0 112.388 179.134 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 25.0 t-105 -69.46 -31.26 69.44 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.428 1.491 . . . . 0.0 113.188 175.085 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 56.4 mtmt -82.49 -5.34 58.65 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 113.692 0.997 . . . . 0.0 113.692 176.775 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 39.4 t-80 -64.22 156.38 28.92 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.6 1.16 . . . . 0.0 113.401 -179.023 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 19.2 mm100 -59.69 -23.27 62.98 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.241 1.416 . . . . 0.0 114.104 175.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -124.65 20.22 8.6 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.214 1.406 . . . . 0.0 113.48 -172.813 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.64 -26.59 64.49 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.102 1.361 . . . . 0.0 113.958 176.457 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 64.1 p-90 -58.87 -34.16 22.22 Favored Pre-proline 0 CA--C 1.547 0.84 0 N-CA-C 117.875 2.546 . . . . 0.0 117.875 -169.779 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -77.75 -0.18 10.4 Favored 'Trans proline' 0 CA--C 1.544 0.994 0 CA-C-N 123.213 2.183 . . . . 0.0 113.387 175.418 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -114.63 -3.67 12.88 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.759 1.624 . . . . 0.0 113.158 178.182 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 18.4 m-30 -62.68 -7.52 5.0 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 115.276 1.584 . . . . 0.0 115.276 179.443 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 25.1 pt20 -159.66 157.98 26.89 Favored Pre-proline 0 CA--C 1.545 0.773 0 C-N-CA 126.188 1.795 . . . . 0.0 110.009 -169.804 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -66.08 142.25 67.14 Favored 'Trans proline' 0 CA--C 1.538 0.676 0 C-N-CA 122.702 2.268 . . . . 0.0 111.731 177.295 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 68.1 t -60.3 139.0 20.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 123.859 0.864 . . . . 0.0 111.322 173.736 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 50.6 m-20 -114.4 107.09 15.09 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.079 1.352 . . . . 0.0 109.497 169.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.32 -26.89 63.59 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.148 0.979 . . . . 0.0 113.419 177.793 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 80.3 mt -66.56 -50.17 68.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 124.979 1.311 . . . . 0.0 110.864 173.655 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -64.56 -40.66 95.98 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.547 1.139 . . . . 0.0 112.695 -178.886 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 47.7 mt -88.78 -0.76 57.63 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.555 1.142 . . . . 0.0 114.007 179.621 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 61.0 t30 52.28 58.07 5.8 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.019 1.728 . . . . 0.0 113.68 -179.427 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 54.2 mt -114.42 83.21 8.32 Favored Pre-proline 0 CA--C 1.547 0.842 0 C-N-CA 126.331 1.852 . . . . 0.0 110.089 -176.074 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -67.79 -7.44 19.53 Favored 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 124.207 3.271 . . . . 0.0 115.456 -169.461 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -130.38 19.04 5.31 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.774 1.63 . . . . 0.0 112.257 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 70.4 t80 -46.96 -56.44 6.39 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.496 1.118 . . . . 0.0 113.526 -173.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -76.23 -3.07 34.44 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 114.608 1.336 . . . . 0.0 114.608 -179.128 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -84.1 -42.0 16.53 Favored 'General case' 0 N--CA 1.477 0.879 0 O-C-N 121.127 -0.983 . . . . 0.0 110.855 173.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.2 mp -81.67 -51.04 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 124.103 0.961 . . . . 0.0 110.408 173.686 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.418 HD11 ' HB2' ' A' ' 115' ' ' TYR . 44.2 mm -71.92 114.47 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 CA-C-O 121.556 0.693 . . . . 0.0 110.142 178.864 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 70.6 mmtt -83.85 -27.93 28.37 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.619 1.168 . . . . 0.0 113.045 179.595 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 21.4 p30 -153.16 81.63 5.05 Favored Pre-proline 0 CA--C 1.548 0.866 0 C-N-CA 126.09 1.756 . . . . 0.0 111.326 -170.025 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -69.17 138.11 38.86 Favored 'Trans proline' 0 CA--C 1.54 0.791 0 C-N-CA 123.498 2.799 . . . . 0.0 111.097 -179.126 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.8 tpt -154.59 141.19 18.91 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.236 1.414 . . . . 0.0 110.03 -178.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -144.68 148.14 33.87 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.397 1.479 . . . . 0.0 111.139 -177.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.6 ttp -57.19 -36.2 70.55 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.903 1.281 . . . . 0.0 113.3 -172.216 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.89 -22.82 60.54 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 125.127 1.346 . . . . 0.0 114.603 173.828 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 24.5 m -97.12 -34.59 11.09 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.846 1.258 . . . . 0.0 111.425 174.229 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 81.4 mt -53.94 -50.93 50.08 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 CA-C-N 119.31 0.959 . . . . 0.0 110.569 173.145 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -61.88 -32.5 72.87 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 178.096 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.432 ' HE3' ' HA ' ' A' ' 88' ' ' LYS . 1.1 tpmt? -68.78 -31.9 71.26 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -175.238 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 3.8 ptp180 -78.08 -26.45 48.17 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 113.941 1.089 . . . . 0.0 113.941 170.041 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 82.2 mt -70.66 -31.45 68.38 Favored 'General case' 0 N--CA 1.481 1.092 0 CA-C-N 119.648 1.113 . . . . 0.0 113.037 168.414 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -68.18 3.61 1.58 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.401 1.48 . . . . 0.0 113.476 171.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -130.74 163.18 27.85 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 127.685 2.394 . . . . 0.0 110.484 175.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -83.31 37.5 0.56 Allowed 'General case' 0 CA--C 1.55 0.966 0 O-C-N 120.834 -1.166 . . . . 0.0 111.581 169.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -60.76 -32.14 71.46 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.088 1.355 . . . . 0.0 114.32 -168.939 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -132.99 175.88 8.98 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 127.602 2.361 . . . . 0.0 111.057 178.199 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 9.7 t-105 -100.95 -25.91 13.92 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.893 1.277 . . . . 0.0 112.886 -178.824 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 34.7 t -143.77 148.64 35.91 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.287 1.035 . . . . 0.0 112.82 -170.482 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -65.36 -18.8 65.6 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 115.991 1.848 . . . . 0.0 115.991 -174.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 32.6 t -56.08 -32.48 64.16 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.398 0.999 . . . . 0.0 112.603 178.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -63.53 -45.97 88.13 Favored 'General case' 0 CA--C 1.544 0.727 0 O-C-N 121.272 -0.892 . . . . 0.0 112.264 173.499 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 48.8 t -65.28 -37.1 86.13 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.869 0.868 . . . . 0.0 112.602 174.713 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 82.5 mtp -65.65 -40.47 92.51 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.724 0.81 . . . . 0.0 111.881 175.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -62.1 -39.8 93.72 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.369 0.668 . . . . 0.0 112.076 170.667 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 85.2 m-20 -64.28 -39.58 94.23 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.366 0.985 . . . . 0.0 112.73 175.728 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -61.01 -46.98 88.54 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.5 -0.75 . . . . 0.0 112.315 170.429 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 17.5 t30 -56.63 -45.25 81.66 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.084 0.553 . . . . 0.0 111.893 174.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 52.3 m -62.51 -40.36 96.47 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.381 1.072 . . . . 0.0 112.687 175.571 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 53.1 ttp -59.52 -52.32 66.09 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 119.708 1.14 . . . . 0.0 112.061 177.32 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -68.45 -39.81 81.32 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 179.619 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 85.6 m -64.72 -47.55 77.89 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.588 0.755 . . . . 0.0 112.037 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -64.69 -31.94 73.39 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 119.024 0.829 . . . . 0.0 112.121 -179.551 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 81.3 m -61.66 -43.44 98.86 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.816 0.846 . . . . 0.0 112.794 170.261 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -68.02 -32.2 72.41 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.929 1.085 . . . . 0.0 113.929 178.66 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 92.3 mt -64.38 -57.63 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 C-N-CA 123.471 0.708 . . . . 0.0 110.994 177.21 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' TYR . . . . . 0.418 ' HB2' HD11 ' A' ' 77' ' ' ILE . 31.0 t80 -68.79 -35.94 77.65 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 114.375 1.25 . . . . 0.0 114.375 -172.301 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 64.1 m-80 -103.98 159.84 15.33 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.804 0.841 . . . . 0.0 113.164 -169.22 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 3.4 mppt? -66.0 148.44 98.34 Favored Pre-proline 0 N--CA 1.472 0.667 0 C-N-CA 124.187 0.995 . . . . 0.0 110.523 172.784 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -65.37 -7.8 16.96 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 123.563 2.842 . . . . 0.0 114.567 -177.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 69.5 p -115.53 1.79 13.69 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 126.473 1.909 . . . . 0.0 113.108 179.518 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -65.89 143.73 57.26 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 121.491 -0.756 . . . . 0.0 110.509 173.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -52.59 -45.62 66.59 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.633 -0.667 . . . . 0.0 112.526 -178.422 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 9.5 tp -56.55 -34.7 42.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 124.637 1.175 . . . . 0.0 113.885 177.91 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 55.7 t -71.49 -42.52 72.71 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 C-N-CA 123.403 0.681 . . . . 0.0 110.65 175.124 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 66.5 mt -62.37 -36.24 81.65 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.099 0.863 . . . . 0.0 111.917 175.196 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -58.11 -53.45 58.11 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 118.298 0.499 . . . . 0.0 110.919 170.597 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -59.39 -41.43 89.35 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 123.745 0.818 . . . . 0.0 112.399 179.314 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -61.16 -39.9 91.84 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.999 0.92 . . . . 0.0 113.12 175.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -79.13 -31.57 44.17 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 85.1 mt -71.02 -46.4 62.2 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.351 0.66 . . . . 0.0 111.297 170.053 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -63.31 -38.04 89.6 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 121.102 -0.999 . . . . 0.0 113.244 -173.694 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 4.9 ptpp? -60.14 -39.36 86.06 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 121.456 -0.778 . . . . 0.0 112.543 175.136 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 78.4 mt -73.18 -41.2 58.53 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 C-N-CA 124.193 0.997 . . . . 0.0 111.518 175.121 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -50.96 -52.14 45.51 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 119.162 0.892 . . . . 0.0 110.438 172.649 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.3 mt -63.63 -40.1 96.03 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 118.558 -0.734 . . . . 0.0 112.909 177.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -68.43 -30.56 69.48 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 120.373 1.442 . . . . 0.0 112.657 179.45 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 69.0 mmtt -75.94 -48.19 22.19 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 117.89 -1.052 . . . . 0.0 112.301 176.122 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.9 m -67.84 -25.79 33.33 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 CA-C-N 120.765 1.62 . . . . 0.0 112.04 176.398 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -62.19 -30.53 71.13 Favored 'General case' 0 CA--C 1.541 0.609 0 O-C-N 121.492 -0.755 . . . . 0.0 112.477 171.811 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -91.29 -3.26 57.02 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.062 1.345 . . . . 0.0 112.913 176.606 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 5.9 ttm -57.0 141.2 76.5 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 124.152 0.981 . . . . 0.0 111.271 171.449 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -63.05 144.23 92.31 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 C-N-CA 122.494 2.129 . . . . 0.0 109.911 168.798 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -74.87 -23.46 58.4 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 114.239 1.199 . . . . 0.0 114.239 -179.115 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -100.04 155.25 17.82 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.636 1.574 . . . . 0.0 113.024 -169.755 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -112.79 137.1 51.62 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.962 1.705 . . . . 0.0 111.229 -174.799 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 12.7 p -146.62 141.18 20.69 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 C-N-CA 124.657 1.183 . . . . 0.0 110.735 172.623 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -68.52 134.71 50.47 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.509 1.124 . . . . 0.0 111.074 175.307 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 96.0 mt -69.74 138.81 53.13 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 -175.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 4.5 pp -64.04 153.46 84.93 Favored Pre-proline 0 CA--C 1.55 0.965 0 C-N-CA 124.72 1.208 . . . . 0.0 112.059 169.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -75.08 149.68 36.74 Favored 'Trans proline' 0 CA--C 1.543 0.968 0 C-N-CA 123.064 2.51 . . . . 0.0 111.824 -178.715 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -70.63 157.84 57.53 Favored 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 123.116 2.544 . . . . 0.0 112.091 179.408 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -66.72 149.88 97.96 Favored Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 123.283 0.633 . . . . 0.0 111.496 171.226 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -68.21 155.19 70.31 Favored 'Trans proline' 0 CA--C 1.54 0.809 0 C-N-CA 122.651 2.234 . . . . 0.0 111.608 176.269 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -116.24 34.3 5.08 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 125.632 1.573 . . . . 0.0 111.974 -175.54 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . -65.05 173.43 18.73 Favored Glycine 0 CA--C 1.538 1.472 0 C-N-CA 125.597 1.57 . . . . 0.0 114.275 176.196 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.252 1.22 0 C-N-CA 126.252 1.821 . . . . 0.0 111.325 -174.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.421 0 N-CA-C 111.851 -0.5 . . . . 0.0 111.851 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 83.7 p -153.53 171.69 18.34 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.075 1.35 . . . . 0.0 112.32 -178.801 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 45.9 m -157.76 146.81 19.6 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.795 1.638 . . . . 0.0 110.495 171.416 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 158.04 -161.47 31.56 Favored Glycine 0 CA--C 1.53 1.0 0 C-N-CA 124.889 1.233 . . . . 0.0 112.378 -174.413 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 34.4 m -154.22 147.72 25.11 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.635 1.174 . . . . 0.0 111.359 170.25 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 68.2 m -139.84 19.84 2.49 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 126.101 1.761 . . . . 0.0 112.183 177.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -168.93 57.92 0.2 Allowed Glycine 0 CA--C 1.529 0.916 0 C-N-CA 125.7 1.619 . . . . 0.0 111.341 -171.341 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.7 pm0 -53.33 162.41 0.76 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.393 1.877 . . . . 0.0 114.926 177.14 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 32.2 m -128.16 -16.84 2.47 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.238 0 C-N-CA 124.494 1.117 . . . . 0.0 113.705 -179.525 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 62.5 p -139.48 167.05 22.96 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 126.61 1.964 . . . . 0.0 111.204 -175.791 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 14.5 p30 -139.66 154.3 71.03 Favored Pre-proline 0 CA--C 1.545 0.759 0 C-N-CA 124.483 1.113 . . . . 0.0 112.543 -171.3 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -77.09 -42.3 0.31 Allowed 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 123.339 2.692 . . . . 0.0 112.177 169.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.1 m -153.18 90.93 1.47 Allowed 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.678 1.591 . . . . 0.0 111.792 -173.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 62.3 tttp -152.11 134.58 8.78 Favored Pre-proline 0 N--CA 1.477 0.887 0 C-N-CA 126.09 1.756 . . . . 0.0 109.847 173.259 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -71.07 148.52 56.78 Favored 'Trans proline' 0 CA--C 1.536 0.607 0 C-N-CA 122.519 2.146 . . . . 0.0 112.531 -178.408 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 168.81 158.12 12.36 Favored Glycine 0 CA--C 1.531 1.038 0 C-N-CA 123.991 0.805 . . . . 0.0 114.474 177.213 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 -162.9 163.55 26.3 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 127.65 2.38 . . . . 0.0 109.586 170.099 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.8 ttmm -73.0 142.57 47.74 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 122.907 0.483 . . . . 0.0 111.634 177.462 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 82.6 p -138.7 165.16 27.68 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.935 1.694 . . . . 0.0 109.51 -179.765 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 22.2 t30 -51.36 -31.43 22.11 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 114.168 1.173 . . . . 0.0 114.168 174.564 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 69.3 mt-30 -74.84 -48.79 23.23 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.166 -0.959 . . . . 0.0 112.791 174.343 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 89.1 mt -61.95 -31.43 71.77 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 120.331 1.423 . . . . 0.0 112.479 173.881 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.5 tp60 -60.8 -52.67 64.09 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.107 0.963 . . . . 0.0 110.906 170.462 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 83.5 t80 -55.83 -41.95 75.02 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.088 0.955 . . . . 0.0 112.446 176.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 87.9 mmm -55.21 -53.99 49.0 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 122.685 0.394 . . . . 0.0 111.267 172.066 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -70.67 -22.93 62.43 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 114.833 1.42 . . . . 0.0 114.833 -178.26 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 18.8 m-80 -108.04 -17.23 14.09 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 115.074 1.509 . . . . 0.0 115.074 -168.467 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.6 t -138.83 -41.08 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 CA-C-N 119.078 0.854 . . . . 0.0 112.036 -176.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 11.9 t -71.62 -69.96 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 176.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 69.5 t -58.36 -48.63 84.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 126.138 1.775 . . . . 0.0 111.495 177.728 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 70.2 tttt -56.54 -43.43 79.86 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.491 0.716 . . . . 0.0 112.884 -171.223 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 60.4 m -85.28 -34.93 21.81 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.327 0.651 . . . . 0.0 112.455 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 68.6 mt -59.65 -32.85 70.83 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 119.629 1.104 . . . . 0.0 111.712 169.175 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 29.3 t-105 -73.14 -34.41 66.07 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 126.048 1.739 . . . . 0.0 113.162 175.068 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp -76.03 -11.17 59.9 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.554 1.142 . . . . 0.0 113.982 174.643 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 55.7 t-80 -61.23 150.83 33.36 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.168 1.387 . . . . 0.0 113.181 -178.188 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -60.37 -20.94 61.41 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.014 1.326 . . . . 0.0 113.727 178.357 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -116.06 16.81 16.01 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.535 1.534 . . . . 0.0 113.643 -178.674 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.67 -29.85 65.06 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 113.979 1.103 . . . . 0.0 113.979 177.745 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 68.1 p-90 -57.67 -34.05 22.65 Favored Pre-proline 0 CA--C 1.548 0.9 0 N-CA-C 118.019 2.6 . . . . 0.0 118.019 -170.334 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -75.51 -4.78 15.75 Favored 'Trans proline' 0 CA--C 1.543 0.966 0 CA-C-N 123.598 2.321 . . . . 0.0 113.408 174.739 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -108.16 -4.52 17.59 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.38 1.472 . . . . 0.0 112.968 178.195 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.7 m-30 -64.47 -17.89 64.27 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 114.011 1.115 . . . . 0.0 114.011 179.238 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 7.7 mp0 -139.36 155.06 72.31 Favored Pre-proline 0 CA--C 1.544 0.747 0 C-N-CA 125.726 1.611 . . . . 0.0 110.203 -176.612 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -65.68 141.56 66.77 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 122.252 1.968 . . . . 0.0 111.888 174.434 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 50.7 t -56.93 145.54 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 124.561 1.144 . . . . 0.0 111.627 172.615 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -121.64 120.57 35.13 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 124.55 1.14 . . . . 0.0 110.049 169.708 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.55 -31.28 70.39 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 123.2 0.6 . . . . 0.0 112.59 178.239 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 81.8 mt -67.37 -49.69 69.38 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 C-N-CA 124.525 1.13 . . . . 0.0 110.923 173.552 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm -64.34 -39.35 93.72 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.219 1.408 . . . . 0.0 113.445 -176.296 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.4 mp -90.93 0.57 57.48 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.249 1.02 . . . . 0.0 113.058 177.233 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 65.9 t30 54.18 53.91 10.33 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 126.001 1.721 . . . . 0.0 113.636 -179.282 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 52.6 mt -111.51 95.31 26.39 Favored Pre-proline 0 CA--C 1.546 0.797 0 C-N-CA 126.415 1.886 . . . . 0.0 110.212 -174.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -68.92 -8.37 23.33 Favored 'Trans proline' 0 CA--C 1.544 1.022 0 C-N-CA 123.455 2.77 . . . . 0.0 114.632 -174.001 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -138.41 21.39 2.75 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 125.569 1.548 . . . . 0.0 112.881 -174.76 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 47.5 t80 -50.61 -55.13 17.73 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 120.44 -1.413 . . . . 0.0 113.484 -174.367 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -76.7 -10.56 59.47 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.692 1.197 . . . . 0.0 114.208 -179.154 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.3 mmmm -72.93 -44.33 61.32 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.404 1.082 . . . . 0.0 110.117 176.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.4 mp -81.41 -52.4 13.97 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 123.963 0.905 . . . . 0.0 110.075 172.542 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 20.5 mm -81.43 104.89 10.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 CA-C-O 122.183 0.992 . . . . 0.0 111.629 -176.715 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 69.8 mmtt -69.7 -35.09 74.78 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.856 1.662 . . . . 0.0 113.603 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 70.5 m-80 -143.1 94.34 6.35 Favored Pre-proline 0 CA--C 1.545 0.776 0 C-N-CA 125.79 1.636 . . . . 0.0 110.013 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -70.67 149.21 60.71 Favored 'Trans proline' 0 CA--C 1.538 0.721 0 C-N-CA 123.141 2.561 . . . . 0.0 111.103 178.161 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -153.93 136.06 14.77 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.434 1.094 . . . . 0.0 110.182 -174.596 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -143.82 148.98 36.32 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.56 1.944 . . . . 0.0 110.815 177.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.6 ttp -57.94 -34.31 69.76 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.797 1.239 . . . . 0.0 113.043 -171.469 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -56.87 -27.6 56.53 Favored Glycine 0 CA--C 1.532 1.145 0 C-N-CA 125.375 1.464 . . . . 0.0 114.394 173.801 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 43.7 m -78.38 -45.92 21.23 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 118.032 0.916 . . . . 0.0 110.878 169.681 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.9 mt -55.82 -53.76 34.01 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 C-N-CA 125.076 1.35 . . . . 0.0 111.754 -175.142 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 4.8 ptpt -54.15 -38.2 65.26 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 174.069 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.548 ' HA ' ' HE2' ' A' ' 88' ' ' LYS . 0.2 OUTLIER -71.03 -39.31 72.41 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.156 0.982 . . . . 0.0 113.179 -176.996 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 12.4 ptp180 -72.43 -32.34 66.23 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 113.683 0.994 . . . . 0.0 113.683 172.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 53.2 mt -61.19 -43.54 98.71 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.416 0.686 . . . . 0.0 112.821 169.158 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -59.63 -39.37 84.1 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 -176.138 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -108.55 17.21 22.26 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 -171.23 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 27.1 m-20 54.79 59.72 3.92 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.467 1.907 . . . . 0.0 114.159 174.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 76.6 t80 -63.55 -20.5 65.69 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.401 1.08 . . . . 0.0 113.588 178.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -145.06 177.48 8.74 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 129.483 3.113 . . . . 0.0 110.768 -173.62 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.7 t-105 -104.47 -27.5 11.88 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.264 1.026 . . . . 0.0 112.843 174.818 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 20.2 m -126.15 138.62 53.68 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.078 0.951 . . . . 0.0 113.273 -168.627 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -65.52 -19.74 66.05 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 115.939 1.829 . . . . 0.0 115.939 -175.312 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 16.8 m -56.55 -28.0 59.05 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.179 0.9 . . . . 0.0 112.826 173.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 56.5 mm-40 -70.35 -43.72 69.61 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.629 0.771 . . . . 0.0 112.03 173.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 42.8 t -62.51 -36.41 82.46 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 121.437 -0.789 . . . . 0.0 112.46 172.816 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 79.0 mtp -63.64 -40.04 95.87 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 121.392 -0.818 . . . . 0.0 112.36 175.099 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.06 -32.01 73.28 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.262 0.625 . . . . 0.0 112.144 174.923 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -72.85 -42.45 63.71 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.505 0.722 . . . . 0.0 111.554 178.087 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 -59.49 -46.28 89.26 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 118.546 0.612 . . . . 0.0 112.148 169.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 24.5 t30 -56.84 -44.51 82.17 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.02 0.528 . . . . 0.0 112.054 174.221 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 36.8 m -66.54 -36.41 82.6 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.852 0.861 . . . . 0.0 112.265 178.174 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 48.5 ttp -61.62 -55.47 30.25 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.27 -0.894 . . . . 0.0 112.083 174.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -65.72 -38.66 89.79 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 122.039 -0.413 . . . . 0.0 111.845 -179.744 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 91.8 m -66.0 -46.3 78.47 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 121.572 -0.705 . . . . 0.0 112.46 178.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.1 p30 -63.79 -31.64 72.88 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 120.117 1.326 . . . . 0.0 112.315 178.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 33.4 m -59.78 -47.51 85.39 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 118.917 -0.563 . . . . 0.0 112.047 169.089 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -68.51 -31.06 70.04 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 114.048 1.129 . . . . 0.0 114.048 179.463 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 88.2 mt -67.78 -59.3 3.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 123.304 0.642 . . . . 0.0 110.607 175.195 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 32.2 t80 -71.79 -35.15 69.9 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 114.023 1.119 . . . . 0.0 114.023 -171.516 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -105.8 155.09 19.64 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.334 1.053 . . . . 0.0 111.64 -172.308 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -72.91 154.04 91.0 Favored Pre-proline 0 N--CA 1.471 0.609 0 C-N-CA 124.304 1.041 . . . . 0.0 110.429 178.215 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -64.78 -0.82 3.45 Favored 'Trans proline' 0 CA--C 1.545 1.05 0 C-N-CA 123.748 2.965 . . . . 0.0 114.883 -179.6 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 64.5 p -116.31 -2.58 12.08 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 126.999 2.12 . . . . 0.0 113.134 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 62.4 m-20 -71.51 143.21 50.06 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 119.08 0.854 . . . . 0.0 110.449 171.342 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -56.05 -47.34 78.09 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 121.538 -0.726 . . . . 0.0 112.373 -175.821 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.5 tp -52.34 -30.91 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 125.201 1.4 . . . . 0.0 114.332 177.029 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 52.4 t -74.05 -47.19 43.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 O-C-N 121.569 -0.707 . . . . 0.0 110.809 174.581 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 76.1 mt -61.48 -37.35 83.32 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 119.237 0.926 . . . . 0.0 111.66 177.105 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 7.8 mtp -60.13 -50.77 72.36 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.506 1.523 . . . . 0.0 111.999 170.136 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.91 -39.68 90.27 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.55 0.74 . . . . 0.0 112.824 175.767 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 88.9 mt-30 -60.83 -48.53 81.4 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 119.413 1.006 . . . . 0.0 111.823 173.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -61.19 -42.64 98.94 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.512 0.725 . . . . 0.0 112.671 178.428 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 86.7 mt -66.02 -45.84 80.04 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.607 0.763 . . . . 0.0 112.067 173.381 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -64.43 -39.65 94.24 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 121.054 -1.028 . . . . 0.0 112.621 -176.367 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 5.2 mtpm? -56.3 -36.98 69.27 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 121.529 -0.732 . . . . 0.0 112.041 175.038 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 68.4 mt -75.24 -46.65 38.15 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 123.627 0.771 . . . . 0.0 111.073 173.764 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 43.9 t80 -49.25 -48.22 45.92 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 119.933 1.242 . . . . 0.0 111.771 174.768 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.3 mt -65.43 -38.89 91.25 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.32 -0.862 . . . . 0.0 113.046 178.13 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -67.6 -29.37 68.69 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 119.97 1.259 . . . . 0.0 112.376 176.699 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 28.7 mmtp -75.53 -49.98 17.05 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.25 1.42 . . . . 0.0 112.577 178.624 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 7.1 m -69.84 -25.41 28.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 119.289 0.949 . . . . 0.0 111.736 178.163 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -61.65 -29.81 70.31 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.665 -0.647 . . . . 0.0 112.453 170.157 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -96.96 1.26 50.14 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.595 1.558 . . . . 0.0 112.626 177.268 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 8.4 ttm -54.13 139.67 54.51 Favored Pre-proline 0 CA--C 1.544 0.725 0 C-N-CA 124.271 1.028 . . . . 0.0 111.306 172.226 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -66.51 117.95 5.14 Favored 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 122.463 2.109 . . . . 0.0 108.568 169.159 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 -65.64 -28.49 69.15 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 -173.044 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -83.75 164.4 19.61 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.135 1.774 . . . . 0.0 111.953 172.138 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -132.24 143.22 49.77 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.111 0.964 . . . . 0.0 111.731 -175.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 55.0 t -130.69 133.29 63.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 125.504 1.521 . . . . 0.0 110.371 -176.243 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -68.07 117.05 9.41 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.68 1.592 . . . . 0.0 111.221 170.59 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 80.6 mt -71.23 144.87 49.93 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 113.245 0.831 . . . . 0.0 113.245 -178.32 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 93.3 mt -76.99 155.17 82.84 Favored Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 124.596 1.158 . . . . 0.0 111.191 169.269 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -73.9 155.68 48.27 Favored 'Trans proline' 0 CA--C 1.547 1.144 0 C-N-CA 122.991 2.46 . . . . 0.0 112.503 178.616 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -73.53 163.26 38.0 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 123.712 2.941 . . . . 0.0 112.589 176.003 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -65.33 152.56 91.71 Favored Pre-proline 0 CA--C 1.553 1.066 0 C-N-CA 124.0 0.92 . . . . 0.0 112.485 172.081 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -70.82 161.56 45.66 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 123.341 2.694 . . . . 0.0 112.628 176.006 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 3.1 mptp? -70.73 164.04 25.92 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.861 1.264 . . . . 0.0 111.905 176.014 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . -143.33 22.67 2.23 Favored Glycine 0 CA--C 1.536 1.404 0 C-N-CA 125.027 1.299 . . . . 0.0 114.913 -176.31 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 62.4 tttp . . . . . 0 C--O 1.254 1.304 0 C-N-CA 126.367 1.867 . . . . 0.0 111.311 178.967 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.395 0 N-CA-C 111.617 -0.593 . . . . 0.0 111.617 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 58.7 p -60.51 -15.86 31.34 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 115.395 1.628 . . . . 0.0 115.395 -176.856 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 17.8 m -60.27 -24.17 64.7 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 125.436 1.494 . . . . 0.0 114.026 173.483 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 66.93 18.87 69.18 Favored Glycine 0 CA--C 1.538 1.529 0 C-N-CA 124.382 0.992 . . . . 0.0 114.762 -178.797 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 16.8 m -60.55 152.97 24.69 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.676 1.59 . . . . 0.0 113.153 -177.152 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.5 t -63.12 151.68 39.42 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.529 0.732 . . . . 0.0 112.172 174.075 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -169.83 35.58 0.18 Allowed Glycine 0 CA--C 1.534 1.238 0 C-N-CA 124.635 1.112 . . . . 0.0 113.556 -175.751 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -62.34 166.56 4.92 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 114.387 1.254 . . . . 0.0 114.387 178.822 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 30.8 m -138.26 -23.37 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.243 0 C-N-CA 125.198 1.399 . . . . 0.0 113.996 172.211 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.9 m -148.75 149.83 32.08 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 126.497 1.919 . . . . 0.0 111.411 171.752 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 22.2 m120 -148.62 135.67 10.57 Favored Pre-proline 0 CA--C 1.545 0.784 0 C-N-CA 126.092 1.757 . . . . 0.0 109.412 174.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -75.16 -19.93 17.04 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 123.367 2.711 . . . . 0.0 113.906 -178.206 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.8 t -72.45 -38.67 68.22 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.018 0.927 . . . . 0.0 113.212 -177.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt -75.27 143.28 76.42 Favored Pre-proline 0 N--CA 1.476 0.874 0 C-N-CA 123.611 0.765 . . . . 0.0 111.574 175.616 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -73.32 155.07 51.44 Favored 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 122.666 2.244 . . . . 0.0 111.281 169.783 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -178.09 158.71 23.79 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 123.893 0.759 . . . . 0.0 113.24 175.598 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 37.8 ptt180 -159.17 160.47 35.53 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.91 1.684 . . . . 0.0 110.982 175.576 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 22.5 ptmt -70.87 132.85 45.89 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.584 0.753 . . . . 0.0 110.837 169.408 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 77.4 p -140.62 161.59 37.39 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 125.076 1.35 . . . . 0.0 111.38 -177.087 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 26.5 p-10 -48.99 -38.94 24.71 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 114.066 1.135 . . . . 0.0 114.066 170.649 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -69.7 -51.22 36.39 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.65 0.78 . . . . 0.0 111.557 178.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.5 mt -65.73 -30.18 70.81 Favored 'General case' 0 CA--C 1.54 0.582 0 O-C-N 121.652 -0.655 . . . . 0.0 112.36 177.423 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 44.7 tt0 -60.8 -52.54 64.66 Favored 'General case' 0 C--O 1.224 -0.268 0 C-N-CA 123.427 0.691 . . . . 0.0 110.237 169.056 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -56.25 -42.18 76.96 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 118.836 0.744 . . . . 0.0 112.15 179.14 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 96.5 mmm -55.98 -50.71 70.06 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 172.684 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -84.44 -11.5 56.09 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -174.43 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 66.6 t30 -117.19 -18.86 9.88 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.55 1.54 . . . . 0.0 112.872 -170.277 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 6.0 t -133.6 -49.67 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 C-N-CA 123.606 0.762 . . . . 0.0 111.869 -177.62 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 22.3 t -69.28 -64.22 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 CA-C-N 119.095 0.861 . . . . 0.0 110.794 -176.76 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 45.0 t -53.83 -50.07 54.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 124.864 1.265 . . . . 0.0 109.841 171.402 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.3 tppt? -60.74 -26.35 67.13 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 -174.095 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 21.0 m -98.66 -39.65 8.57 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-N 118.948 0.795 . . . . 0.0 112.429 177.236 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 80.7 mt -59.0 -30.14 67.77 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.485 -0.759 . . . . 0.0 112.121 171.816 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' TRP . . . . . 0.429 ' CE3' ' HD3' ' A' ' 87' ' ' LYS . 27.5 t-105 -75.56 -39.22 58.47 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 114.826 1.417 . . . . 0.0 114.826 179.061 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 8.9 ptpp? -76.62 -10.42 59.38 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 177.116 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 60.3 t-80 -54.74 152.5 7.03 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.073 1.749 . . . . 0.0 113.456 -178.79 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 58.9 mt-30 -54.37 -25.57 25.11 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.813 1.645 . . . . 0.0 114.437 177.671 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -125.19 18.62 8.33 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.041 1.337 . . . . 0.0 113.705 -172.783 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.13 -24.85 63.25 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.391 1.476 . . . . 0.0 114.177 176.17 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 64.6 p-90 -58.14 -33.42 17.74 Favored Pre-proline 0 CA--C 1.547 0.851 0 N-CA-C 117.592 2.441 . . . . 0.0 117.592 -170.356 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -81.27 2.29 8.68 Favored 'Trans proline' 0 CA--C 1.547 1.133 0 CA-C-N 123.041 2.122 . . . . 0.0 113.237 175.643 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -113.38 -5.29 13.55 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.493 1.517 . . . . 0.0 113.572 178.858 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 23.4 m-30 -64.19 -17.99 64.06 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 119.848 1.204 . . . . 0.0 113.952 177.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -144.03 158.31 55.8 Favored Pre-proline 0 CA--C 1.546 0.819 0 C-N-CA 126.55 1.94 . . . . 0.0 110.625 -176.504 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -67.48 159.5 52.18 Favored 'Trans proline' 0 CA--C 1.537 0.635 0 C-N-CA 123.061 2.507 . . . . 0.0 112.476 172.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 60.1 t -70.86 107.08 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 123.85 0.86 . . . . 0.0 109.458 170.066 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 -72.39 79.95 1.03 Allowed 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.282 1.033 . . . . 0.0 110.517 169.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -51.16 -27.72 9.35 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.917 1.287 . . . . 0.0 114.348 -177.731 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 85.2 mt -64.0 -48.38 86.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 125.592 1.557 . . . . 0.0 111.566 172.136 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -75.96 -39.83 55.23 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.57 1.548 . . . . 0.0 112.899 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -74.74 -9.65 58.77 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.874 1.67 . . . . 0.0 113.094 176.085 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 57.75 55.0 5.77 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.426 1.891 . . . . 0.0 112.527 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 55.8 mt -116.1 78.96 8.07 Favored Pre-proline 0 CA--C 1.543 0.706 0 C-N-CA 126.241 1.816 . . . . 0.0 110.703 -178.444 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -66.87 -16.67 50.56 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 123.302 2.668 . . . . 0.0 112.999 -179.166 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 -100.96 7.54 43.5 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.903 1.681 . . . . 0.0 113.103 175.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 79.0 t80 -52.75 -56.48 15.34 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 120.462 -1.399 . . . . 0.0 112.398 -176.506 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -74.07 -15.08 61.08 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.776 1.23 . . . . 0.0 114.128 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 9.9 mptt -69.92 -31.88 69.88 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.042 0.937 . . . . 0.0 111.592 177.251 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.4 mp -102.05 -45.2 10.81 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 125.688 1.595 . . . . 0.0 111.27 176.077 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.599 HD11 ' HB2' ' A' ' 115' ' ' TYR . 34.4 mm -76.42 101.68 2.86 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 121.929 0.871 . . . . 0.0 111.151 179.006 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.68 -40.72 95.89 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.747 1.619 . . . . 0.0 112.983 172.026 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -144.22 98.77 5.05 Favored Pre-proline 0 CA--C 1.545 0.766 0 C-N-CA 125.347 1.459 . . . . 0.0 110.575 -176.362 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -74.49 147.31 36.16 Favored 'Trans proline' 0 CA--C 1.539 0.773 0 C-N-CA 123.206 2.604 . . . . 0.0 111.083 175.361 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.3 tpt -155.68 148.26 23.98 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.832 1.253 . . . . 0.0 110.557 178.785 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -147.46 154.45 40.81 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 125.686 1.595 . . . . 0.0 111.368 179.679 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.5 ttp -62.03 -36.96 83.14 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 123.856 0.862 . . . . 0.0 112.563 -171.628 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -56.11 -49.11 69.5 Favored Glycine 0 CA--C 1.532 1.142 0 C-N-CA 124.242 0.925 . . . . 0.0 112.615 177.198 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 85.2 m -69.67 -33.71 72.96 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 117.661 -1.161 . . . . 0.0 112.648 174.7 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 97.7 mt -56.56 -49.54 77.2 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 CA-C-N 120.663 1.574 . . . . 0.0 110.826 172.47 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.429 ' HD3' ' CE3' ' A' ' 51' ' ' TRP . 0.4 OUTLIER -60.35 -35.36 75.5 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 118.698 0.681 . . . . 0.0 112.511 174.941 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.452 ' HE3' ' HA ' ' A' ' 88' ' ' LYS . 1.4 tpmt? -65.73 -41.9 91.69 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 -179.874 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 13.3 ptp180 -67.68 -24.08 65.38 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 173.265 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 74.8 mt -75.66 -39.06 58.24 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 167.724 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -63.05 -27.26 69.28 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 114.845 1.424 . . . . 0.0 114.845 -176.631 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -137.04 136.28 38.27 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.907 1.683 . . . . 0.0 110.642 -179.312 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 -51.99 134.4 32.0 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.227 1.411 . . . . 0.0 113.81 -169.453 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 44.1 t80 -155.54 -34.48 0.09 Allowed 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.588 1.555 . . . . 0.0 112.981 179.109 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -134.86 176.79 8.33 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.234 1.414 . . . . 0.0 112.045 179.127 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 12.0 t-105 -115.16 -21.1 10.13 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.114 1.365 . . . . 0.0 113.31 -169.693 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 44.3 t -144.63 151.53 39.14 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 125.489 1.516 . . . . 0.0 111.207 -178.838 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -58.56 -22.55 56.13 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 115.572 1.693 . . . . 0.0 115.572 -177.79 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 39.5 m -54.8 -31.52 59.11 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 -179.044 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -68.87 -46.07 69.37 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 121.374 -0.829 . . . . 0.0 112.17 173.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 46.4 t -63.75 -36.34 83.54 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.515 1.126 . . . . 0.0 112.354 177.433 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 81.6 mtp -58.67 -40.56 83.89 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 123.93 0.892 . . . . 0.0 112.535 174.007 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -66.68 -32.57 73.98 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 174.314 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 -69.36 -39.29 78.17 Favored 'General case' 0 CA--C 1.541 0.634 0 O-C-N 120.98 -1.075 . . . . 0.0 111.759 173.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -60.35 -47.13 87.36 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.446 -0.784 . . . . 0.0 112.145 169.442 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -60.19 -41.08 92.16 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 121.665 -0.647 . . . . 0.0 111.429 175.4 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 86.0 m -62.31 -40.14 95.35 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.764 0.826 . . . . 0.0 111.756 177.662 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 48.0 ttp -59.64 -50.75 72.67 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.481 0.713 . . . . 0.0 112.305 175.431 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -71.08 -41.67 70.38 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -179.532 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 41.7 m -64.97 -46.75 80.17 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 121.358 -0.839 . . . . 0.0 112.09 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -63.23 -32.83 74.33 Favored 'General case' 0 CA--C 1.547 0.854 0 CA-C-N 119.585 1.084 . . . . 0.0 112.004 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 67.4 m -61.06 -43.23 99.2 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.904 0.882 . . . . 0.0 113.136 170.21 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 17.9 m-85 -67.52 -31.91 72.35 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 177.584 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 87.3 mt -68.18 -56.06 14.11 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.825 0 C-N-CA 123.266 0.626 . . . . 0.0 110.785 177.622 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' TYR . . . . . 0.599 ' HB2' HD11 ' A' ' 77' ' ' ILE . 34.5 t80 -69.41 -36.79 77.06 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 114.389 1.255 . . . . 0.0 114.389 -172.296 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 60.1 m-80 -101.01 158.71 15.8 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.245 1.018 . . . . 0.0 111.872 -172.612 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 3.7 mptp? -70.35 151.07 95.81 Favored Pre-proline 0 N--CA 1.47 0.568 0 C-N-CA 123.822 0.849 . . . . 0.0 109.671 174.517 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -65.45 -1.03 4.14 Favored 'Trans proline' 0 CA--C 1.546 1.076 0 C-N-CA 123.714 2.943 . . . . 0.0 114.725 -179.183 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 52.6 p -119.96 -2.19 10.32 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 127.266 2.226 . . . . 0.0 113.207 -179.431 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -67.44 145.54 54.91 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 118.837 0.744 . . . . 0.0 110.545 169.64 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -58.01 -40.89 81.93 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 121.561 -0.712 . . . . 0.0 112.386 -173.766 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 9.9 tp -55.59 -35.73 39.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 125.517 1.527 . . . . 0.0 113.877 178.823 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 46.4 t -67.35 -44.79 86.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 123.216 0.606 . . . . 0.0 110.456 174.825 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 53.0 mt -62.66 -36.17 82.0 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 118.588 0.631 . . . . 0.0 111.774 177.539 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 1.1 mmt -58.93 -52.16 66.94 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 122.765 0.426 . . . . 0.0 111.27 170.764 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -62.06 -38.82 90.21 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.459 0.703 . . . . 0.0 112.307 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -60.17 -47.48 85.75 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 119.227 0.921 . . . . 0.0 112.2 173.639 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -63.83 -44.56 92.84 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.437 0.695 . . . . 0.0 112.617 178.081 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 92.5 mt -65.91 -44.86 83.96 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.927 0.891 . . . . 0.0 112.135 176.541 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -63.26 -39.17 93.84 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 119.374 0.988 . . . . 0.0 112.615 -176.71 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -58.82 -40.86 85.39 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 121.381 -0.824 . . . . 0.0 112.107 175.065 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 85.0 mt -72.7 -41.78 62.29 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 123.624 0.77 . . . . 0.0 111.209 175.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -51.96 -51.39 57.42 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.891 0.768 . . . . 0.0 110.68 173.354 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 99.0 mt -62.58 -40.89 98.3 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.327 0.651 . . . . 0.0 112.665 177.841 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.73 -35.38 80.87 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 119.634 1.106 . . . . 0.0 112.729 176.498 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 71.0 mmtt -70.47 -52.87 19.0 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.748 1.219 . . . . 0.0 111.885 177.209 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 6.4 m -66.53 -24.12 32.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 CA-C-N 120.09 1.314 . . . . 0.0 112.313 179.211 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -64.79 -35.11 80.05 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.769 -0.582 . . . . 0.0 112.364 170.526 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -81.8 -16.72 50.01 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.372 1.069 . . . . 0.0 112.904 173.027 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 49.3 ttp -63.68 137.73 97.18 Favored Pre-proline 0 CA--C 1.546 0.818 0 CA-C-N 119.266 0.939 . . . . 0.0 110.937 174.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -68.48 136.23 35.98 Favored 'Trans proline' 0 CA--C 1.536 0.605 0 C-N-CA 122.786 2.324 . . . . 0.0 111.73 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -74.6 -22.95 58.68 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.216 1.006 . . . . 0.0 112.797 175.53 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -77.16 156.37 31.65 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.251 1.42 . . . . 0.0 111.783 173.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -126.58 135.78 51.69 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.377 1.471 . . . . 0.0 110.795 -174.723 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 12.7 p -148.22 140.32 18.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 C-N-CA 124.668 1.187 . . . . 0.0 110.946 174.387 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -70.15 132.32 45.62 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.5 1.12 . . . . 0.0 111.045 174.383 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 77.6 mt -72.57 158.15 36.23 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 -175.765 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 4.5 pp -61.79 153.93 69.46 Favored Pre-proline 0 CA--C 1.552 1.025 0 C-N-CA 124.882 1.273 . . . . 0.0 112.331 169.465 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -76.15 149.97 32.81 Favored 'Trans proline' 0 CA--C 1.545 1.04 0 C-N-CA 123.202 2.601 . . . . 0.0 112.252 -177.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -72.61 160.67 45.98 Favored 'Trans proline' 0 CA--C 1.539 0.765 0 C-N-CA 123.354 2.702 . . . . 0.0 112.497 178.651 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -64.62 150.31 94.17 Favored Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 123.657 0.783 . . . . 0.0 111.785 170.333 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -69.97 115.02 3.93 Favored 'Trans proline' 0 CA--C 1.54 0.777 0 C-N-CA 123.248 2.632 . . . . 0.0 111.62 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 8.3 mtpm? -81.61 -2.98 52.15 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 125.081 1.352 . . . . 0.0 113.756 177.422 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . -167.92 -112.19 0.26 Allowed Glycine 0 CA--C 1.533 1.181 0 C-N-CA 125.751 1.643 . . . . 0.0 111.353 -179.525 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 22.9 ptmt . . . . . 0 C--O 1.252 1.228 0 C-N-CA 124.949 1.3 . . . . 0.0 113.851 172.562 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.416 0 N-CA-C 111.11 -0.796 . . . . 0.0 111.11 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 75.5 p -68.58 166.25 17.5 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.801 1.24 . . . . 0.0 113.282 174.666 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 79.4 p -139.55 -4.67 1.42 Allowed 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 115.378 1.621 . . . . 0.0 115.378 -177.796 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 178.46 34.13 0.06 OUTLIER Glycine 0 CA--C 1.535 1.327 0 O-C-N 121.255 -0.903 . . . . 0.0 114.845 -178.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 20.1 t -69.99 -31.67 69.48 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.233 1.013 . . . . 0.0 113.504 -175.889 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 66.0 p -74.46 159.95 31.6 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.923 1.289 . . . . 0.0 113.577 -179.801 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -94.64 88.36 1.14 Allowed Glycine 0 CA--C 1.531 1.072 0 C-N-CA 125.523 1.535 . . . . 0.0 111.891 178.598 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -58.14 154.25 13.33 Favored 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 113.803 1.038 . . . . 0.0 113.803 174.461 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 32.6 m -134.97 -9.96 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.466 0 C-N-CA 124.971 1.309 . . . . 0.0 114.414 -169.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 55.4 p -152.18 117.05 5.13 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 125.852 1.661 . . . . 0.0 110.036 -178.338 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 60.5 t-20 -149.35 114.68 3.58 Favored Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 124.193 0.997 . . . . 0.0 110.636 -174.351 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -72.7 -12.21 26.51 Favored 'Trans proline' 0 CA--C 1.542 0.896 0 C-N-CA 123.813 3.009 . . . . 0.0 113.973 -177.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.1 m -81.11 -5.5 57.73 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.147 0.979 . . . . 0.0 113.639 177.27 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -110.7 140.38 22.56 Favored Pre-proline 0 N--CA 1.472 0.669 0 C-N-CA 125.297 1.439 . . . . 0.0 111.395 -178.402 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -73.01 150.54 48.74 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.592 2.195 . . . . 0.0 111.487 173.738 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 163.71 168.49 25.8 Favored Glycine 0 CA--C 1.528 0.85 0 CA-C-O 122.252 0.918 . . . . 0.0 115.094 177.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 8.8 ptp180 -164.33 162.87 22.56 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 128.403 2.681 . . . . 0.0 108.724 173.566 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 50.5 tttt -73.51 124.38 25.75 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 168.283 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 62.6 p -122.26 165.76 15.7 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 125.043 1.337 . . . . 0.0 110.743 -176.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -50.33 -35.19 26.6 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.424 1.09 . . . . 0.0 113.589 171.385 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -70.76 -49.38 47.4 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 121.512 -0.743 . . . . 0.0 112.11 176.662 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.5 mt -64.2 -32.58 74.22 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 121.676 -0.64 . . . . 0.0 112.275 175.829 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 8.6 tp60 -60.51 -50.83 72.0 Favored 'General case' 0 C--O 1.223 -0.335 0 CA-C-O 118.47 -0.776 . . . . 0.0 110.434 170.036 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 60.9 t80 -56.83 -43.87 81.49 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.809 1.186 . . . . 0.0 112.269 177.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 93.3 mmm -55.08 -52.2 63.96 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 122.946 0.498 . . . . 0.0 112.083 172.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 -72.48 -30.95 64.99 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 -177.741 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -91.56 -25.87 19.01 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.429 1.492 . . . . 0.0 113.271 -168.428 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 34.3 t -128.4 -52.18 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 C-N-CA 123.224 0.61 . . . . 0.0 111.443 -176.312 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 16.3 t -69.85 -65.87 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 C-N-CA 123.624 0.769 . . . . 0.0 110.468 -171.336 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 48.8 t -54.21 -49.74 60.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 C-N-CA 125.624 1.57 . . . . 0.0 110.13 173.067 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -53.33 -52.65 58.5 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 118.824 -0.608 . . . . 0.0 111.63 -177.568 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 25.4 m -70.91 -40.16 72.32 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 118.576 0.625 . . . . 0.0 112.407 -178.429 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 62.7 mt -59.67 -29.59 68.16 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 118.682 0.674 . . . . 0.0 112.141 172.788 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' TRP . . . . . 0.465 ' CZ3' ' HE3' ' A' ' 87' ' ' LYS . 26.8 t-105 -79.83 -33.88 39.89 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.902 1.681 . . . . 0.0 114.234 179.209 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 15.4 ptmt -80.05 -9.51 59.7 Favored 'General case' 0 N--CA 1.483 1.193 0 CA-C-N 119.968 1.258 . . . . 0.0 114.166 174.587 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 50.1 t-80 -55.42 151.57 9.96 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.771 1.628 . . . . 0.0 113.519 177.664 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.62 -17.38 21.63 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.765 1.626 . . . . 0.0 114.442 176.76 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -125.85 17.04 8.01 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.48 1.512 . . . . 0.0 114.043 -173.784 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.32 -29.97 65.65 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 177.263 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' TRP . . . . . 0.409 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 41.5 p-90 -54.84 -36.98 50.77 Favored Pre-proline 0 CA--C 1.549 0.919 0 N-CA-C 117.543 2.423 . . . . 0.0 117.543 -171.896 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.409 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 73.1 Cg_endo -70.53 -3.03 11.69 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 CA-C-N 123.187 2.174 . . . . 0.0 114.7 173.136 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 -115.78 -3.25 12.24 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.345 1.458 . . . . 0.0 113.363 178.574 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -63.64 -27.45 69.24 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 119.511 1.051 . . . . 0.0 113.435 178.577 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -138.16 153.83 73.54 Favored Pre-proline 0 CA--C 1.542 0.652 0 C-N-CA 126.138 1.775 . . . . 0.0 110.003 -173.119 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -66.3 141.21 61.5 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 C-N-CA 122.416 2.077 . . . . 0.0 113.308 -175.316 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 54.5 t -57.08 136.23 20.28 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 124.716 1.206 . . . . 0.0 110.432 169.42 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -127.95 101.48 6.34 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 125.304 1.442 . . . . 0.0 109.983 178.635 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.0 -30.06 61.26 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.499 1.12 . . . . 0.0 113.924 -179.387 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 83.6 mt -67.77 -48.84 74.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 125.02 1.328 . . . . 0.0 111.109 175.085 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -66.21 -37.54 85.82 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.945 1.298 . . . . 0.0 112.96 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 72.3 mt -95.24 0.55 54.03 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.335 1.854 . . . . 0.0 113.103 -174.302 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 51.6 57.5 6.5 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.914 1.686 . . . . 0.0 113.036 -179.073 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 36.8 mt -113.92 78.24 4.06 Favored Pre-proline 0 CA--C 1.546 0.815 0 C-N-CA 126.042 1.737 . . . . 0.0 110.021 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -66.56 -7.34 17.62 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 124.387 3.392 . . . . 0.0 115.292 -169.421 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -130.71 17.79 5.22 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.942 1.697 . . . . 0.0 112.204 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 69.8 t80 -46.55 -54.61 9.03 Favored 'General case' 0 N--CA 1.476 0.849 0 O-C-N 120.997 -1.064 . . . . 0.0 113.486 -174.213 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -76.24 -8.88 58.03 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.013 1.325 . . . . 0.0 114.477 -179.312 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.1 mmmp? -77.86 -39.13 44.36 Favored 'General case' 0 N--CA 1.476 0.857 0 O-C-N 121.214 -0.929 . . . . 0.0 110.866 173.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.3 mp -82.61 -50.38 15.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 124.219 1.007 . . . . 0.0 110.565 174.026 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.593 HD11 ' HB2' ' A' ' 115' ' ' TYR . 34.4 mm -76.87 109.08 10.88 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.625 0 C-N-CA 123.642 0.777 . . . . 0.0 111.319 -178.257 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.22 -40.24 93.24 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.506 1.123 . . . . 0.0 112.464 171.364 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -154.44 106.18 2.39 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 125.98 1.712 . . . . 0.0 110.905 -172.677 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -76.71 163.26 31.81 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 123.6 2.867 . . . . 0.0 111.934 178.007 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.406 ' HE2' ' H ' ' A' ' 82' ' ' ASP . 0.0 OUTLIER -158.19 153.14 25.24 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.954 0.901 . . . . 0.0 111.981 175.025 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.406 ' H ' ' HE2' ' A' ' 81' ' ' MET . 10.8 m-20 -153.19 132.32 12.65 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 126.906 2.082 . . . . 0.0 110.566 -171.971 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 7.2 ttp -59.82 -36.2 76.29 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.254 1.022 . . . . 0.0 113.37 -172.032 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -58.15 -24.85 56.0 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 124.662 1.125 . . . . 0.0 114.503 175.06 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 91.2 m -94.25 -17.44 22.66 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.267 1.427 . . . . 0.0 112.524 178.158 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.5 mt -72.43 -52.86 21.51 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 O-C-N 120.803 -1.185 . . . . 0.0 110.302 170.577 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.465 ' HE3' ' CZ3' ' A' ' 51' ' ' TRP . 16.6 ptpt -57.8 -29.0 64.54 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -178.56 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 3.0 tppp? -66.8 -45.35 78.65 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.98 1.312 . . . . 0.0 112.697 -177.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 1.4 ptt180 -77.55 -27.7 51.62 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.169 0.987 . . . . 0.0 113.009 178.25 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 64.6 mt -60.98 -34.15 74.33 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 168.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -73.12 -38.85 66.17 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 118.864 0.756 . . . . 0.0 112.362 173.809 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -69.8 178.13 2.76 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 125.261 1.425 . . . . 0.0 112.896 171.071 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 41.5 p-10 -99.12 34.2 2.19 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.832 2.053 . . . . 0.0 111.936 174.284 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 65.5 t80 -63.87 -36.32 83.54 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.409 1.084 . . . . 0.0 113.696 -169.232 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -136.63 -177.99 4.98 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 128.184 2.594 . . . . 0.0 110.78 177.551 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 7.4 t-105 -115.0 -29.91 6.54 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.984 1.314 . . . . 0.0 112.464 -178.13 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 54.3 m -132.17 141.24 49.02 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.062 0.945 . . . . 0.0 112.665 -168.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -63.45 -16.63 61.15 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 115.943 1.831 . . . . 0.0 115.943 -173.52 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 14.7 m -55.32 -30.85 61.01 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.969 0.907 . . . . 0.0 112.989 175.012 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -65.49 -50.52 65.01 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 121.544 -0.723 . . . . 0.0 111.332 173.283 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 53.2 t -59.96 -37.74 80.44 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.25 1.02 . . . . 0.0 112.567 175.396 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 85.5 mtp -62.01 -42.68 99.42 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 121.184 -0.947 . . . . 0.0 112.393 173.318 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -64.95 -35.93 82.76 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 112.702 0.63 . . . . 0.0 112.702 173.425 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 55.8 m-20 -61.37 -48.02 83.17 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.487 1.039 . . . . 0.0 112.084 172.372 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -60.79 -43.71 97.76 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.622 -0.674 . . . . 0.0 112.767 174.573 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 18.1 t30 -55.2 -52.11 64.4 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.113 0.565 . . . . 0.0 111.526 173.729 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 96.5 m -61.01 -35.99 78.31 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.748 0.819 . . . . 0.0 112.737 177.546 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 27.7 ttp -61.3 -49.9 75.17 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 119.421 1.009 . . . . 0.0 112.554 176.573 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -70.9 -42.29 70.17 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 179.428 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 62.5 m -63.86 -46.76 83.54 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.764 0.825 . . . . 0.0 112.664 179.629 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -64.38 -33.78 76.65 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 119.852 1.206 . . . . 0.0 112.108 -179.296 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 19.2 m -59.15 -41.72 89.01 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.76 0.824 . . . . 0.0 112.989 169.522 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -68.73 -29.39 67.8 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 177.787 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 87.5 mt -69.12 -56.69 11.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 123.383 0.673 . . . . 0.0 110.986 176.063 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' TYR . . . . . 0.593 ' HB2' HD11 ' A' ' 77' ' ' ILE . 33.7 t80 -67.9 -31.51 71.34 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 114.577 1.325 . . . . 0.0 114.577 -173.167 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 60.8 m-80 -110.18 160.43 16.5 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.474 1.11 . . . . 0.0 112.053 -170.332 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 49.0 mmtm -72.18 152.14 92.46 Favored Pre-proline 0 N--CA 1.474 0.752 0 O-C-N 121.499 -0.75 . . . . 0.0 110.343 172.363 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -65.74 -1.24 4.68 Favored 'Trans proline' 0 CA--C 1.545 1.042 0 C-N-CA 123.676 2.917 . . . . 0.0 115.043 -177.461 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 67.7 p -119.01 -0.59 11.11 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.663 1.985 . . . . 0.0 113.126 -179.429 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -68.45 146.5 53.12 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 118.794 0.724 . . . . 0.0 110.68 170.344 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -55.39 -49.53 72.09 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 121.681 -0.637 . . . . 0.0 112.209 -175.562 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.5 tp -51.99 -31.12 13.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 125.232 1.413 . . . . 0.0 114.54 177.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 55.2 t -73.84 -48.96 37.23 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 O-C-N 121.541 -0.725 . . . . 0.0 110.719 174.174 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 77.2 mt -61.33 -37.4 83.14 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 119.124 0.875 . . . . 0.0 111.848 177.806 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 10.6 mtp -57.91 -52.62 64.72 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.869 1.668 . . . . 0.0 111.918 169.801 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.43 -39.23 90.02 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 113.04 0.755 . . . . 0.0 113.04 176.164 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' GLN . . . . . 0.428 ' O ' ' HE2' ' A' ' 131' ' ' LYS . 89.4 mt-30 -61.55 -47.79 83.96 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 119.312 0.96 . . . . 0.0 112.012 174.342 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.34 -40.44 96.38 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.698 -0.626 . . . . 0.0 112.514 177.885 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 82.6 mt -65.37 -44.73 86.7 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.436 0.694 . . . . 0.0 111.904 172.812 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -59.34 -48.09 82.95 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.343 0.974 . . . . 0.0 113.173 -175.093 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.428 ' HE2' ' O ' ' A' ' 127' ' ' GLN . 1.1 mppt? -60.45 -32.83 71.76 Favored 'General case' 0 CA--C 1.533 0.31 0 O-C-N 120.947 -1.096 . . . . 0.0 113.693 176.646 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 73.8 mt -76.18 -40.79 36.93 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 CA-C-N 118.803 0.729 . . . . 0.0 111.362 174.178 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -51.45 -51.61 53.47 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.383 -0.823 . . . . 0.0 109.965 170.593 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.3 mt -61.3 -43.18 99.3 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.507 0.723 . . . . 0.0 112.939 177.781 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -64.92 -31.58 72.88 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 120.056 1.298 . . . . 0.0 112.76 -178.588 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -76.14 -52.0 11.02 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.774 0.83 . . . . 0.0 112.191 175.544 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.3 m -65.61 -24.79 35.22 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 CA-C-N 120.338 1.426 . . . . 0.0 112.586 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -60.25 -30.69 69.59 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 112.889 0.699 . . . . 0.0 112.889 171.45 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 80.0 mt-30 -91.71 -9.17 44.75 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.752 1.221 . . . . 0.0 112.925 175.494 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 46.2 ttp -64.64 142.07 98.42 Favored Pre-proline 0 CA--C 1.549 0.918 0 O-C-N 121.282 -0.886 . . . . 0.0 110.807 173.528 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_exo -50.25 162.37 0.86 Allowed 'Trans proline' 0 CA--C 1.542 0.908 0 C-N-CA 123.787 2.991 . . . . 0.0 114.728 169.56 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 -93.65 -11.55 31.38 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.414 1.086 . . . . 0.0 113.53 172.321 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -124.18 163.2 22.05 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 127.097 2.159 . . . . 0.0 111.07 -175.237 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -124.93 162.42 24.48 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 114.973 1.471 . . . . 0.0 114.973 -177.99 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 65.3 t -138.48 135.28 43.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 125.999 1.72 . . . . 0.0 109.889 -176.806 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -65.38 121.38 14.72 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.338 1.455 . . . . 0.0 111.142 170.206 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 84.4 mt -74.71 150.3 39.53 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.615 0.722 . . . . 0.0 112.4 177.324 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -74.49 160.13 81.88 Favored Pre-proline 0 CA--C 1.546 0.813 0 C-N-CA 124.404 1.082 . . . . 0.0 112.638 173.07 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -69.95 157.34 60.36 Favored 'Trans proline' 0 CA--C 1.546 1.115 0 C-N-CA 123.281 2.654 . . . . 0.0 111.472 171.834 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -71.35 155.32 60.41 Favored 'Trans proline' 0 CA--C 1.54 0.776 0 C-N-CA 123.018 2.478 . . . . 0.0 111.999 177.387 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -76.11 151.01 83.67 Favored Pre-proline 0 CA--C 1.55 0.964 0 C-N-CA 123.995 0.918 . . . . 0.0 112.039 175.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -72.15 147.88 49.09 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 123.115 2.544 . . . . 0.0 111.826 174.496 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 54.9 tttp -72.95 158.16 36.01 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.38 1.072 . . . . 0.0 111.668 173.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . -154.93 179.23 31.13 Favored Glycine 0 CA--C 1.535 1.328 0 C-N-CA 125.289 1.424 . . . . 0.0 113.152 177.118 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 9.8 ptpp? . . . . . 0 C--O 1.252 1.223 0 C-N-CA 126.075 1.75 . . . . 0.0 112.906 -177.464 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.475 0 N-CA-C 111.214 -0.755 . . . . 0.0 111.214 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 51.7 p 63.99 -3.74 0.43 Allowed 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 127.998 2.519 . . . . 0.0 117.576 -179.595 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.8 t -66.47 110.6 3.19 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.333 1.053 . . . . 0.0 110.942 173.495 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 176.1 -169.26 41.82 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 124.74 1.162 . . . . 0.0 113.335 -174.338 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 59.3 p -61.8 152.68 30.81 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.434 1.094 . . . . 0.0 113.405 176.341 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 12.6 t -72.14 -29.03 63.64 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.186 0.994 . . . . 0.0 113.606 -178.055 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 178.03 -169.52 41.4 Favored Glycine 0 CA--C 1.534 1.234 0 C-N-CA 124.675 1.131 . . . . 0.0 113.459 -176.039 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -141.58 163.26 33.4 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.638 1.575 . . . . 0.0 112.56 -176.867 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 25.2 m -131.93 -13.51 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.336 0 C-N-CA 125.228 1.411 . . . . 0.0 114.14 -169.272 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 14.2 t -151.03 135.6 17.09 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 125.714 1.605 . . . . 0.0 110.09 178.552 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 38.2 t-20 -155.21 122.96 2.84 Favored Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 124.54 1.136 . . . . 0.0 110.182 -175.864 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -77.35 -9.88 17.54 Favored 'Trans proline' 0 CA--C 1.544 1.005 0 C-N-CA 123.776 2.984 . . . . 0.0 114.775 -176.07 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 62.1 m -113.19 -25.1 9.05 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.757 1.223 . . . . 0.0 113.713 -176.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -64.67 131.27 95.08 Favored Pre-proline 0 CA--C 1.545 0.766 0 C-N-CA 124.863 1.265 . . . . 0.0 110.759 172.425 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -73.06 148.2 44.42 Favored 'Trans proline' 0 CA--C 1.536 0.622 0 C-N-CA 122.696 2.264 . . . . 0.0 112.368 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 162.14 161.48 12.09 Favored Glycine 0 CA--C 1.532 1.12 0 C-N-CA 124.793 1.187 . . . . 0.0 112.855 179.397 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 33.1 ptt180 -154.91 156.84 36.83 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 126.026 1.73 . . . . 0.0 111.038 177.375 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.8 tttt -73.38 140.04 46.35 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.444 0.698 . . . . 0.0 110.758 170.107 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 70.0 p -142.13 168.3 20.08 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 126.373 1.869 . . . . 0.0 109.695 -177.457 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 24.9 p-10 -49.87 -32.87 15.42 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 169.815 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.3 mm-40 -67.59 -57.04 7.15 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.01 0.924 . . . . 0.0 111.351 178.705 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 89.6 mt -65.37 -33.32 75.67 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.527 -0.733 . . . . 0.0 112.689 178.167 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -58.45 -50.24 74.44 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.98 0.912 . . . . 0.0 111.318 170.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -59.6 -40.09 86.31 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.543 0.737 . . . . 0.0 112.603 177.912 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 90.4 mmm -56.38 -49.14 75.29 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 121.86 -0.525 . . . . 0.0 112.331 173.459 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -77.9 -18.38 56.22 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 114.772 1.397 . . . . 0.0 114.772 178.313 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 56.7 m-20 -102.96 -21.3 13.97 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 -171.5 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 59.0 t -131.84 -48.61 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 123.989 0.916 . . . . 0.0 111.645 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.4 t -72.31 -66.57 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 CA-C-N 118.863 0.756 . . . . 0.0 110.86 -170.423 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 89.8 t -58.76 -40.8 80.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 124.157 0.983 . . . . 0.0 110.362 172.338 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.5 tppp? -54.63 -47.64 73.21 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.892 0.877 . . . . 0.0 112.427 178.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 62.4 m -73.06 -44.33 60.78 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 122.923 0.489 . . . . 0.0 111.624 178.34 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 55.3 mt -62.86 -32.54 73.79 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.471 0.708 . . . . 0.0 112.426 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 18.0 t-105 -75.26 -30.09 60.36 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.319 1.447 . . . . 0.0 113.192 174.164 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 54.2 mtmt -79.03 -9.14 59.45 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.514 0.931 . . . . 0.0 113.514 175.105 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 35.6 t-80 -62.89 154.53 29.88 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.754 1.222 . . . . 0.0 113.494 -178.106 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -58.11 -24.48 58.86 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.475 1.51 . . . . 0.0 113.815 174.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -123.36 22.23 9.34 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.158 1.383 . . . . 0.0 113.657 -172.85 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.57 -26.08 63.38 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.725 1.21 . . . . 0.0 113.843 173.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 64.6 p-90 -59.14 -33.9 20.02 Favored Pre-proline 0 CA--C 1.546 0.804 0 N-CA-C 117.735 2.494 . . . . 0.0 117.735 -170.155 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -73.84 -2.61 12.48 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 CA-C-N 123.216 2.184 . . . . 0.0 113.781 173.757 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -115.75 -2.11 12.49 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.547 1.539 . . . . 0.0 113.474 179.221 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -63.06 -24.99 68.17 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 120.913 -1.117 . . . . 0.0 113.565 177.373 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -139.69 153.94 70.62 Favored Pre-proline 0 CA--C 1.543 0.681 0 C-N-CA 126.134 1.774 . . . . 0.0 110.377 -174.834 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -66.28 142.02 64.94 Favored 'Trans proline' 0 CA--C 1.537 0.652 0 C-N-CA 122.774 2.316 . . . . 0.0 112.569 179.526 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 49.5 t -59.13 142.31 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 124.452 1.101 . . . . 0.0 111.491 171.595 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -120.52 95.65 4.81 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.482 1.513 . . . . 0.0 109.536 171.513 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.25 -27.31 45.55 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.653 1.181 . . . . 0.0 113.877 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 77.9 mt -63.44 -53.46 45.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 124.437 1.095 . . . . 0.0 110.59 173.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 4.3 mptp? -66.16 -35.76 81.33 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.401 1.48 . . . . 0.0 112.707 -179.663 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 47.1 mt -81.08 -3.3 51.5 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 114.039 1.125 . . . . 0.0 114.039 174.318 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 62.7 t30 54.56 52.93 11.44 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.937 1.695 . . . . 0.0 113.677 -178.318 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 45.9 mt -115.47 80.61 8.02 Favored Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 126.644 1.978 . . . . 0.0 110.431 -177.06 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -67.47 -10.42 28.66 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 123.806 3.004 . . . . 0.0 113.917 -175.372 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -126.05 22.41 7.31 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.153 1.781 . . . . 0.0 112.397 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 71.6 t80 -51.04 -57.81 7.69 Favored 'General case' 0 N--CA 1.474 0.741 0 O-C-N 120.844 -1.16 . . . . 0.0 112.476 177.702 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -74.02 -12.7 60.7 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.973 1.309 . . . . 0.0 114.499 -178.094 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -71.61 -32.97 68.57 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.053 0.941 . . . . 0.0 111.645 177.725 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.9 mp -103.01 -43.51 9.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 125.82 1.648 . . . . 0.0 111.667 -178.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 22.6 mm -61.17 114.82 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 124.231 1.013 . . . . 0.0 110.244 173.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -63.41 -46.1 87.96 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.452 1.101 . . . . 0.0 111.756 179.011 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -156.19 127.94 3.85 Favored Pre-proline 0 CA--C 1.545 0.757 0 C-N-CA 125.606 1.562 . . . . 0.0 110.847 169.389 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -76.45 155.48 36.33 Favored 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 123.564 2.842 . . . . 0.0 112.232 -177.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 33.5 tpp -163.12 140.94 7.9 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.629 1.571 . . . . 0.0 110.115 174.479 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 25.8 m-20 -139.12 134.97 33.59 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 126.574 1.949 . . . . 0.0 108.42 169.375 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.5 ttp -46.96 -30.86 2.8 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 127.348 2.259 . . . . 0.0 116.24 -168.64 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.3 -30.41 40.13 Favored Glycine 0 CA--C 1.54 1.631 0 CA-C-N 119.08 0.854 . . . . 0.0 114.141 172.839 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 2.2 m -70.89 -35.63 72.41 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 125.259 1.424 . . . . 0.0 112.363 175.733 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 46.6 mt -67.94 -52.25 41.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.552 1.141 . . . . 0.0 110.008 -176.106 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.49 -40.12 77.94 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 174.869 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 3.2 tppp? -59.83 -39.85 86.48 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.014 0.926 . . . . 0.0 112.797 179.683 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 1.5 ptm180 -87.24 -28.35 22.4 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 39.6 mt -61.85 -34.88 76.77 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.127 0.971 . . . . 0.0 112.833 167.052 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -74.31 9.59 1.61 Allowed 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 124.962 1.305 . . . . 0.0 113.758 174.645 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 46.0 m-80 -129.29 161.02 31.19 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 127.36 2.264 . . . . 0.0 110.015 173.34 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 10.3 p-10 -78.34 36.89 0.25 Allowed 'General case' 0 CA--C 1.551 1.006 0 O-C-N 120.767 -1.208 . . . . 0.0 112.177 169.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -62.6 -34.18 76.47 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.073 1.349 . . . . 0.0 113.235 -169.604 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -134.54 -179.38 5.55 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 127.089 2.156 . . . . 0.0 111.296 174.851 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 4.3 t-105 -110.97 -26.24 9.38 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.217 1.407 . . . . 0.0 112.789 -177.725 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 62.1 m -134.29 143.74 47.92 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.664 1.186 . . . . 0.0 112.632 -170.091 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -65.3 -16.18 63.3 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 115.232 1.567 . . . . 0.0 115.232 -177.869 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 11.4 p -51.83 -36.21 47.3 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.497 1.119 . . . . 0.0 113.476 172.801 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -69.65 -42.0 74.82 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.764 0.825 . . . . 0.0 112.227 176.836 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 49.4 t -64.81 -35.33 80.75 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.162 0.985 . . . . 0.0 112.459 172.702 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 89.4 mtp -66.84 -42.32 85.96 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 121.323 -0.861 . . . . 0.0 111.817 173.66 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -63.73 -29.62 70.81 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 173.688 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -66.81 -45.95 76.73 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 119.341 0.973 . . . . 0.0 112.301 171.657 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -63.37 -41.28 98.8 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 121.322 -0.861 . . . . 0.0 112.687 173.091 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 22.7 t30 -57.66 -46.15 84.6 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.831 -0.543 . . . . 0.0 111.578 172.202 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 81.4 m -56.02 -49.82 72.61 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.19 0.996 . . . . 0.0 111.417 175.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 27.3 ttm -56.72 -61.29 2.53 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.224 1.01 . . . . 0.0 112.313 179.255 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -63.16 -40.79 98.56 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -175.107 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 66.5 m -66.72 -45.79 77.55 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.442 -0.786 . . . . 0.0 112.167 176.045 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -63.19 -30.84 71.91 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 120.102 1.319 . . . . 0.0 112.586 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 82.7 m -60.58 -45.17 94.92 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.266 1.026 . . . . 0.0 112.217 170.544 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -69.71 -29.56 66.99 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 179.563 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 88.6 mt -71.21 -55.83 12.56 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 CA-C-N 118.41 0.55 . . . . 0.0 110.126 178.027 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -71.3 -30.45 66.26 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 114.567 1.321 . . . . 0.0 114.567 -172.882 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 44.4 m-80 -113.61 158.25 21.06 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.012 0.925 . . . . 0.0 112.654 -171.011 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -66.16 147.89 98.66 Favored Pre-proline 0 N--CA 1.472 0.672 0 C-N-CA 124.61 1.164 . . . . 0.0 110.834 176.756 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -65.72 -6.94 15.06 Favored 'Trans proline' 0 CA--C 1.543 0.954 0 C-N-CA 123.828 3.019 . . . . 0.0 114.973 -175.161 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 70.7 p -116.46 1.18 12.93 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 126.265 1.826 . . . . 0.0 113.096 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -67.53 146.04 54.33 Favored 'General case' 0 CA--C 1.541 0.633 0 O-C-N 121.451 -0.781 . . . . 0.0 110.941 174.096 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -51.97 -46.25 64.74 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.7 0.8 . . . . 0.0 112.808 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 9.6 tp -57.43 -34.56 46.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 124.488 1.115 . . . . 0.0 113.747 179.39 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 45.4 t -69.95 -43.55 79.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 123.428 0.691 . . . . 0.0 110.67 174.203 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 69.5 mt -63.25 -35.8 81.53 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 119.003 0.819 . . . . 0.0 111.94 176.416 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -57.79 -53.4 58.62 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 118.26 0.482 . . . . 0.0 110.738 170.381 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.87 -39.99 91.26 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.483 0.713 . . . . 0.0 112.611 179.669 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -60.72 -50.12 74.77 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.07 0.85 . . . . 0.0 112.036 174.419 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.87 -41.33 99.36 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.427 0.691 . . . . 0.0 112.41 -179.654 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 85.4 mt -65.48 -45.74 82.47 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.635 0.774 . . . . 0.0 111.848 173.472 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -60.37 -43.24 96.74 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.566 1.075 . . . . 0.0 113.165 -176.595 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 66.1 mttt -58.23 -38.24 76.46 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.53 0.732 . . . . 0.0 111.857 178.104 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 70.1 mt -78.16 -41.62 26.84 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 123.406 0.682 . . . . 0.0 111.729 176.657 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 29.2 t80 -50.42 -51.57 45.26 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 119.131 0.878 . . . . 0.0 110.413 172.448 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 99.4 mt -62.04 -42.48 99.22 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.891 0.7 . . . . 0.0 112.891 178.401 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -67.89 -30.65 70.05 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 120.009 1.277 . . . . 0.0 112.755 179.85 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 69.2 mmtt -75.52 -48.39 22.76 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 117.616 -1.183 . . . . 0.0 112.435 175.189 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.7 m -68.43 -25.98 32.51 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 CA-C-N 121.094 1.77 . . . . 0.0 112.362 177.253 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -59.85 -31.12 69.46 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.748 -0.595 . . . . 0.0 112.431 171.394 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 21.6 mm100 -89.97 -5.85 56.26 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.125 1.37 . . . . 0.0 113.027 176.498 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 40.8 ttp -63.43 137.26 97.03 Favored Pre-proline 0 CA--C 1.546 0.819 0 C-N-CA 123.802 0.841 . . . . 0.0 110.418 171.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_endo -61.63 148.7 92.42 Favored 'Trans proline' 0 CA--C 1.534 0.514 0 C-N-CA 122.601 2.201 . . . . 0.0 111.023 174.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 -92.09 -13.46 30.77 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -174.487 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 9.5 mp0 -100.01 150.54 22.33 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 126.184 1.794 . . . . 0.0 111.862 176.047 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -98.84 140.93 32.28 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.04 1.336 . . . . 0.0 110.315 177.237 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 8.5 p -146.29 138.04 19.34 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 CA-C-O 122.299 1.047 . . . . 0.0 111.162 169.854 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -65.51 131.84 47.39 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.452 1.901 . . . . 0.0 111.64 176.054 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 98.6 mt -78.0 150.36 33.91 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 114.068 1.136 . . . . 0.0 114.068 -177.095 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 4.4 pp -73.43 154.88 89.89 Favored Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 124.738 1.215 . . . . 0.0 111.118 168.216 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -76.78 145.61 25.75 Favored 'Trans proline' 0 CA--C 1.547 1.139 0 C-N-CA 122.882 2.388 . . . . 0.0 112.529 -177.157 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -73.19 170.21 20.4 Favored 'Trans proline' 0 CA--C 1.543 0.929 0 C-N-CA 123.733 2.956 . . . . 0.0 112.574 175.595 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -145.97 150.94 43.99 Favored Pre-proline 0 CA--C 1.55 0.959 0 C-N-CA 124.83 1.252 . . . . 0.0 112.072 177.235 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -76.97 75.02 4.74 Favored 'Trans proline' 0 CA--C 1.545 1.041 0 C-N-CA 124.663 3.575 . . . . 0.0 112.231 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -54.46 -35.21 62.78 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 125.465 1.506 . . . . 0.0 113.744 179.476 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . 172.84 170.32 36.41 Favored Glycine 0 CA--C 1.536 1.357 0 C-N-CA 124.966 1.27 . . . . 0.0 113.55 174.585 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.253 1.266 0 C-N-CA 125.118 1.367 . . . . 0.0 113.864 173.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.463 0 N-CA-C 111.138 -0.785 . . . . 0.0 111.138 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 19.4 m -68.32 -16.64 64.02 Favored 'General case' 0 N--CA 1.479 1.007 0 N-CA-C 114.876 1.435 . . . . 0.0 114.876 -176.799 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.4 t -152.98 159.95 42.97 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.52 1.528 . . . . 0.0 111.269 176.104 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 70.51 -171.88 43.18 Favored Glycine 0 CA--C 1.536 1.394 0 C-N-CA 124.544 1.068 . . . . 0.0 114.22 -176.041 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 25.0 m -135.96 -14.6 1.82 Allowed 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 114.772 1.397 . . . . 0.0 114.772 -177.362 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.3 t -71.6 127.08 31.42 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 119.574 1.079 . . . . 0.0 110.996 173.597 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 153.51 -32.05 0.77 Allowed Glycine 0 CA--C 1.533 1.16 0 C-N-CA 126.488 1.994 . . . . 0.0 110.923 -175.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 26.4 pt-20 -64.58 162.84 14.75 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.475 1.51 . . . . 0.0 112.691 168.602 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.6 m -133.96 5.38 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 C-N-CA 125.71 1.604 . . . . 0.0 113.107 -177.52 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 12.7 t -149.9 168.69 23.06 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 127.414 2.286 . . . . 0.0 110.055 176.686 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -140.11 143.78 35.27 Favored Pre-proline 0 CA--C 1.548 0.872 0 C-N-CA 124.707 1.203 . . . . 0.0 113.342 -171.523 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -80.26 -20.25 8.61 Favored 'Trans proline' 0 CA--C 1.542 0.878 0 C-N-CA 123.829 3.019 . . . . 0.0 114.332 -179.472 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 18.7 t -156.48 -32.63 0.09 Allowed 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 114.656 1.354 . . . . 0.0 114.656 -173.745 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 21.3 ttpp -54.31 136.99 59.91 Favored Pre-proline 0 N--CA 1.478 0.97 0 C-N-CA 124.831 1.252 . . . . 0.0 112.292 -178.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -71.95 161.24 45.46 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 C-N-CA 122.786 2.324 . . . . 0.0 113.731 179.771 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 174.68 156.66 14.43 Favored Glycine 0 CA--C 1.536 1.394 0 C-N-CA 126.874 2.178 . . . . 0.0 111.766 172.581 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 34.6 ptt180 -153.02 152.57 31.52 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.471 1.508 . . . . 0.0 110.675 172.169 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 74.0 tttt -71.75 139.24 48.99 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.362 0.665 . . . . 0.0 110.4 169.531 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 61.9 p -140.41 168.56 19.52 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.864 1.666 . . . . 0.0 110.421 -176.468 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 26.2 p-10 -48.94 -37.36 19.75 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 114.29 1.219 . . . . 0.0 114.29 172.039 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -72.11 -46.17 57.7 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 121.521 -0.737 . . . . 0.0 111.767 178.849 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 79.4 mt -65.44 -32.62 74.34 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 121.805 -0.559 . . . . 0.0 112.222 175.097 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 44.3 tt0 -59.6 -52.48 65.36 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 123.292 0.637 . . . . 0.0 109.863 168.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -56.4 -41.38 76.2 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.503 0.721 . . . . 0.0 112.516 179.179 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 89.9 mmm -57.15 -56.03 27.08 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 118.303 0.502 . . . . 0.0 112.017 171.496 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.2 pt20 -77.46 -11.53 59.86 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.952 1.464 . . . . 0.0 114.952 -175.243 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -115.48 -21.14 9.92 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.771 1.228 . . . . 0.0 113.334 -169.634 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 16.0 t -129.2 -51.4 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 C-N-CA 123.225 0.61 . . . . 0.0 111.229 -179.243 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.5 t -68.04 -63.01 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 123.246 0.618 . . . . 0.0 110.469 -176.505 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 69.0 t -57.79 -48.36 83.86 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 124.518 1.127 . . . . 0.0 110.523 174.429 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm -58.22 -44.34 88.16 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 118.482 0.583 . . . . 0.0 112.24 -175.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 40.5 m -71.01 -43.05 68.75 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 177.685 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 75.7 mt -63.16 -33.83 76.31 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.291 0.636 . . . . 0.0 112.355 176.576 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' TRP . . . . . 0.464 ' CZ3' ' HE3' ' A' ' 87' ' ' LYS . 19.3 t-105 -70.75 -28.33 64.61 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.741 1.616 . . . . 0.0 113.353 175.056 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.4 mtmp? -83.92 -4.13 58.47 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.291 1.036 . . . . 0.0 113.533 176.122 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 36.1 t-80 -65.99 158.91 27.01 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.902 1.281 . . . . 0.0 113.301 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -58.84 -24.53 62.15 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.518 1.527 . . . . 0.0 113.88 175.42 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 -125.4 22.1 7.79 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.802 1.241 . . . . 0.0 114.057 -171.532 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.72 -28.27 65.68 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 176.211 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' TRP . . . . . 0.427 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 45.0 p-90 -56.69 -37.6 59.41 Favored Pre-proline 0 CA--C 1.547 0.855 0 N-CA-C 117.324 2.342 . . . . 0.0 117.324 -170.911 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.427 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 64.0 Cg_endo -70.22 -5.53 16.72 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 CA-C-N 123.042 2.122 . . . . 0.0 114.592 172.325 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 80.7 m-85 -113.19 -1.06 14.45 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.345 1.458 . . . . 0.0 113.302 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -64.02 -17.83 63.72 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 113.914 1.079 . . . . 0.0 113.914 175.379 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 -142.88 157.06 62.01 Favored Pre-proline 0 CA--C 1.546 0.797 0 C-N-CA 125.958 1.703 . . . . 0.0 111.047 -172.311 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -65.42 152.48 81.85 Favored 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 122.998 2.465 . . . . 0.0 112.34 173.613 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 36.5 t -71.85 144.75 12.92 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 124.485 1.114 . . . . 0.0 110.56 177.153 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -128.97 97.07 4.52 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.197 1.399 . . . . 0.0 110.604 178.834 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.0 -28.46 57.35 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.563 1.145 . . . . 0.0 113.858 178.607 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 82.6 mt -66.72 -49.34 75.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 125.071 1.348 . . . . 0.0 111.021 174.614 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 9.6 mtpm? -67.75 -37.73 82.54 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.636 1.174 . . . . 0.0 112.745 -179.537 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 85.0 mt -90.63 -1.2 57.88 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.952 1.701 . . . . 0.0 113.513 -177.596 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 51.96 57.43 6.51 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 125.754 1.622 . . . . 0.0 113.296 -178.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 53.9 mt -113.6 83.59 7.25 Favored Pre-proline 0 CA--C 1.547 0.854 0 C-N-CA 125.9 1.68 . . . . 0.0 110.655 -177.537 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -67.66 -11.6 32.68 Favored 'Trans proline' 0 CA--C 1.541 0.858 0 C-N-CA 123.975 3.117 . . . . 0.0 114.61 -170.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.432 ' HA ' ' HE3' ' A' ' 75' ' ' LYS . 40.9 m-20 -125.8 21.53 7.61 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.416 1.486 . . . . 0.0 113.048 177.878 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -48.28 -55.39 10.7 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 121.212 -0.93 . . . . 0.0 113.009 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -77.39 -16.25 58.94 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 114.672 1.36 . . . . 0.0 114.672 -177.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.432 ' HE3' ' HA ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -68.66 -39.64 80.54 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.141 -0.975 . . . . 0.0 111.714 172.656 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.3 mp -88.65 -46.2 15.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 124.35 1.06 . . . . 0.0 111.189 175.69 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.574 HD11 ' HB2' ' A' ' 115' ' ' TYR . 32.3 mm -80.34 104.51 8.78 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-O 121.685 0.755 . . . . 0.0 111.189 178.514 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -69.34 -36.65 77.11 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.84 1.256 . . . . 0.0 112.578 174.822 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -146.35 103.46 4.04 Favored Pre-proline 0 CA--C 1.547 0.83 0 C-N-CA 125.69 1.596 . . . . 0.0 110.686 -178.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -76.32 149.17 31.16 Favored 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 123.403 2.735 . . . . 0.0 111.232 174.191 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 6.8 tpt -157.83 148.66 21.02 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.726 1.211 . . . . 0.0 111.105 177.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -150.56 154.85 38.33 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.771 1.628 . . . . 0.0 111.533 -178.644 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 4.5 ttp -64.07 -33.23 75.28 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.911 0.885 . . . . 0.0 113.369 -174.21 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.67 -44.97 97.26 Favored Glycine 0 CA--C 1.532 1.138 0 C-N-CA 124.697 1.141 . . . . 0.0 112.899 173.759 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 57.7 m -68.56 -39.78 80.91 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 121.789 -0.83 . . . . 0.0 111.827 172.727 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 95.3 mt -55.56 -53.23 38.82 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 CA-C-N 120.104 1.32 . . . . 0.0 111.22 176.119 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.464 ' HE3' ' CZ3' ' A' ' 51' ' ' TRP . 16.3 ptpt -59.74 -30.52 68.89 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 177.871 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm -66.83 -44.9 79.91 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.814 0.846 . . . . 0.0 112.867 177.037 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 6.9 ptp180 -75.17 -19.6 59.77 Favored 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 172.817 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 46.3 mt -70.76 -51.55 26.41 Favored 'General case' 0 CA--C 1.543 0.673 0 CA-C-N 119.152 0.887 . . . . 0.0 111.328 167.051 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -71.46 -41.53 69.29 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 113.461 0.912 . . . . 0.0 113.461 -176.315 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -86.34 110.75 19.89 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 169.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 46.2 t30 -48.79 115.63 1.33 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.54 1.136 . . . . 0.0 112.915 -175.178 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 54.7 t80 -137.0 -26.76 1.02 Allowed 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 114.365 1.246 . . . . 0.0 114.365 -172.501 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -138.56 170.79 15.38 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.801 1.24 . . . . 0.0 112.708 178.196 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 8.8 t-105 -99.92 -21.45 15.67 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.136 1.375 . . . . 0.0 112.657 -176.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.7 p -141.42 148.29 39.32 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.452 1.501 . . . . 0.0 113.105 -169.53 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -72.19 -17.18 61.95 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 115.221 1.563 . . . . 0.0 115.221 -176.359 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 5.7 p -52.88 -37.03 60.02 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.033 0.933 . . . . 0.0 113.004 174.817 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -67.45 -43.72 80.4 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.705 -0.622 . . . . 0.0 112.474 178.501 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 45.4 t -60.17 -40.77 91.1 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.119 0.968 . . . . 0.0 112.617 170.48 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 83.9 mtp -62.35 -42.61 99.53 Favored 'General case' 0 N--CA 1.473 0.679 0 O-C-N 121.303 -0.873 . . . . 0.0 112.579 176.136 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 58.0 mm-40 -66.45 -32.99 74.7 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 173.424 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -66.46 -41.27 89.33 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 120.736 -1.227 . . . . 0.0 111.922 171.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -60.67 -45.49 93.95 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.264 -0.898 . . . . 0.0 112.47 170.859 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.91 -42.62 94.3 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.434 -0.791 . . . . 0.0 110.924 173.857 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 88.0 m -60.26 -40.23 89.59 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.976 0.91 . . . . 0.0 111.883 178.312 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 17.2 ttm -57.31 -59.61 4.87 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 119.001 0.819 . . . . 0.0 111.534 173.456 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -64.17 -43.46 95.08 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -176.431 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 97.5 m -63.71 -47.44 81.13 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.973 0.909 . . . . 0.0 112.054 179.025 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -64.2 -34.25 77.66 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-N 119.711 1.142 . . . . 0.0 112.224 -179.079 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 24.6 m -58.4 -43.8 88.71 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 113.232 0.827 . . . . 0.0 113.232 170.147 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 14.9 m-85 -68.45 -29.1 67.67 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.861 1.06 . . . . 0.0 113.861 178.861 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 86.8 mt -70.08 -56.57 10.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 123.27 0.628 . . . . 0.0 110.647 176.573 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' TYR . . . . . 0.574 ' HB2' HD11 ' A' ' 77' ' ' ILE . 33.7 t80 -69.33 -35.3 75.78 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 114.371 1.248 . . . . 0.0 114.371 -173.572 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 55.6 m-80 -105.58 154.96 19.68 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.25 1.02 . . . . 0.0 111.535 -172.423 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 53.3 mttm -68.3 151.58 97.12 Favored Pre-proline 0 N--CA 1.471 0.577 0 C-N-CA 123.988 0.915 . . . . 0.0 111.037 175.383 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -65.24 -1.03 3.97 Favored 'Trans proline' 0 CA--C 1.547 1.168 0 C-N-CA 123.601 2.868 . . . . 0.0 114.763 -179.238 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 52.0 p -117.67 -2.41 11.43 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 127.123 2.169 . . . . 0.0 113.151 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 -69.31 144.38 53.55 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 118.966 0.803 . . . . 0.0 110.648 171.106 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -56.29 -46.27 79.83 Favored 'General case' 0 N--CA 1.471 0.616 0 O-C-N 121.649 -0.657 . . . . 0.0 112.514 -175.728 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.4 tp -54.42 -30.29 21.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 125.118 1.367 . . . . 0.0 114.209 177.6 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 45.5 t -72.81 -47.18 50.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 O-C-N 121.422 -0.798 . . . . 0.0 110.555 174.015 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 71.8 mt -61.46 -37.08 82.27 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 118.93 0.786 . . . . 0.0 111.599 176.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 7.7 mtt -59.01 -51.91 68.01 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.921 1.288 . . . . 0.0 111.971 169.835 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.28 -39.65 87.63 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.353 0.661 . . . . 0.0 112.72 176.713 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 89.3 mt-30 -62.41 -45.36 93.45 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 119.24 0.927 . . . . 0.0 111.902 174.663 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -67.41 -29.69 69.26 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.246 1.018 . . . . 0.0 113.615 179.149 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 81.5 mt -76.14 -48.52 20.3 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.832 0.853 . . . . 0.0 111.49 169.716 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -62.05 -37.81 86.39 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 113.376 0.88 . . . . 0.0 113.376 -173.546 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 59.5 pttt -58.9 -44.21 91.15 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 121.593 -0.692 . . . . 0.0 111.679 176.171 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 65.9 mt -70.99 -39.97 75.71 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 124.413 1.085 . . . . 0.0 110.91 176.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -51.11 -49.5 60.64 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.903 1.229 . . . . 0.0 110.808 171.43 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.7 mt -63.9 -39.68 94.75 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 176.762 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -57.3 -41.09 79.17 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-N 119.688 1.131 . . . . 0.0 112.652 172.184 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 36.7 mmtm -75.69 -48.83 20.32 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.961 1.304 . . . . 0.0 111.786 -175.309 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.8 m -68.78 -25.96 31.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 CA-C-N 120.121 1.328 . . . . 0.0 112.218 176.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -61.59 -28.3 69.25 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 121.495 -0.753 . . . . 0.0 112.449 171.475 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -96.51 1.73 51.73 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.399 1.48 . . . . 0.0 112.687 177.696 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 8.9 ttm -54.28 141.53 51.71 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 124.951 1.3 . . . . 0.0 112.482 174.539 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -67.6 114.84 3.44 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 123.076 2.517 . . . . 0.0 109.233 168.556 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -71.44 -20.58 62.08 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 -169.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -84.41 160.24 20.65 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.74 1.616 . . . . 0.0 112.056 177.149 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -116.43 133.07 56.44 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.116 1.367 . . . . 0.0 110.986 178.04 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 13.0 p -149.28 142.94 18.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 C-N-CA 124.848 1.259 . . . . 0.0 111.286 173.027 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -70.77 137.75 49.86 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.656 1.182 . . . . 0.0 111.636 176.066 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 95.9 mt -79.19 152.53 30.63 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 114.058 1.133 . . . . 0.0 114.058 -175.854 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 4.4 pp -76.79 154.98 83.3 Favored Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 124.715 1.206 . . . . 0.0 110.875 168.032 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.94 142.23 24.87 Favored 'Trans proline' 0 CA--C 1.547 1.136 0 C-N-CA 122.889 2.393 . . . . 0.0 112.207 -177.497 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -73.44 161.47 42.4 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 123.389 2.726 . . . . 0.0 112.669 178.592 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -65.98 153.13 92.29 Favored Pre-proline 0 CA--C 1.553 1.066 0 C-N-CA 124.097 0.959 . . . . 0.0 112.446 173.205 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -77.38 36.94 0.57 Allowed 'Trans proline' 0 CA--C 1.551 1.363 0 C-N-CA 124.949 3.766 . . . . 0.0 113.21 177.021 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -58.14 128.12 35.52 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.657 1.583 . . . . 0.0 111.519 -177.389 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . 78.65 -41.85 2.17 Favored Glycine 0 CA--C 1.539 1.538 0 C-N-CA 125.585 1.564 . . . . 0.0 115.115 176.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 64.6 tttm . . . . . 0 C--O 1.252 1.231 0 C-N-CA 126.085 1.754 . . . . 0.0 111.723 178.716 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.45 0 N-CA-C 110.718 -0.953 . . . . 0.0 110.718 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 20.9 m -145.91 36.92 1.05 Allowed 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 124.836 1.254 . . . . 0.0 112.37 -170.71 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.6 t -139.36 178.9 6.86 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 125.088 1.355 . . . . 0.0 112.885 -173.762 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -166.67 -166.42 25.71 Favored Glycine 0 CA--C 1.535 1.338 0 C-N-CA 125.923 1.725 . . . . 0.0 113.276 -173.864 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 82.9 p -145.48 168.64 20.07 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 124.98 1.312 . . . . 0.0 113.428 -173.695 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.4 t -67.71 164.67 18.85 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.034 1.334 . . . . 0.0 113.391 179.71 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 159.4 -0.24 0.08 OUTLIER Glycine 0 CA--C 1.538 1.486 0 N-CA-C 116.868 1.507 . . . . 0.0 116.868 175.556 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -61.64 140.35 58.17 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 119.26 1.53 . . . . 0.0 114.089 -177.756 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 29.8 m -148.46 -27.57 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.438 0 C-N-CA 125.768 1.627 . . . . 0.0 114.452 179.269 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 49.9 m -146.53 130.16 16.96 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.267 1.427 . . . . 0.0 111.549 -177.428 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 58.3 t30 -159.35 124.86 2.3 Favored Pre-proline 0 CA--C 1.546 0.8 0 C-N-CA 125.558 1.543 . . . . 0.0 109.606 176.812 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -75.16 -170.44 0.79 Allowed 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 123.706 2.937 . . . . 0.0 110.658 171.544 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 31.9 m 51.9 22.17 1.68 Allowed 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 126.621 1.969 . . . . 0.0 115.13 -173.386 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 28.0 ttpp -139.41 131.39 15.1 Favored Pre-proline 0 N--CA 1.476 0.841 0 C-N-CA 126.688 1.995 . . . . 0.0 110.423 -175.16 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_endo -75.35 156.56 41.45 Favored 'Trans proline' 0 CA--C 1.539 0.751 0 C-N-CA 123.078 2.519 . . . . 0.0 113.496 -174.308 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 174.45 166.33 32.29 Favored Glycine 0 CA--C 1.533 1.207 0 C-N-CA 126.329 1.919 . . . . 0.0 111.753 174.066 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 34.9 ptt180 -162.83 161.2 25.92 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.918 1.687 . . . . 0.0 110.693 179.317 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.589 ' HB3' HD12 ' A' ' 147' ' ' LEU . 46.6 mttp -76.93 141.23 40.57 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 121.398 0.618 . . . . 0.0 110.425 167.516 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 81.0 p -141.04 164.16 31.02 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 125.585 1.554 . . . . 0.0 110.004 176.904 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -52.68 -30.97 34.82 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 170.631 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.4 mm-40 -67.9 -54.74 16.45 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.884 0.874 . . . . 0.0 111.188 177.144 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.3 mt -65.03 -32.88 74.82 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 121.489 -0.757 . . . . 0.0 112.52 176.326 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.515 ' HB2' HD11 ' A' ' 147' ' ' LEU . 53.4 tt0 -57.16 -52.81 63.8 Favored 'General case' 0 C--O 1.224 -0.26 0 C-N-CA 123.977 0.911 . . . . 0.0 110.92 170.065 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -60.21 -41.18 92.49 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.453 0.701 . . . . 0.0 112.596 179.197 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 93.9 mmm -55.85 -48.35 75.67 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 121.747 -0.595 . . . . 0.0 111.794 171.725 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -86.42 -5.57 59.13 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 115.114 1.524 . . . . 0.0 115.114 -175.739 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 30.6 m-20 -117.0 -18.36 10.12 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 125.157 1.383 . . . . 0.0 113.481 -176.117 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 46.9 t -133.85 -50.66 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 123.934 0.894 . . . . 0.0 111.686 179.602 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.0 t -71.54 -67.48 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-N 119.407 1.003 . . . . 0.0 110.802 -171.468 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 59.1 t -57.61 -41.85 80.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 123.655 0.782 . . . . 0.0 109.965 171.805 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.74 -45.02 86.44 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 118.87 0.759 . . . . 0.0 113.005 -177.604 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 62.4 m -71.76 -44.46 64.0 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 122.925 0.49 . . . . 0.0 111.364 176.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 66.6 mt -62.0 -32.49 72.97 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.572 0.749 . . . . 0.0 112.277 178.145 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 16.9 t-105 -73.17 -29.53 62.92 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.022 1.729 . . . . 0.0 112.955 176.066 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 56.5 mtmt -84.25 -5.28 59.24 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.256 1.022 . . . . 0.0 113.462 176.568 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 37.3 t-80 -65.02 156.18 32.23 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.695 1.198 . . . . 0.0 113.564 -178.439 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 18.4 tp60 -58.74 -20.82 52.62 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.604 1.562 . . . . 0.0 114.057 174.49 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -125.12 19.97 8.26 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.399 1.479 . . . . 0.0 113.791 -174.44 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.3 -30.01 65.73 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 177.736 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' TRP . . . . . 0.446 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 39.4 p-90 -54.57 -37.84 59.34 Favored Pre-proline 0 CA--C 1.547 0.863 0 N-CA-C 117.094 2.257 . . . . 0.0 117.094 -172.517 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.446 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 56.9 Cg_endo -67.99 -7.28 19.29 Favored 'Trans proline' 0 C--N 1.354 0.866 0 CA-C-N 122.959 2.092 . . . . 0.0 115.012 172.785 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 72.7 m-85 -114.5 -1.45 13.43 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.132 1.373 . . . . 0.0 113.284 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 20.1 m-30 -65.18 -22.53 66.92 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 113.458 0.91 . . . . 0.0 113.458 176.212 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -138.4 155.46 73.89 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 126.515 1.926 . . . . 0.0 110.005 -176.386 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -67.24 147.63 78.95 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 122.571 2.18 . . . . 0.0 112.4 178.828 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 76.6 t -59.75 142.34 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 123.903 0.881 . . . . 0.0 111.258 170.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -122.97 101.24 7.31 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 125.689 1.596 . . . . 0.0 109.497 171.746 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.27 -27.23 61.91 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 -179.26 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 84.3 mt -64.81 -49.61 79.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 124.855 1.262 . . . . 0.0 110.846 172.677 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -68.36 -42.31 79.37 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.97 1.308 . . . . 0.0 112.788 -178.526 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.4 mp -80.74 -4.32 54.04 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.358 1.063 . . . . 0.0 113.329 176.889 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 61.7 t30 55.02 56.28 6.76 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 126.266 1.826 . . . . 0.0 113.501 -179.499 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 51.5 mt -115.28 84.05 11.04 Favored Pre-proline 0 CA--C 1.545 0.77 0 C-N-CA 126.312 1.845 . . . . 0.0 110.741 -175.436 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -68.3 -3.88 11.71 Favored 'Trans proline' 0 CA--C 1.544 1.009 0 C-N-CA 123.945 3.097 . . . . 0.0 114.633 -174.368 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -131.24 14.78 5.11 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 126.051 1.74 . . . . 0.0 112.528 -178.681 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 40.9 t80 -51.13 -55.05 19.75 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 120.729 -1.232 . . . . 0.0 113.364 -173.212 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -79.44 -9.44 59.6 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.346 1.059 . . . . 0.0 113.854 178.894 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -70.65 -47.27 60.88 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.006 0.922 . . . . 0.0 110.337 177.325 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.9 mp -77.11 -50.39 20.85 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 C-N-CA 124.137 0.975 . . . . 0.0 109.84 172.096 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 40.9 mm -91.4 103.04 14.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 CA-C-O 122.48 1.134 . . . . 0.0 112.097 -171.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt -68.06 -32.26 72.48 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.936 1.694 . . . . 0.0 113.487 179.641 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -147.59 91.67 4.94 Favored Pre-proline 0 CA--C 1.545 0.761 0 C-N-CA 125.715 1.606 . . . . 0.0 110.209 -178.044 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -78.76 159.61 27.97 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 123.499 2.799 . . . . 0.0 111.356 174.522 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 40.8 mmm -147.05 160.87 41.88 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.522 1.129 . . . . 0.0 112.751 168.585 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -146.81 146.79 30.36 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 127.099 2.159 . . . . 0.0 110.228 175.912 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.2 ttp -61.84 -35.19 77.55 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.163 0.985 . . . . 0.0 113.63 -170.362 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -57.87 -42.4 94.65 Favored Glycine 0 CA--C 1.531 1.075 0 C-N-CA 123.831 0.729 . . . . 0.0 113.219 177.448 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 19.7 m -67.13 -41.58 85.9 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.826 0.85 . . . . 0.0 111.602 176.147 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 95.0 mt -60.02 -52.06 65.58 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 124.257 1.023 . . . . 0.0 110.493 177.444 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 25.2 ttpp -57.75 -37.4 73.56 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 125.417 1.487 . . . . 0.0 112.888 176.391 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 34.0 ttmt -62.69 -41.88 99.34 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 113.458 0.91 . . . . 0.0 113.458 178.613 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -74.03 -27.09 60.77 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 114.537 1.31 . . . . 0.0 114.537 172.777 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 62.5 mt -61.8 -48.62 79.78 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 118.675 0.67 . . . . 0.0 111.29 168.711 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -59.29 -42.01 90.28 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.054 0.942 . . . . 0.0 111.977 176.478 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 -83.51 2.56 36.34 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 125.086 1.354 . . . . 0.0 113.987 179.371 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 34.86 56.72 0.74 Allowed 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 127.579 2.352 . . . . 0.0 115.091 -171.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 71.2 t80 -58.83 -24.37 61.91 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 127.358 2.263 . . . . 0.0 114.948 -176.757 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -133.22 -175.48 3.81 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 129.043 2.937 . . . . 0.0 111.568 -169.852 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 14.4 t-105 -110.45 -27.45 9.01 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.382 1.073 . . . . 0.0 113.142 -171.511 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 16.9 m -145.95 151.69 38.22 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.724 1.21 . . . . 0.0 112.703 -171.898 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -66.0 -21.23 66.39 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 116.502 2.038 . . . . 0.0 116.502 -172.711 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 47.0 t -53.85 -36.7 62.88 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 119.282 0.946 . . . . 0.0 112.552 178.843 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -65.86 -44.78 84.39 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 121.088 -1.008 . . . . 0.0 112.015 179.087 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 53.1 t -57.92 -41.91 83.68 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.088 0.955 . . . . 0.0 112.37 171.123 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 79.9 mtp -61.86 -40.33 94.99 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.999 0.92 . . . . 0.0 112.975 175.83 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 65.0 mt-30 -62.57 -37.32 85.72 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.093 0.957 . . . . 0.0 112.682 175.269 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -71.96 -33.91 68.55 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.0 -1.063 . . . . 0.0 113.281 174.543 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -64.25 -45.0 90.07 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 119.346 0.975 . . . . 0.0 112.212 169.538 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 24.1 t30 -56.27 -42.12 76.95 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.866 -0.521 . . . . 0.0 111.534 171.502 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 60.4 m -64.98 -39.57 93.68 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.128 0.971 . . . . 0.0 112.491 176.357 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 21.1 ttm -58.98 -61.09 2.9 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.941 0.897 . . . . 0.0 111.352 174.742 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -62.91 -39.79 95.63 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 -176.351 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 90.5 m -65.11 -47.33 77.53 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.195 0.598 . . . . 0.0 112.07 178.424 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -64.71 -32.53 74.25 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 119.615 1.098 . . . . 0.0 112.549 -179.227 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 55.9 m -59.8 -45.15 93.2 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.717 0.807 . . . . 0.0 112.543 169.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 14.3 m-85 -67.84 -32.55 73.15 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 177.826 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 85.6 mt -69.41 -58.19 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 123.576 0.75 . . . . 0.0 111.05 176.963 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 43.2 t80 -68.31 -34.61 76.45 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 114.246 1.202 . . . . 0.0 114.246 -170.874 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 60.5 m-80 -101.03 164.7 11.68 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.51 1.124 . . . . 0.0 111.987 -173.375 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -72.61 150.84 91.32 Favored Pre-proline 0 N--CA 1.476 0.836 0 O-C-N 121.368 -0.833 . . . . 0.0 109.921 170.25 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -66.08 -1.65 5.62 Favored 'Trans proline' 0 CA--C 1.546 1.108 0 C-N-CA 123.393 2.728 . . . . 0.0 114.68 -178.493 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 50.7 p -118.24 -1.34 11.35 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.994 2.118 . . . . 0.0 113.113 -179.056 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 54.4 m-20 -67.46 145.9 54.53 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.535 -0.728 . . . . 0.0 110.822 170.618 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -56.22 -46.69 79.4 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.619 -0.675 . . . . 0.0 112.406 -176.068 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.5 tp -54.73 -29.13 20.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 125.227 1.411 . . . . 0.0 114.442 177.855 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 38.6 t -73.17 -45.57 53.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 O-C-N 121.281 -0.887 . . . . 0.0 110.517 173.631 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 73.5 mt -63.31 -36.87 85.12 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 118.977 0.808 . . . . 0.0 111.405 176.689 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 7.6 mtt -59.17 -52.11 67.12 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.019 1.328 . . . . 0.0 111.648 169.541 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.54 -38.8 85.64 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.483 0.713 . . . . 0.0 112.707 176.827 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -62.74 -49.41 75.15 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.955 0.798 . . . . 0.0 112.146 174.049 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -61.25 -39.51 90.62 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.493 0.717 . . . . 0.0 112.295 179.595 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 80.5 mt -66.08 -48.42 71.02 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.487 0.715 . . . . 0.0 111.872 170.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -62.27 -39.72 93.85 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 120.78 -1.2 . . . . 0.0 113.53 -175.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 14.2 mttm -60.02 -29.33 68.42 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.672 0.789 . . . . 0.0 112.595 174.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 59.4 mt -86.61 -39.98 13.79 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 C-N-CA 123.615 0.766 . . . . 0.0 112.055 174.134 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 35.6 t80 -50.43 -53.17 31.49 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.366 0.985 . . . . 0.0 110.455 172.899 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.2 mt -62.97 -40.24 97.1 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 112.951 0.723 . . . . 0.0 112.951 -179.869 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.5 pt20 -71.33 -29.67 65.28 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 119.694 1.134 . . . . 0.0 112.847 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -75.69 -48.44 21.97 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 117.638 -1.173 . . . . 0.0 112.439 174.704 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 6.1 m -66.97 -26.28 36.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 CA-C-N 121.031 1.741 . . . . 0.0 112.075 177.033 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -60.64 -29.99 69.6 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 172.139 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -89.99 -6.25 55.83 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 124.712 1.205 . . . . 0.0 112.838 175.648 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 39.7 ttp -63.77 139.45 97.63 Favored Pre-proline 0 CA--C 1.547 0.847 0 O-C-N 121.251 -0.906 . . . . 0.0 110.278 170.834 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -63.75 154.62 68.34 Favored 'Trans proline' 0 CA--C 1.538 0.699 0 C-N-CA 122.758 2.305 . . . . 0.0 111.907 175.832 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 20.1 mm100 -84.54 -18.07 36.89 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 176.055 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -96.35 155.22 16.86 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.357 1.463 . . . . 0.0 112.934 -179.441 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -122.32 138.25 54.57 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.652 1.181 . . . . 0.0 111.065 -175.58 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 9.7 p -145.16 140.08 22.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 C-N-CA 125.289 1.436 . . . . 0.0 110.672 176.121 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -70.24 135.78 49.32 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.67 1.188 . . . . 0.0 111.354 176.385 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 147' ' ' LEU . . . . . 0.589 HD12 ' HB3' ' A' ' 35' ' ' LYS . 84.1 mt -72.25 132.27 43.85 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 -173.04 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 4.4 pp -67.5 154.63 92.78 Favored Pre-proline 0 CA--C 1.551 0.997 0 C-N-CA 124.687 1.195 . . . . 0.0 111.08 169.044 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -72.17 140.95 35.1 Favored 'Trans proline' 0 CA--C 1.544 0.979 0 C-N-CA 122.578 2.185 . . . . 0.0 111.922 -175.196 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -72.13 159.99 48.48 Favored 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 123.225 2.617 . . . . 0.0 112.774 -178.381 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -66.41 153.78 92.12 Favored Pre-proline 0 CA--C 1.552 1.056 0 C-N-CA 124.205 1.002 . . . . 0.0 112.619 174.244 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -70.25 168.92 20.81 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 123.431 2.754 . . . . 0.0 112.301 172.353 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 14.9 ptmm? -143.74 157.5 44.34 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.136 1.374 . . . . 0.0 112.82 -178.692 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . 165.8 174.59 35.46 Favored Glycine 0 CA--C 1.537 1.423 0 C-N-CA 125.548 1.547 . . . . 0.0 112.937 179.694 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 19.8 ptpt . . . . . 0 C--O 1.252 1.221 0 C-N-CA 124.754 1.222 . . . . 0.0 113.612 173.722 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.525 0 N-CA-C 111.51 -0.636 . . . . 0.0 111.51 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 33.6 t -63.8 145.33 55.99 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.923 0.889 . . . . 0.0 113.098 178.794 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 67.7 p -72.79 172.72 10.26 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.177 0.991 . . . . 0.0 110.341 166.329 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 73.75 21.83 78.9 Favored Glycine 0 CA--C 1.535 1.331 0 O-C-N 121.512 -0.743 . . . . 0.0 114.673 177.606 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 8.1 t -58.06 -19.05 28.81 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.263 1.425 . . . . 0.0 113.763 177.356 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 64.8 p -57.78 -26.84 62.47 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.874 1.669 . . . . 0.0 114.219 169.599 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 57.57 28.37 59.67 Favored Glycine 0 CA--C 1.538 1.492 0 C-N-CA 124.478 1.037 . . . . 0.0 113.835 -172.399 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -62.22 151.48 36.05 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 -169.797 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 20.9 m -137.42 -4.57 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 C-N-CA 125.8 1.64 . . . . 0.0 113.944 -170.896 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 43.3 p -149.12 140.44 23.21 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 126.236 1.814 . . . . 0.0 110.302 179.001 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.444 ' HB2' ' HE3' ' A' ' 31' ' ' LYS . 51.4 p30 -144.94 74.14 14.63 Favored Pre-proline 0 CA--C 1.551 0.995 0 N-CA-C 115.704 1.742 . . . . 0.0 115.704 -168.647 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -61.12 -14.79 35.55 Favored 'Trans proline' 0 CA--C 1.549 1.226 0 C-N-CA 123.196 2.597 . . . . 0.0 114.607 176.611 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.0 t -85.64 -4.81 59.27 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.634 1.573 . . . . 0.0 114.256 174.41 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.444 ' HE3' ' HB2' ' A' ' 28' ' ' ASN . 38.4 mtmt -129.2 155.84 79.27 Favored Pre-proline 0 N--CA 1.48 1.06 0 C-N-CA 126.385 1.874 . . . . 0.0 111.584 -175.774 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -73.27 153.2 50.87 Favored 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 122.94 2.427 . . . . 0.0 112.691 178.739 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 163.62 161.08 12.26 Favored Glycine 0 CA--C 1.533 1.191 0 C-N-CA 124.828 1.204 . . . . 0.0 113.367 175.642 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.5 ptt180 -158.4 152.46 23.93 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 126.55 1.94 . . . . 0.0 109.858 168.583 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 26.2 ttpt -82.63 141.64 32.36 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 121.455 0.645 . . . . 0.0 111.127 174.84 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 59.3 p -135.74 166.63 22.81 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 125.562 1.545 . . . . 0.0 111.143 -169.24 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 27.3 p-10 -47.54 -38.34 13.95 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.288 1.035 . . . . 0.0 113.767 172.604 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 15.0 tt0 -72.72 -42.12 64.49 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.424 1.09 . . . . 0.0 112.323 -179.344 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 73.3 mt -67.18 -31.65 72.2 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.566 0.746 . . . . 0.0 112.137 171.262 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -60.96 -48.46 81.7 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 118.539 0.609 . . . . 0.0 110.413 169.551 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -55.76 -41.07 73.44 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.466 0.706 . . . . 0.0 112.415 177.417 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 90.3 mmm -57.0 -52.87 63.55 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 119.004 -0.522 . . . . 0.0 112.401 172.468 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -77.87 -17.26 57.55 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 114.772 1.397 . . . . 0.0 114.772 -178.304 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -106.27 -22.35 12.85 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.002 0.921 . . . . 0.0 113.317 -169.122 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 33.7 t -127.96 -51.68 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 C-N-CA 123.234 0.614 . . . . 0.0 111.207 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.7 t -67.72 -62.34 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.206 0.602 . . . . 0.0 110.566 -174.431 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 55.6 t -57.19 -50.62 76.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 124.375 1.07 . . . . 0.0 110.222 173.138 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm -57.03 -43.49 81.98 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 118.658 0.663 . . . . 0.0 112.407 -174.261 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 56.4 m -69.4 -47.62 63.6 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 117.956 0.344 . . . . 0.0 111.901 176.576 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 70.9 mt -61.43 -33.85 74.41 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.43 0.692 . . . . 0.0 112.313 178.806 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' TRP . . . . . 0.445 ' CZ3' ' HE3' ' A' ' 87' ' ' LYS . 22.2 t-105 -70.07 -29.64 66.69 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.828 1.651 . . . . 0.0 113.413 176.218 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.4 mtmp? -82.7 -7.1 59.67 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.012 0.925 . . . . 0.0 113.403 177.761 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 41.0 t-80 -64.76 152.86 41.53 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.707 1.203 . . . . 0.0 113.018 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 26.8 mp0 -60.85 -19.29 59.73 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.578 1.551 . . . . 0.0 113.948 175.781 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -119.78 15.24 12.64 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.56 1.544 . . . . 0.0 113.672 -175.162 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.93 -26.21 63.09 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.184 1.394 . . . . 0.0 114.345 178.245 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 68.1 p-90 -57.54 -33.89 21.62 Favored Pre-proline 0 CA--C 1.549 0.938 0 N-CA-C 117.967 2.58 . . . . 0.0 117.967 -170.694 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -77.24 -1.28 11.44 Favored 'Trans proline' 0 CA--C 1.543 0.972 0 CA-C-N 123.437 2.263 . . . . 0.0 113.281 174.755 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 88.4 m-85 -112.03 -4.87 14.37 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.576 1.55 . . . . 0.0 113.411 179.372 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -65.02 -14.76 61.22 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 176.4 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 69.8 mt-30 -142.91 157.7 60.68 Favored Pre-proline 0 CA--C 1.547 0.861 0 C-N-CA 126.252 1.821 . . . . 0.0 111.069 -176.394 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -65.65 157.06 60.58 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 123.336 2.691 . . . . 0.0 113.309 176.082 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 21.8 t -77.09 85.8 0.84 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 125.085 1.354 . . . . 0.0 110.015 178.511 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -71.31 86.11 0.8 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.025 1.33 . . . . 0.0 111.303 177.394 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.37 -27.88 26.23 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 124.893 1.277 . . . . 0.0 114.395 -178.492 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 82.0 mt -65.77 -49.96 73.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 124.831 1.252 . . . . 0.0 111.109 173.664 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 85.5 mttt -67.3 -40.37 86.03 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.932 1.293 . . . . 0.0 112.4 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.9 mp -82.65 -3.59 56.51 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.869 1.667 . . . . 0.0 112.7 -179.44 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 51.76 56.35 7.97 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.977 1.711 . . . . 0.0 113.123 -178.258 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 28.0 mt -112.76 81.87 4.66 Favored Pre-proline 0 CA--C 1.545 0.751 0 C-N-CA 126.179 1.792 . . . . 0.0 109.926 179.221 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -67.38 -7.82 20.25 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 124.026 3.151 . . . . 0.0 114.827 -170.095 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -132.17 17.49 4.54 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.926 1.691 . . . . 0.0 112.515 -179.156 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -48.12 -51.99 22.38 Favored 'General case' 0 N--CA 1.477 0.911 0 O-C-N 120.86 -1.15 . . . . 0.0 112.985 -175.855 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -76.19 -6.14 49.95 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.633 1.573 . . . . 0.0 114.496 -179.454 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.4 mmmp? -84.4 -37.04 21.97 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.979 0.912 . . . . 0.0 111.269 174.757 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.3 mp -81.31 -48.1 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 124.087 0.955 . . . . 0.0 110.099 171.624 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 22.0 mm -86.8 111.67 21.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 123.824 0.85 . . . . 0.0 111.596 -176.518 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 29.6 mmmt -63.14 -32.66 74.1 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.488 1.515 . . . . 0.0 112.878 175.262 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 21.7 p-10 -157.3 96.81 2.04 Favored Pre-proline 0 CA--C 1.551 0.992 0 C-N-CA 126.089 1.756 . . . . 0.0 111.904 -169.695 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -77.32 149.39 27.78 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 123.557 2.838 . . . . 0.0 111.763 176.791 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 6.7 tpt -158.42 150.33 21.47 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.663 1.185 . . . . 0.0 111.864 179.358 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -150.21 155.21 39.33 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 126.079 1.751 . . . . 0.0 112.172 -178.512 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.9 ttp -65.24 -33.68 76.57 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 113.45 0.908 . . . . 0.0 113.45 -174.696 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.93 -44.41 98.17 Favored Glycine 0 CA--C 1.531 1.094 0 C-N-CA 124.594 1.093 . . . . 0.0 112.909 175.242 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 65.0 m -67.2 -42.98 83.25 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 118.382 -0.818 . . . . 0.0 111.597 172.093 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 76.2 mt -52.84 -53.85 19.23 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 CA-C-N 119.801 1.182 . . . . 0.0 111.667 178.15 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.445 ' HE3' ' CZ3' ' A' ' 51' ' ' TRP . 16.0 ptpt -59.95 -29.18 68.23 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 113.891 1.071 . . . . 0.0 113.891 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.6 tpmt? -69.96 -45.59 67.07 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.421 1.089 . . . . 0.0 112.453 177.343 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 5.4 ptp180 -73.07 -27.09 61.53 Favored 'General case' 0 N--CA 1.481 1.095 0 N-CA-C 113.874 1.065 . . . . 0.0 113.874 174.116 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 33.2 mt -67.91 -43.19 79.8 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 113.161 0.8 . . . . 0.0 113.161 168.563 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -64.67 -46.58 81.81 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 119.006 0.821 . . . . 0.0 112.305 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 64.2 m-80 -75.08 173.91 10.11 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.409 1.484 . . . . 0.0 112.337 174.117 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 60.4 t-20 -87.11 114.17 23.49 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 121.364 -0.835 . . . . 0.0 109.01 168.15 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -137.09 -33.77 0.75 Allowed 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.363 1.065 . . . . 0.0 113.676 179.019 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -139.45 164.84 28.8 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.765 1.626 . . . . 0.0 111.824 177.416 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 5.6 t-105 -91.63 -22.56 20.22 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.736 1.214 . . . . 0.0 112.829 -179.734 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 7.5 t -143.9 149.01 36.22 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.561 1.144 . . . . 0.0 113.285 -169.353 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -70.96 -18.59 62.62 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 115.764 1.764 . . . . 0.0 115.764 -172.103 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 11.4 t -60.51 -25.72 66.31 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.403 1.002 . . . . 0.0 113.004 178.491 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -67.08 -42.25 84.98 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 121.31 -0.869 . . . . 0.0 111.87 173.068 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 42.3 t -65.1 -35.4 81.03 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.819 0.847 . . . . 0.0 112.248 172.556 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 80.8 mtp -63.69 -41.43 98.13 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 121.453 -0.78 . . . . 0.0 112.003 173.924 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -62.17 -39.36 92.39 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 171.373 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 92.4 m-20 -65.0 -42.19 94.7 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 119.414 1.007 . . . . 0.0 112.303 175.454 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -61.33 -45.79 92.98 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 121.236 -0.915 . . . . 0.0 112.635 172.098 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 31.9 t30 -58.63 -41.11 85.18 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.653 -0.654 . . . . 0.0 111.752 173.878 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 85.6 m -66.01 -36.56 83.61 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.055 1.342 . . . . 0.0 112.672 178.737 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 17.3 ttm -58.67 -57.79 11.42 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.025 0.93 . . . . 0.0 111.365 174.179 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 19.3 m-85 -64.86 -38.18 90.11 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 122.831 0.452 . . . . 0.0 112.141 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 92.6 m -64.63 -48.09 76.14 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.502 0.721 . . . . 0.0 112.167 178.414 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -64.23 -30.14 71.21 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 119.785 1.175 . . . . 0.0 112.578 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 98.8 m -61.39 -43.68 98.45 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.356 0.663 . . . . 0.0 112.66 170.052 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 -68.3 -32.26 72.27 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 177.773 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 73.5 mt -73.24 -57.51 6.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 123.214 0.606 . . . . 0.0 111.091 179.86 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -68.59 -27.18 65.82 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 114.111 1.152 . . . . 0.0 114.111 -172.242 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 -113.74 164.61 13.49 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.479 1.112 . . . . 0.0 112.506 -171.373 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -71.06 146.02 92.16 Favored Pre-proline 0 N--CA 1.474 0.741 0 C-N-CA 123.918 0.887 . . . . 0.0 110.513 175.629 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -66.87 -5.25 12.89 Favored 'Trans proline' 0 CA--C 1.543 0.97 0 C-N-CA 123.839 3.026 . . . . 0.0 114.659 -176.14 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 45.3 p -112.98 -3.55 14.03 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 126.999 2.12 . . . . 0.0 113.169 -179.652 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 37.1 t0 -68.91 152.38 45.35 Favored 'General case' 0 CA--C 1.542 0.658 0 O-C-N 121.462 -0.774 . . . . 0.0 111.319 174.099 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -54.65 -48.28 72.49 Favored 'General case' 0 N--CA 1.47 0.546 0 O-C-N 121.625 -0.672 . . . . 0.0 111.927 -179.085 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.5 tp -55.94 -31.98 31.9 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 -177.011 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 49.0 t -71.05 -51.21 36.89 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 C-N-CA 123.362 0.665 . . . . 0.0 110.647 173.406 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 75.5 mt -61.13 -37.46 82.92 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 119.082 0.856 . . . . 0.0 112.005 179.715 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 37.3 mtp -60.59 -49.52 77.21 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 126.183 1.793 . . . . 0.0 111.672 171.416 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -62.1 -39.61 93.07 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 175.043 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 90.6 mt-30 -61.88 -44.47 96.75 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 119.209 0.913 . . . . 0.0 111.98 175.465 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.62 -42.76 95.29 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.656 0.782 . . . . 0.0 112.785 176.851 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 85.3 mt -63.26 -44.89 93.84 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.282 0.633 . . . . 0.0 111.634 172.708 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -60.85 -41.43 95.86 Favored 'General case' 0 CA--C 1.538 0.483 0 O-C-N 121.145 -0.972 . . . . 0.0 112.744 -177.936 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 55.5 mtmt -60.06 -28.49 67.84 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 175.297 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 58.5 mt -84.9 -39.89 14.56 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 C-N-CA 123.481 0.712 . . . . 0.0 111.901 173.251 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -51.88 -51.34 57.49 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.134 -0.978 . . . . 0.0 110.554 172.034 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 99.3 mt -62.35 -40.88 97.84 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.596 0.758 . . . . 0.0 113.006 179.229 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -70.83 -28.4 64.59 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.663 1.119 . . . . 0.0 112.996 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 70.8 mmtt -76.14 -47.09 25.61 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 117.925 -1.036 . . . . 0.0 112.74 173.723 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 9.1 m -68.41 -24.92 30.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 CA-C-N 121.024 1.738 . . . . 0.0 112.187 176.024 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -60.19 -28.08 67.66 Favored 'General case' 0 CA--C 1.541 0.633 0 O-C-N 121.523 -0.736 . . . . 0.0 112.682 171.058 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 93.7 mt-30 -98.58 2.75 47.69 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.358 1.463 . . . . 0.0 112.769 177.709 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 8.1 ttm -53.45 141.76 42.48 Favored Pre-proline 0 CA--C 1.545 0.769 0 C-N-CA 124.863 1.265 . . . . 0.0 112.78 175.265 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -68.95 111.34 2.62 Favored 'Trans proline' 0 CA--C 1.537 0.666 0 C-N-CA 123.111 2.541 . . . . 0.0 109.02 168.729 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 -69.3 -22.1 63.82 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 -172.619 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -84.81 156.77 21.2 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.649 1.579 . . . . 0.0 111.662 175.355 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -131.09 128.84 41.01 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.739 1.216 . . . . 0.0 112.547 -168.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 7.7 p -150.46 146.0 16.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 125.134 1.374 . . . . 0.0 111.88 -178.521 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -63.22 140.66 58.9 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.008 1.323 . . . . 0.0 112.383 175.745 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 83.3 mt -77.09 153.54 34.22 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 114.202 1.186 . . . . 0.0 114.202 -177.633 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 95.3 mt -78.03 157.85 78.2 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 125.254 1.421 . . . . 0.0 111.899 169.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_endo -72.82 161.35 43.98 Favored 'Trans proline' 0 CA--C 1.548 1.224 0 C-N-CA 123.267 2.645 . . . . 0.0 112.725 177.074 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -69.81 162.73 40.97 Favored 'Trans proline' 0 CA--C 1.541 0.838 0 C-N-CA 123.591 2.86 . . . . 0.0 112.871 176.381 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -64.81 148.37 97.35 Favored Pre-proline 0 CA--C 1.553 1.063 0 C-N-CA 124.227 1.011 . . . . 0.0 113.433 -179.444 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo -77.27 71.3 6.41 Favored 'Trans proline' 0 CA--C 1.545 1.053 0 C-N-CA 124.908 3.739 . . . . 0.0 111.874 176.772 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 65.5 pttt -52.82 148.6 7.28 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 125.468 1.507 . . . . 0.0 113.992 -178.394 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . 134.8 -25.55 3.37 Favored Glycine 0 CA--C 1.536 1.37 0 C-N-CA 125.498 1.523 . . . . 0.0 114.296 174.946 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 4.3 mppt? . . . . . 0 C--O 1.253 1.261 0 C-N-CA 126.687 1.995 . . . . 0.0 110.948 178.779 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.41 0 N-CA-C 111.376 -0.69 . . . . 0.0 111.376 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 48.9 m -142.98 176.15 9.3 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 125.686 1.595 . . . . 0.0 111.839 -174.317 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 56.8 m -153.33 155.31 36.23 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.194 1.398 . . . . 0.0 111.494 172.398 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -68.84 158.3 53.01 Favored Glycine 0 CA--C 1.536 1.372 0 C-N-CA 123.927 0.775 . . . . 0.0 114.071 -178.765 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 89.4 p 40.49 42.04 1.22 Allowed 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 126.843 2.057 . . . . 0.0 115.22 -179.269 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.4 t -59.83 147.17 39.21 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.529 1.132 . . . . 0.0 112.639 -179.786 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 176.33 79.14 0.05 OUTLIER Glycine 0 CA--C 1.532 1.108 0 C-N-CA 124.485 1.04 . . . . 0.0 112.116 -172.437 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -55.99 155.64 6.11 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 114.209 1.189 . . . . 0.0 114.209 -178.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 19.5 m -127.0 -9.35 4.48 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.267 0 C-N-CA 124.547 1.139 . . . . 0.0 113.985 -170.643 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.3 t -154.18 147.19 24.54 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 125.304 1.442 . . . . 0.0 110.763 175.817 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -151.3 122.68 3.83 Favored Pre-proline 0 CA--C 1.548 0.871 0 C-N-CA 124.271 1.028 . . . . 0.0 110.778 -175.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_endo -81.48 -10.37 12.13 Favored 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 123.77 2.98 . . . . 0.0 114.365 -177.248 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.2 t -104.66 -41.27 5.73 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.649 1.18 . . . . 0.0 112.673 -172.699 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.6 ttpm? -68.02 131.64 92.25 Favored Pre-proline 0 CA--C 1.547 0.841 0 C-N-CA 124.043 0.937 . . . . 0.0 110.577 174.691 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -71.47 156.78 57.7 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 122.76 2.306 . . . . 0.0 113.041 -177.727 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 176.38 159.46 22.0 Favored Glycine 0 CA--C 1.533 1.164 0 C-N-CA 125.224 1.392 . . . . 0.0 112.621 178.389 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 36.0 ptt180 -144.86 154.43 42.63 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.198 1.399 . . . . 0.0 110.58 169.44 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.6 tptm -81.93 130.73 35.16 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.365 1.066 . . . . 0.0 110.279 177.438 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 65.3 p -135.24 165.22 25.93 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.972 1.309 . . . . 0.0 111.936 -169.459 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -50.31 -35.43 27.41 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 112.354 0.502 . . . . 0.0 112.354 174.617 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 14.2 mp0 -57.91 -65.1 0.69 Allowed 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.137 1.375 . . . . 0.0 111.263 173.601 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 76.1 mt -63.37 -32.71 74.21 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -175.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 -62.22 -54.65 37.81 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 118.473 0.578 . . . . 0.0 110.77 169.777 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 65.4 t80 -56.86 -38.26 72.46 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.881 0.872 . . . . 0.0 112.632 -179.657 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 86.1 mmm -55.07 -49.39 71.77 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 172.386 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -82.92 -18.03 41.57 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 120.385 1.448 . . . . 0.0 114.524 179.206 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 59.5 t30 -99.09 -24.56 14.85 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.77 1.228 . . . . 0.0 112.767 -170.405 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 39.9 t -130.38 -49.83 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 C-N-CA 123.945 0.898 . . . . 0.0 111.576 -179.035 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 17.1 t -72.17 -68.14 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 CA-C-N 118.943 0.792 . . . . 0.0 111.058 -170.667 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 60.4 t -58.54 -40.57 79.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 124.578 1.151 . . . . 0.0 110.199 172.702 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.4 tppt? -52.84 -51.03 62.49 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 118.837 0.744 . . . . 0.0 112.262 177.151 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 72.5 m -70.52 -43.42 69.64 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.191 0.596 . . . . 0.0 111.82 179.253 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 46.5 mt -63.71 -32.04 73.41 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.396 0.679 . . . . 0.0 112.333 179.216 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 14.3 t-105 -74.33 -30.73 62.16 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.887 1.675 . . . . 0.0 113.058 173.038 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp -79.12 -8.8 59.28 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.135 0.974 . . . . 0.0 113.402 175.619 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 38.6 t-80 -63.02 156.05 25.84 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.278 1.431 . . . . 0.0 113.436 -178.764 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 19.1 mm100 -60.34 -22.16 62.92 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.052 1.341 . . . . 0.0 114.039 174.723 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -124.31 21.24 8.76 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.155 1.382 . . . . 0.0 113.666 -172.577 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.01 -24.77 62.44 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.093 1.357 . . . . 0.0 113.95 174.377 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 64.4 p-90 -59.38 -33.88 19.39 Favored Pre-proline 0 CA--C 1.547 0.827 0 N-CA-C 117.538 2.421 . . . . 0.0 117.538 -170.898 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -79.31 2.47 8.3 Favored 'Trans proline' 0 CA--C 1.547 1.132 0 CA-C-N 122.985 2.102 . . . . 0.0 113.058 172.697 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -117.9 9.89 13.0 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.273 1.829 . . . . 0.0 113.206 178.077 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 22.5 m-30 -74.6 -17.02 60.78 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 120.396 -1.44 . . . . 0.0 113.538 174.436 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 31.4 mm-40 -149.21 148.58 27.15 Favored Pre-proline 0 CA--C 1.546 0.805 0 C-N-CA 126.495 1.918 . . . . 0.0 110.753 -178.685 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -68.05 163.26 36.54 Favored 'Trans proline' 0 CA--C 1.537 0.627 0 C-N-CA 124.085 3.19 . . . . 0.0 113.572 -177.482 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 46.9 t -72.59 89.12 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 124.685 1.194 . . . . 0.0 110.012 173.661 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -69.57 78.77 0.41 Allowed 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.824 1.25 . . . . 0.0 109.96 169.165 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -52.28 -24.92 8.22 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.677 1.362 . . . . 0.0 114.677 -174.739 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 84.9 mt -62.94 -48.89 85.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 125.204 1.401 . . . . 0.0 111.32 170.651 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 56.5 mttm -76.01 -40.97 52.44 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 125.912 1.685 . . . . 0.0 112.836 -179.159 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -72.12 -11.03 60.56 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.244 1.018 . . . . 0.0 113.555 172.43 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.5 t30 58.46 54.07 5.8 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 126.697 1.999 . . . . 0.0 112.71 178.652 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 37.2 mt -114.61 81.29 6.91 Favored Pre-proline 0 CA--C 1.543 0.691 0 C-N-CA 126.289 1.836 . . . . 0.0 110.17 -178.274 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -66.15 -12.66 36.44 Favored 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 123.325 2.683 . . . . 0.0 113.296 -177.383 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 35.0 m-20 -111.42 6.01 20.02 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 126.074 1.75 . . . . 0.0 113.365 177.598 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -54.26 -52.22 62.07 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 120.472 1.487 . . . . 0.0 112.15 -178.335 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -76.75 -15.26 59.81 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.692 1.197 . . . . 0.0 114.121 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 9.5 mptt -69.41 -44.52 71.21 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 121.304 -0.873 . . . . 0.0 110.731 174.869 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.4 mp -81.87 -51.67 14.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 C-N-CA 123.524 0.73 . . . . 0.0 110.151 173.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 22.7 mm -83.41 101.79 8.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 CA-C-O 122.328 1.061 . . . . 0.0 111.599 -177.683 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -65.7 -30.88 71.62 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 126.046 1.738 . . . . 0.0 113.473 178.063 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -148.6 111.72 3.66 Favored Pre-proline 0 CA--C 1.546 0.819 0 C-N-CA 125.996 1.719 . . . . 0.0 110.488 174.991 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -87.84 160.23 7.55 Favored 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 124.306 3.337 . . . . 0.0 112.016 172.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.5 tpt -159.3 155.71 27.36 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.84 1.256 . . . . 0.0 111.88 175.578 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -149.65 151.16 33.28 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.103 1.361 . . . . 0.0 113.42 -175.888 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 4.3 ttp -65.67 -33.24 75.42 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.244 1.017 . . . . 0.0 112.804 -174.396 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -58.53 -45.65 94.24 Favored Glycine 0 CA--C 1.528 0.875 0 C-N-CA 124.327 0.965 . . . . 0.0 112.163 176.012 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 25.4 m -70.13 -43.68 70.47 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.104 0.962 . . . . 0.0 111.885 176.308 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 83.3 mt -52.97 -52.71 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.182 0 CA-C-N 119.428 1.013 . . . . 0.0 111.413 177.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 6.5 ttpm? -56.43 -32.59 65.03 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.424 1.489 . . . . 0.0 113.201 177.548 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.1 tpmt? -72.72 -45.33 59.29 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.936 1.294 . . . . 0.0 113.275 177.394 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 3.1 ptp180 -69.04 -31.09 69.63 Favored 'General case' 0 N--CA 1.483 1.218 0 CA-C-N 119.49 1.041 . . . . 0.0 113.421 174.448 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 55.4 mt -64.94 -41.31 95.62 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 113.774 1.027 . . . . 0.0 113.774 169.255 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -62.3 -33.44 74.66 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 118.809 0.731 . . . . 0.0 112.756 176.709 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 52.5 m-80 -79.52 -176.49 5.31 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 125.624 1.569 . . . . 0.0 112.511 171.617 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -105.39 42.54 1.22 Allowed 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 125.555 1.542 . . . . 0.0 110.394 174.08 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 45.5 t80 -66.61 -32.99 74.67 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 114.046 1.128 . . . . 0.0 114.046 -168.921 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -139.04 -177.26 4.81 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.531 1.932 . . . . 0.0 112.755 -177.269 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 4.5 t-105 -107.57 -25.73 11.22 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.41 1.484 . . . . 0.0 112.848 -177.013 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 47.0 t -136.55 143.08 43.49 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.709 1.204 . . . . 0.0 112.162 -170.902 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -57.56 -19.3 24.5 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.625 1.17 . . . . 0.0 113.839 169.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 10.4 m -53.17 -36.57 61.04 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 119.098 0.863 . . . . 0.0 112.65 177.416 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -71.85 -40.92 68.67 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 123.75 0.82 . . . . 0.0 112.731 176.384 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 43.0 t -61.06 -36.51 79.8 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 123.912 0.885 . . . . 0.0 112.572 170.301 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 78.8 mtp -68.33 -39.8 81.81 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.335 1.054 . . . . 0.0 111.95 175.641 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -61.0 -40.82 95.01 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 123.236 0.614 . . . . 0.0 112.006 169.909 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -64.03 -43.11 96.55 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 121.535 -0.728 . . . . 0.0 112.245 175.53 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -61.0 -41.72 97.06 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 121.301 -0.874 . . . . 0.0 112.912 172.375 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 13.9 t30 -57.53 -50.47 72.98 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 118.398 0.544 . . . . 0.0 111.193 172.852 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 53.7 m -57.84 -38.59 75.92 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 176.571 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 19.3 ttm -59.96 -62.4 1.9 Allowed 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.515 1.052 . . . . 0.0 111.611 176.152 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -63.02 -39.82 95.91 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -176.479 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 60.8 m -66.25 -44.39 83.83 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 118.272 -0.871 . . . . 0.0 112.572 178.176 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -64.29 -32.63 74.31 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 120.921 1.691 . . . . 0.0 112.398 178.126 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 57.5 m -60.82 -43.98 97.51 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.229 0.612 . . . . 0.0 112.433 169.537 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -67.66 -32.99 74.05 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 176.604 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 80.0 mt -72.58 -58.01 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 123.613 0.765 . . . . 0.0 111.038 178.25 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -69.71 -19.53 63.56 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 114.381 1.252 . . . . 0.0 114.381 -170.861 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 36.5 m-80 -123.25 160.15 27.24 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.724 1.21 . . . . 0.0 112.144 -173.764 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.85 148.72 96.51 Favored Pre-proline 0 N--CA 1.472 0.642 0 C-N-CA 124.242 1.017 . . . . 0.0 110.641 176.918 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -65.32 -8.52 19.02 Favored 'Trans proline' 0 CA--C 1.543 0.947 0 C-N-CA 123.67 2.913 . . . . 0.0 114.723 -175.655 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 44.8 p -107.92 -4.08 18.28 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.745 2.018 . . . . 0.0 113.471 179.071 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -67.09 145.99 54.75 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 118.909 0.777 . . . . 0.0 111.11 175.838 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -52.68 -45.32 66.76 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.682 0.793 . . . . 0.0 112.736 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 9.1 tp -57.37 -35.19 48.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 124.387 1.075 . . . . 0.0 113.785 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 48.0 t -68.51 -44.38 83.07 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 C-N-CA 123.393 0.677 . . . . 0.0 110.534 174.515 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 68.9 mt -62.7 -36.43 82.92 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 118.848 0.749 . . . . 0.0 112.094 176.762 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 1.1 mmt -57.61 -52.27 66.12 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 118.241 0.473 . . . . 0.0 111.004 170.999 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -63.17 -37.37 86.95 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.582 0.753 . . . . 0.0 112.758 179.322 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 83.2 mt-30 -62.08 -40.61 96.4 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 119.607 1.094 . . . . 0.0 112.861 173.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -69.81 -45.46 67.83 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.545 -0.722 . . . . 0.0 112.107 176.502 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 83.1 mt -64.54 -43.97 92.31 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.622 0.769 . . . . 0.0 112.234 177.193 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -63.27 -40.95 98.83 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 119.81 1.186 . . . . 0.0 112.874 -175.647 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 36.0 mtmm -59.77 -39.62 85.49 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 121.528 -0.733 . . . . 0.0 111.954 175.831 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 77.0 mt -72.75 -41.11 61.91 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 C-N-CA 122.947 0.499 . . . . 0.0 111.424 176.467 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 16.7 t80 -51.06 -51.24 55.19 Favored 'General case' 0 CA--C 1.538 0.511 0 O-C-N 121.491 -0.756 . . . . 0.0 110.53 172.822 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 98.1 mt -65.14 -41.28 94.91 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 178.301 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -65.53 -32.16 73.61 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 120.118 1.327 . . . . 0.0 112.293 179.678 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 70.3 mmtt -75.5 -48.67 21.53 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 117.536 -1.221 . . . . 0.0 112.146 177.849 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 6.1 m -67.06 -26.76 37.42 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 CA-C-N 121.13 1.786 . . . . 0.0 112.3 177.12 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -61.22 -30.96 70.75 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 172.041 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 99.5 mt-30 -89.58 -7.92 53.76 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.992 1.317 . . . . 0.0 112.955 175.723 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 46.2 ttp -65.49 144.32 98.91 Favored Pre-proline 0 CA--C 1.547 0.84 0 CA-C-N 119.141 0.882 . . . . 0.0 111.301 173.725 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -53.69 142.94 60.0 Favored 'Trans proline' 0 CA--C 1.539 0.738 0 C-N-CA 122.548 2.165 . . . . 0.0 111.904 168.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -91.29 -24.0 19.97 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 112.581 0.586 . . . . 0.0 112.581 176.553 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -86.74 155.33 20.39 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.662 1.185 . . . . 0.0 111.508 172.562 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -103.09 138.56 39.77 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.196 1.398 . . . . 0.0 111.558 -174.151 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 69.2 t -137.85 124.65 28.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 125.529 1.532 . . . . 0.0 109.129 177.51 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -69.84 128.73 37.41 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.52 1.128 . . . . 0.0 111.084 169.697 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 49.8 mt -83.09 161.94 21.5 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -176.126 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 99.3 mt -68.28 155.47 92.3 Favored Pre-proline 0 CA--C 1.549 0.919 0 C-N-CA 124.441 1.096 . . . . 0.0 111.322 169.023 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -72.13 155.85 56.25 Favored 'Trans proline' 0 CA--C 1.547 1.132 0 C-N-CA 122.871 2.38 . . . . 0.0 111.957 177.144 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -72.42 156.41 54.45 Favored 'Trans proline' 0 CA--C 1.539 0.75 0 C-N-CA 123.191 2.594 . . . . 0.0 112.3 177.999 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -82.14 152.28 67.87 Favored Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 124.265 1.026 . . . . 0.0 112.146 175.533 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -71.11 154.16 62.38 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 123.184 2.589 . . . . 0.0 111.953 173.962 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -87.95 165.93 14.87 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.918 1.287 . . . . 0.0 111.654 178.102 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . -171.16 -174.72 39.14 Favored Glycine 0 CA--C 1.536 1.345 0 C-N-CA 124.915 1.245 . . . . 0.0 113.545 -178.632 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.166 0 C-N-CA 126.28 1.832 . . . . 0.0 112.971 -179.135 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.396 0 N-CA-C 110.594 -1.002 . . . . 0.0 110.594 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 23.5 m -139.97 26.58 2.24 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 124.778 1.231 . . . . 0.0 112.972 -169.708 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 65.4 p -141.38 167.17 22.82 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.587 1.555 . . . . 0.0 113.06 -172.756 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -79.1 -166.76 32.09 Favored Glycine 0 CA--C 1.537 1.423 0 C-N-CA 125.179 1.371 . . . . 0.0 113.917 177.67 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 25.1 m -52.26 133.93 33.93 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.245 1.018 . . . . 0.0 112.444 177.697 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 40.2 m -60.79 155.06 20.28 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.49 1.116 . . . . 0.0 113.7 -176.471 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -153.06 42.83 0.65 Allowed Glycine 0 CA--C 1.533 1.173 0 C-N-CA 125.362 1.458 . . . . 0.0 112.345 -176.309 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -59.11 153.63 17.58 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.344 1.458 . . . . 0.0 113.799 -178.027 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 23.5 m -138.93 -22.37 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 N-CA-C 115.673 1.731 . . . . 0.0 115.673 -170.649 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 47.5 t -148.53 105.62 3.61 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.402 1.081 . . . . 0.0 110.992 -172.11 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 18.6 m120 -146.07 117.13 4.88 Favored Pre-proline 0 CA--C 1.548 0.872 0 C-N-CA 124.354 1.062 . . . . 0.0 111.361 -170.952 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -76.17 -10.51 19.37 Favored 'Trans proline' 0 CA--C 1.544 0.984 0 C-N-CA 124.032 3.155 . . . . 0.0 113.416 177.119 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 64.3 p -67.04 -13.75 62.22 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.756 1.623 . . . . 0.0 114.671 176.759 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 36.0 mtmm -125.19 143.28 43.84 Favored Pre-proline 0 CA--C 1.541 0.615 0 C-N-CA 126.596 1.958 . . . . 0.0 110.798 179.172 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -70.77 146.88 55.08 Favored 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.591 2.194 . . . . 0.0 112.282 -179.121 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 172.61 162.33 24.56 Favored Glycine 0 CA--C 1.529 0.935 0 C-N-CA 124.431 1.015 . . . . 0.0 113.311 177.558 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -173.49 165.12 4.64 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 127.289 2.236 . . . . 0.0 110.983 175.737 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 5.5 mmtp -64.64 136.22 56.75 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.609 1.164 . . . . 0.0 111.959 173.833 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 71.0 p -142.0 161.84 36.97 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 126.307 1.843 . . . . 0.0 109.899 177.451 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 16.0 t30 -52.7 -33.61 48.38 Favored 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 114.622 1.341 . . . . 0.0 114.622 177.837 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -72.25 -47.15 52.45 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.084 -1.01 . . . . 0.0 112.208 174.002 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 86.1 mt -62.56 -30.88 71.63 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 121.223 -0.923 . . . . 0.0 112.33 174.903 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -58.98 -54.33 48.3 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.816 1.247 . . . . 0.0 109.947 169.126 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 63.3 t80 -58.49 -41.61 85.72 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.966 0.907 . . . . 0.0 112.909 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 96.2 mmm -54.78 -52.33 62.93 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 118.348 0.522 . . . . 0.0 111.834 173.333 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.1 tp60 -71.09 -31.79 68.24 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 113.793 1.034 . . . . 0.0 113.793 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 42.9 t30 -98.89 -16.27 18.88 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 114.658 1.355 . . . . 0.0 114.658 -166.653 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 17.2 t -132.81 -50.26 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 122.8 0.44 . . . . 0.0 111.271 -179.75 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 17.9 t -69.86 -66.41 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 123.645 0.778 . . . . 0.0 110.423 -174.291 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 48.7 t -55.1 -47.74 76.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 125.836 1.654 . . . . 0.0 110.303 173.266 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 52.0 tttt -59.8 -37.94 80.55 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.89 0.876 . . . . 0.0 113.176 -175.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 22.2 m -83.52 -38.54 21.61 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 118.542 0.61 . . . . 0.0 112.37 177.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 67.9 mt -60.86 -35.49 76.73 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 121.585 -0.697 . . . . 0.0 112.343 172.684 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 20.2 t-105 -70.55 -29.69 66.21 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.201 1.4 . . . . 0.0 113.543 176.507 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 55.0 mttm -71.15 -17.59 62.54 Favored 'General case' 0 N--CA 1.484 1.261 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 172.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 44.5 t-80 -62.37 151.15 37.64 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.58 1.152 . . . . 0.0 113.596 -171.736 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 26.4 mp0 -59.28 -16.77 23.62 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.018 1.727 . . . . 0.0 114.167 176.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 -124.63 17.85 8.78 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.721 1.608 . . . . 0.0 113.747 -177.403 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.24 -28.57 66.46 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 176.139 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' TRP . . . . . 0.411 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 42.9 p-90 -57.42 -38.05 63.63 Favored Pre-proline 0 CA--C 1.547 0.86 0 N-CA-C 117.613 2.449 . . . . 0.0 117.613 -170.201 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.411 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 73.3 Cg_endo -70.97 -6.26 18.8 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 CA-C-N 123.115 2.148 . . . . 0.0 114.225 173.485 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 56.6 m-85 -109.61 -4.32 16.28 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.343 1.457 . . . . 0.0 112.921 178.646 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 21.0 m-30 -62.43 -18.26 61.28 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 114.343 1.238 . . . . 0.0 114.343 178.764 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 86.5 mt-30 -143.79 155.75 59.46 Favored Pre-proline 0 CA--C 1.544 0.727 0 C-N-CA 125.787 1.635 . . . . 0.0 110.559 -175.165 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -64.84 146.36 87.96 Favored 'Trans proline' 0 CA--C 1.539 0.773 0 C-N-CA 122.733 2.289 . . . . 0.0 111.862 173.436 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 95.9 t -62.13 120.54 8.6 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 123.932 0.893 . . . . 0.0 111.732 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 38.2 m-20 -89.02 89.45 7.99 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.505 1.122 . . . . 0.0 109.952 169.646 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.95 -28.11 48.85 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 113.603 0.964 . . . . 0.0 113.603 178.54 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 81.8 mt -64.86 -50.08 76.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 124.876 1.27 . . . . 0.0 111.039 172.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -66.86 -41.17 87.76 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.039 1.336 . . . . 0.0 112.807 -179.223 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.4 mp -80.2 -3.78 50.44 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.124 0.969 . . . . 0.0 113.21 176.359 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 61.8 t30 54.89 55.73 7.45 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 126.259 1.824 . . . . 0.0 113.448 -179.422 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 44.1 mt -115.2 80.43 7.26 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 126.587 1.955 . . . . 0.0 110.594 -176.301 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -68.88 -4.7 13.91 Favored 'Trans proline' 0 CA--C 1.544 1.023 0 C-N-CA 123.992 3.128 . . . . 0.0 114.418 -175.203 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -124.54 15.11 8.84 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.524 1.929 . . . . 0.0 111.951 179.195 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -51.12 -57.12 9.54 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 120.727 -1.233 . . . . 0.0 112.788 -176.345 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -73.54 -2.41 22.63 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.962 1.305 . . . . 0.0 114.194 178.0 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -84.52 -43.23 14.74 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.395 1.078 . . . . 0.0 110.611 176.807 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.3 mp -82.14 -47.57 19.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 C-N-CA 124.397 1.079 . . . . 0.0 110.423 172.823 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.593 HD11 ' HB2' ' A' ' 115' ' ' TYR . 34.4 mm -78.6 113.7 18.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 123.549 0.74 . . . . 0.0 111.254 -179.04 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -77.01 -31.05 56.14 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.947 1.299 . . . . 0.0 112.575 174.302 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 18.4 p30 -149.88 83.29 6.29 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 125.609 1.564 . . . . 0.0 112.215 -168.806 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -70.34 138.42 35.93 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 123.179 2.586 . . . . 0.0 110.932 178.902 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 8.5 tpt -156.32 137.58 13.81 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.863 1.265 . . . . 0.0 110.017 -174.673 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -146.17 148.31 32.41 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 125.316 1.446 . . . . 0.0 111.364 -175.356 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 9.4 ttp -57.54 -36.98 72.33 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.173 1.389 . . . . 0.0 113.181 -171.668 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.56 -27.05 65.45 Favored Glycine 0 CA--C 1.533 1.206 0 C-N-CA 124.989 1.28 . . . . 0.0 114.366 173.584 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 26.0 m -87.36 -37.28 17.23 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.457 1.103 . . . . 0.0 111.215 172.916 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 66.5 mt -56.43 -51.14 68.08 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 CA-C-N 119.61 1.096 . . . . 0.0 110.892 176.184 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 15.0 ptmm? -59.39 -37.07 77.04 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 175.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.71 -36.41 80.85 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.473 1.109 . . . . 0.0 112.842 -178.634 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 5.7 ptp180 -80.59 -30.62 36.89 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 114.114 1.153 . . . . 0.0 114.114 172.289 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 76.2 mt -63.74 -30.9 71.94 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-N 119.759 1.163 . . . . 0.0 113.794 168.588 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -66.16 -15.0 62.76 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 114.618 1.34 . . . . 0.0 114.618 -178.659 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -138.56 177.85 7.58 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 125.397 1.479 . . . . 0.0 113.592 -174.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 4.0 p30 -78.34 97.65 5.68 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 124.431 1.092 . . . . 0.0 111.78 173.356 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 78.7 t80 -131.24 -37.78 1.24 Allowed 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.54 1.136 . . . . 0.0 113.023 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -132.9 173.44 11.4 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.896 1.678 . . . . 0.0 111.098 169.831 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.6 t-105 -106.78 -19.07 13.76 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.306 1.042 . . . . 0.0 112.544 -177.894 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 78.6 p -137.63 145.71 43.05 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.487 1.115 . . . . 0.0 114.009 -170.251 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -63.53 -22.22 66.77 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 114.847 1.425 . . . . 0.0 114.847 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 15.3 p -51.54 -35.29 40.18 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.273 1.029 . . . . 0.0 113.452 174.612 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -70.01 -43.52 71.2 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.117 0.967 . . . . 0.0 112.105 176.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 51.0 t -63.32 -39.33 94.25 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.245 1.018 . . . . 0.0 112.298 173.04 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 86.7 mtp -61.75 -42.14 98.58 Favored 'General case' 0 N--CA 1.47 0.546 0 O-C-N 121.291 -0.881 . . . . 0.0 112.279 174.097 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 90.8 mm-40 -62.93 -38.57 91.51 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 172.27 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -63.77 -42.45 97.78 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 119.347 0.976 . . . . 0.0 112.421 174.503 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -59.66 -45.28 92.51 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.21 -0.931 . . . . 0.0 112.356 171.313 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -57.97 -46.03 85.8 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.82 -0.55 . . . . 0.0 112.222 174.63 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 84.0 m -63.75 -38.31 90.64 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.177 0.991 . . . . 0.0 112.669 176.415 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 51.0 ttp -59.13 -53.07 62.55 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 119.385 0.993 . . . . 0.0 112.03 176.214 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -68.33 -39.53 81.91 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 121.996 -0.44 . . . . 0.0 112.081 179.367 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 86.4 m -64.24 -48.26 76.5 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.65 0.78 . . . . 0.0 112.063 -179.719 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -64.06 -32.18 73.64 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 119.055 0.843 . . . . 0.0 112.067 -179.7 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 88.7 m -61.16 -44.24 97.63 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.731 0.812 . . . . 0.0 112.885 170.406 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 17.0 m-85 -67.63 -29.45 68.76 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 114.031 1.122 . . . . 0.0 114.031 178.326 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 87.5 mt -68.83 -56.91 10.43 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 123.136 0.574 . . . . 0.0 110.648 175.655 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' TYR . . . . . 0.593 ' HB2' HD11 ' A' ' 77' ' ' ILE . 25.8 t80 -69.61 -37.83 77.03 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 -173.028 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 52.3 m-80 -103.55 151.88 22.36 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.408 1.083 . . . . 0.0 111.164 -172.468 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.34 153.87 93.97 Favored Pre-proline 0 N--CA 1.469 0.493 0 C-N-CA 123.804 0.842 . . . . 0.0 111.135 178.909 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -64.02 -3.28 5.71 Favored 'Trans proline' 0 CA--C 1.547 1.133 0 C-N-CA 124.288 3.325 . . . . 0.0 114.79 -178.67 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 62.1 p -122.22 0.02 9.47 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 126.944 2.097 . . . . 0.0 113.256 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 65.5 m-20 -67.93 146.1 53.93 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 118.886 0.766 . . . . 0.0 110.759 170.534 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -56.45 -46.46 80.31 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 121.537 -0.727 . . . . 0.0 112.36 -176.555 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.5 tp -55.38 -29.84 24.48 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 125.008 1.323 . . . . 0.0 114.321 177.857 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 40.3 t -72.31 -47.22 53.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 O-C-N 121.272 -0.893 . . . . 0.0 110.431 173.308 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 71.0 mt -61.03 -36.97 80.94 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 118.943 0.792 . . . . 0.0 111.617 176.467 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 9.4 mtt -58.92 -51.88 68.13 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.957 1.303 . . . . 0.0 112.081 169.941 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.6 -40.08 90.51 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.349 0.659 . . . . 0.0 112.702 176.825 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 89.1 mt-30 -61.73 -45.92 91.85 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 119.072 0.851 . . . . 0.0 111.975 173.765 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -67.65 -28.72 67.96 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.55 1.14 . . . . 0.0 113.794 178.756 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 77.1 mt -76.72 -46.84 23.87 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.513 0.725 . . . . 0.0 111.455 169.517 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -61.4 -40.36 94.1 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.186 0.903 . . . . 0.0 113.084 -174.548 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -60.52 -33.72 73.05 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 113.187 0.81 . . . . 0.0 113.187 177.254 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 48.1 mt -78.75 -43.21 25.36 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 124.026 0.93 . . . . 0.0 111.415 173.463 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -49.33 -50.06 41.28 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 120.036 1.289 . . . . 0.0 110.907 172.168 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 99.9 mt -62.99 -42.72 99.92 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 113.126 0.788 . . . . 0.0 113.126 179.25 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -69.7 -28.44 65.83 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.793 1.179 . . . . 0.0 112.782 178.823 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 33.9 mmtm -72.8 -52.03 16.6 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 125.423 1.489 . . . . 0.0 111.639 175.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.9 m -68.89 -25.09 29.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 CA-C-N 119.88 1.218 . . . . 0.0 112.382 178.237 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -59.15 -29.01 67.11 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 173.071 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -92.57 -4.11 53.97 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.637 1.175 . . . . 0.0 112.866 176.371 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 40.7 ttp -65.87 139.14 96.7 Favored Pre-proline 0 CA--C 1.546 0.814 0 O-C-N 121.189 -0.945 . . . . 0.0 110.371 170.557 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -65.74 133.25 33.32 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 122.929 2.419 . . . . 0.0 110.896 176.103 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -69.1 -30.8 69.16 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 178.317 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -76.57 162.04 28.1 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.651 1.58 . . . . 0.0 111.153 169.383 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -134.81 145.19 48.11 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.678 1.191 . . . . 0.0 111.802 -176.741 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 54.9 t -131.55 134.17 60.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 125.311 1.444 . . . . 0.0 110.622 -174.472 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -69.19 120.61 15.29 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.599 1.559 . . . . 0.0 111.399 171.004 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 91.2 mt -82.58 154.84 24.79 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.115 0.966 . . . . 0.0 112.986 -179.347 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 4.3 pp -66.39 153.87 91.9 Favored Pre-proline 0 CA--C 1.551 1.005 0 C-N-CA 123.955 0.902 . . . . 0.0 111.863 169.216 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -76.24 141.79 23.56 Favored 'Trans proline' 0 CA--C 1.547 1.159 0 C-N-CA 123.04 2.493 . . . . 0.0 111.794 -179.675 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -73.91 165.45 32.11 Favored 'Trans proline' 0 CA--C 1.54 0.807 0 C-N-CA 123.393 2.728 . . . . 0.0 112.779 179.229 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -61.28 152.81 71.18 Favored Pre-proline 0 CA--C 1.553 1.082 0 C-N-CA 124.089 0.955 . . . . 0.0 111.884 169.705 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -66.62 147.29 81.53 Favored 'Trans proline' 0 CA--C 1.538 0.713 0 C-N-CA 122.853 2.368 . . . . 0.0 112.548 -179.479 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -150.27 126.92 10.91 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.918 1.687 . . . . 0.0 110.035 -178.97 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . 159.66 -163.86 33.8 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 124.347 0.975 . . . . 0.0 113.611 -175.067 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.252 1.235 0 C-N-CA 126.308 1.843 . . . . 0.0 109.818 177.227 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.385 0 N-CA-C 111.113 -0.795 . . . . 0.0 111.113 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 39.1 m -60.36 151.25 28.37 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.424 1.09 . . . . 0.0 112.954 177.824 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.9 m -74.8 -8.2 55.7 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 113.961 1.097 . . . . 0.0 113.961 174.943 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -175.34 -175.61 42.92 Favored Glycine 0 CA--C 1.534 1.236 0 C-N-CA 126.579 2.038 . . . . 0.0 111.564 178.269 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 32.2 p -61.92 107.08 0.79 Allowed 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.304 1.042 . . . . 0.0 112.018 174.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 56.1 m -63.7 -25.33 68.15 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 115.236 1.569 . . . . 0.0 115.236 -172.083 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 52.32 44.89 58.45 Favored Glycine 0 CA--C 1.537 1.424 0 C-N-CA 125.133 1.349 . . . . 0.0 115.831 169.853 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -57.81 151.86 16.96 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 114.676 1.362 . . . . 0.0 114.676 -176.436 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 16.5 m -135.12 -10.3 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 C-N-CA 124.879 1.272 . . . . 0.0 113.911 -176.431 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 56.3 p -149.06 135.33 19.25 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 126.265 1.826 . . . . 0.0 110.561 -179.395 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 28.7 p-10 -148.22 141.2 15.24 Favored Pre-proline 0 CA--C 1.551 1.004 0 C-N-CA 124.642 1.177 . . . . 0.0 113.253 -171.475 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -82.58 -20.67 5.57 Favored 'Trans proline' 0 CA--C 1.543 0.95 0 C-N-CA 123.877 3.051 . . . . 0.0 112.976 170.178 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 50.4 p -76.22 -11.18 59.87 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 126.188 1.795 . . . . 0.0 115.22 -174.826 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -133.76 130.5 20.72 Favored Pre-proline 0 CA--C 1.543 0.706 0 C-N-CA 125.982 1.713 . . . . 0.0 110.56 -176.686 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -75.11 164.06 33.89 Favored 'Trans proline' 0 CA--C 1.539 0.767 0 C-N-CA 122.93 2.42 . . . . 0.0 111.448 175.564 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -168.67 171.8 42.88 Favored Glycine 0 CA--C 1.527 0.82 0 N-CA-C 115.34 0.896 . . . . 0.0 115.34 178.159 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 47.7 mtm180 -145.75 179.47 7.42 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 127.129 2.172 . . . . 0.0 111.681 -172.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 40.1 tttm -128.49 69.89 1.37 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 127.196 2.198 . . . . 0.0 109.063 172.389 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 50.3 p -82.71 170.54 14.98 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.313 1.445 . . . . 0.0 113.501 -175.64 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 27.6 p-10 -48.47 -37.43 17.31 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 125.084 1.354 . . . . 0.0 114.503 169.666 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -72.82 -49.58 29.51 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 121.481 -0.762 . . . . 0.0 111.539 178.761 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 93.5 mt -63.53 -30.98 72.02 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 121.552 -0.717 . . . . 0.0 112.386 175.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.465 ' HB2' HD11 ' A' ' 147' ' ' LEU . 52.3 tt0 -58.79 -53.78 54.47 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 123.635 0.774 . . . . 0.0 110.498 168.835 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -59.67 -39.76 85.56 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.794 0.838 . . . . 0.0 112.772 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 93.0 mmm -55.89 -49.19 74.08 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 121.559 -0.713 . . . . 0.0 111.668 171.257 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -85.65 -3.79 58.98 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 115.046 1.499 . . . . 0.0 115.046 -175.777 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 37.1 m-80 -122.08 -16.76 7.42 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.305 1.442 . . . . 0.0 114.46 -176.628 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 54.8 t -134.07 -50.26 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 123.77 0.828 . . . . 0.0 111.359 -179.399 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 22.0 t -69.65 -63.19 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 CA-C-N 119.16 0.891 . . . . 0.0 110.594 -174.36 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 85.1 t -58.65 -44.66 90.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 123.946 0.898 . . . . 0.0 110.405 172.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? -56.91 -45.01 82.92 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.949 0.9 . . . . 0.0 112.614 -177.462 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 56.4 m -72.75 -45.04 60.74 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 122.813 0.445 . . . . 0.0 111.679 177.805 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 69.8 mt -62.97 -33.54 75.6 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.137 0.575 . . . . 0.0 112.237 179.331 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 19.5 t-105 -71.55 -29.85 65.21 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.288 1.435 . . . . 0.0 113.339 174.073 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -80.49 -7.8 59.32 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 176.032 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 40.2 t-80 -64.02 154.28 34.71 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.691 1.196 . . . . 0.0 113.357 -179.451 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -61.95 -17.59 57.44 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.143 1.377 . . . . 0.0 114.179 175.721 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -122.9 17.33 10.14 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.557 1.543 . . . . 0.0 113.664 -174.837 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.53 -27.99 65.64 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 114.165 1.172 . . . . 0.0 114.165 177.466 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' TRP . . . . . 0.408 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 43.3 p-90 -57.65 -37.81 60.44 Favored Pre-proline 0 CA--C 1.548 0.882 0 N-CA-C 117.808 2.521 . . . . 0.0 117.808 -169.636 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.408 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 97.9 Cg_endo -74.09 -3.46 13.83 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 CA-C-N 123.143 2.158 . . . . 0.0 113.9 173.609 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -109.96 -4.67 15.79 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.475 1.51 . . . . 0.0 112.969 178.094 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 22.5 m-30 -63.11 -16.39 59.83 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 114.143 1.164 . . . . 0.0 114.143 175.788 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 90.3 mt-30 -145.73 157.96 50.47 Favored Pre-proline 0 CA--C 1.546 0.817 0 C-N-CA 126.175 1.79 . . . . 0.0 110.837 -175.567 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -66.53 155.35 70.63 Favored 'Trans proline' 0 C--N 1.35 0.63 0 C-N-CA 122.933 2.422 . . . . 0.0 111.844 171.917 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 37.1 t -76.61 99.72 2.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 124.202 1.001 . . . . 0.0 109.879 177.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -71.6 88.63 0.95 Allowed 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.319 1.048 . . . . 0.0 111.351 175.193 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.64 -31.16 46.29 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.576 1.15 . . . . 0.0 114.094 -179.154 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 84.3 mt -66.12 -49.33 77.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 124.702 1.201 . . . . 0.0 111.075 174.476 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -65.42 -37.01 85.67 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 125.464 1.505 . . . . 0.0 113.376 -179.026 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.8 mp -88.25 -2.97 58.91 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.431 1.493 . . . . 0.0 112.558 177.921 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 24.1 m120 52.55 57.97 5.86 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.015 1.726 . . . . 0.0 113.255 -178.237 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 47.0 mt -114.29 81.75 6.82 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 126.625 1.97 . . . . 0.0 109.992 -179.369 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -67.19 -8.65 22.54 Favored 'Trans proline' 0 CA--C 1.543 0.963 0 C-N-CA 123.969 3.113 . . . . 0.0 113.684 -175.183 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 18.7 p-10 -118.21 8.2 12.27 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 127.988 2.515 . . . . 0.0 113.078 179.781 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 86.3 t80 -52.25 -57.24 10.31 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 120.164 1.347 . . . . 0.0 112.124 -179.215 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 99.8 m-70 -75.89 -5.93 48.39 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.21 1.404 . . . . 0.0 114.104 178.126 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -78.08 -32.65 50.84 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.974 0.909 . . . . 0.0 111.419 174.579 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.1 mp -98.26 -44.85 12.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 125.734 1.613 . . . . 0.0 111.296 175.371 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 21.3 mm -71.48 114.65 10.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 123.552 0.741 . . . . 0.0 110.929 176.904 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.69 -35.9 51.73 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 124.709 1.204 . . . . 0.0 113.226 172.448 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 15.2 p30 -145.34 83.81 8.9 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 125.213 1.405 . . . . 0.0 112.119 -167.906 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -68.63 138.58 42.02 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 123.482 2.788 . . . . 0.0 110.927 178.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.9 tpt -159.58 145.55 16.03 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 125.352 1.461 . . . . 0.0 110.116 -175.43 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -149.77 152.42 35.2 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.869 1.267 . . . . 0.0 112.005 -177.798 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 6.8 ttp -59.72 -33.87 72.18 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.524 1.129 . . . . 0.0 112.564 -177.51 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.51 -23.45 60.5 Favored Glycine 0 CA--C 1.536 1.366 0 C-N-CA 125.86 1.695 . . . . 0.0 114.977 172.123 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 89.8 m -97.11 -37.04 10.28 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.393 1.077 . . . . 0.0 111.372 173.178 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 98.7 mt -53.45 -49.75 52.59 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 CA-C-N 119.877 1.217 . . . . 0.0 111.088 175.368 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.7 -30.3 65.4 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 113.828 1.048 . . . . 0.0 113.828 175.846 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.449 ' HE3' ' HA ' ' A' ' 88' ' ' LYS . 1.2 tpmt? -80.17 -35.61 36.21 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.099 0.96 . . . . 0.0 112.992 -175.811 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 9.4 ptp180 -70.27 -29.84 66.73 Favored 'General case' 0 N--CA 1.482 1.138 0 CA-C-N 119.399 0.999 . . . . 0.0 113.03 169.457 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 70.3 mt -63.58 -43.32 97.32 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.664 0.786 . . . . 0.0 112.341 169.213 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -71.93 -2.22 17.25 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 114.662 1.356 . . . . 0.0 114.662 175.082 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 39.4 m-80 -124.77 15.05 8.67 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.667 1.587 . . . . 0.0 113.565 -177.539 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 40.62 47.83 2.45 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 126.247 1.819 . . . . 0.0 114.287 -179.478 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 85.8 t80 -63.17 -20.64 65.59 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 126.243 1.817 . . . . 0.0 114.179 -170.318 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -143.18 164.82 29.14 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 128.158 2.583 . . . . 0.0 111.729 -171.009 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 23.9 t-105 -87.6 -25.38 23.61 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.804 1.242 . . . . 0.0 112.703 -179.184 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 6.4 t -145.68 152.52 39.76 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 125.418 1.487 . . . . 0.0 111.981 -169.547 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -67.38 -15.76 63.86 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 115.248 1.574 . . . . 0.0 115.248 -176.622 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 32.0 p -54.06 -34.93 61.37 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 177.844 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -72.36 -41.36 66.49 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.669 0.787 . . . . 0.0 111.989 176.651 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 48.0 t -62.71 -40.48 97.27 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 123.914 0.886 . . . . 0.0 111.838 172.99 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 88.2 mtp -60.63 -41.69 95.38 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.9 0.88 . . . . 0.0 112.075 172.657 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 43.2 mm-40 -66.82 -30.32 70.48 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 173.617 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 80.3 m-20 -69.8 -39.95 76.24 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 119.702 1.137 . . . . 0.0 112.075 172.601 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -60.98 -47.99 83.89 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 121.631 -0.668 . . . . 0.0 111.959 169.658 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 33.0 t30 -55.45 -44.54 76.45 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.616 0.766 . . . . 0.0 111.805 173.895 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 96.0 m -61.49 -46.8 88.48 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.207 1.003 . . . . 0.0 111.884 177.358 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 50.7 ttp -56.75 -52.91 63.18 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.1 0.96 . . . . 0.0 112.439 177.567 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -67.16 -39.48 86.5 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.744 -0.597 . . . . 0.0 112.139 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 96.8 m -64.32 -47.89 77.69 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.951 0.9 . . . . 0.0 112.013 178.769 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.3 p30 -63.72 -30.66 71.73 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 118.814 0.734 . . . . 0.0 112.382 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 67.4 m -64.25 -42.24 96.59 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.279 1.031 . . . . 0.0 112.54 172.427 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 15.0 m-85 -68.23 -29.75 68.64 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 177.704 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 88.1 mt -69.73 -56.34 11.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 123.331 0.652 . . . . 0.0 110.557 176.569 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 57.4 t80 -70.49 -38.43 74.37 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 114.595 1.332 . . . . 0.0 114.595 -172.004 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 59.9 m-80 -97.36 159.26 15.02 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.262 1.025 . . . . 0.0 111.939 -175.103 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -68.85 150.55 97.59 Favored Pre-proline 0 N--CA 1.473 0.676 0 O-C-N 121.299 -0.875 . . . . 0.0 109.721 173.282 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -65.66 -1.75 5.35 Favored 'Trans proline' 0 CA--C 1.546 1.115 0 C-N-CA 123.854 3.036 . . . . 0.0 114.722 -179.119 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 56.2 p -120.88 -0.33 10.13 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 126.947 2.099 . . . . 0.0 113.198 -179.301 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -66.75 145.77 55.17 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.601 -0.687 . . . . 0.0 110.805 170.478 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -56.45 -45.42 80.85 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.445 -0.784 . . . . 0.0 112.441 -176.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.6 tp -55.7 -29.93 26.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 124.955 1.302 . . . . 0.0 114.171 177.148 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 42.3 t -72.81 -45.97 54.65 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 O-C-N 121.314 -0.866 . . . . 0.0 110.519 173.398 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 68.5 mt -61.44 -36.76 81.27 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 119.137 0.88 . . . . 0.0 111.675 176.231 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 11.5 mtt -59.39 -52.48 65.42 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.581 1.152 . . . . 0.0 111.994 169.72 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -59.56 -40.26 86.73 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.589 0.755 . . . . 0.0 112.431 177.165 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -61.21 -50.39 73.3 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.977 0.911 . . . . 0.0 111.745 174.437 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -63.07 -40.0 96.38 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.434 0.693 . . . . 0.0 112.823 179.573 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 73.7 mt -65.53 -46.88 77.86 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.485 0.714 . . . . 0.0 111.72 172.167 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -62.78 -37.4 86.5 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.11 -0.994 . . . . 0.0 112.908 -177.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 23.5 mmmt -55.79 -41.82 74.66 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.234 1.014 . . . . 0.0 112.214 172.175 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 78.2 mt -78.18 -39.06 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 C-N-CA 123.921 0.888 . . . . 0.0 111.288 178.386 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 31.9 t80 -50.85 -51.99 45.82 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.53 -0.731 . . . . 0.0 110.302 172.08 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.9 mt -62.53 -41.8 99.11 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 178.25 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -67.64 -30.15 69.64 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 119.885 1.221 . . . . 0.0 112.664 179.807 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 69.8 mmtt -76.65 -50.18 14.37 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 117.646 -1.168 . . . . 0.0 112.505 175.509 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 6.6 m -66.71 -25.34 34.56 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 CA-C-N 121.084 1.765 . . . . 0.0 112.329 178.515 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -58.93 -28.25 66.05 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 171.284 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 95.0 mm-40 -95.95 -4.73 42.82 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.07 1.348 . . . . 0.0 112.925 177.129 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 41.6 ttp -64.96 137.3 97.11 Favored Pre-proline 0 CA--C 1.545 0.779 0 O-C-N 121.402 -0.811 . . . . 0.0 109.994 169.629 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -67.85 131.3 23.74 Favored 'Trans proline' 0 CA--C 1.535 0.538 0 C-N-CA 122.642 2.228 . . . . 0.0 110.72 178.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 83.0 mt-30 -70.35 -24.95 63.07 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -76.72 154.82 33.76 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.187 0.995 . . . . 0.0 112.469 169.807 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -132.4 133.22 43.65 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.363 1.065 . . . . 0.0 110.827 -172.216 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 7.8 p -150.47 142.73 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 124.678 1.191 . . . . 0.0 111.56 -177.736 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -65.11 142.3 58.42 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-O 121.554 0.692 . . . . 0.0 111.179 171.801 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 147' ' ' LEU . . . . . 0.465 HD11 ' HB2' ' A' ' 40' ' ' GLN . 98.6 mt -73.86 166.47 23.27 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 113.882 1.067 . . . . 0.0 113.882 -178.975 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 4.3 pp -136.75 153.99 76.11 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 126.823 2.049 . . . . 0.0 111.03 177.026 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_endo -77.16 150.65 29.5 Favored 'Trans proline' 0 CA--C 1.547 1.128 0 C-N-CA 123.005 2.47 . . . . 0.0 112.749 -173.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -72.19 159.68 49.17 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 123.338 2.692 . . . . 0.0 112.335 175.779 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -153.2 152.27 27.52 Favored Pre-proline 0 CA--C 1.548 0.893 0 C-N-CA 125.304 1.441 . . . . 0.0 111.344 176.44 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -69.92 135.06 29.13 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 123.051 2.501 . . . . 0.0 111.635 177.364 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -156.52 152.37 27.25 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.851 1.66 . . . . 0.0 111.75 178.89 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . 160.92 34.19 0.02 OUTLIER Glycine 0 CA--C 1.537 1.429 0 N-CA-C 115.298 0.879 . . . . 0.0 115.298 -179.022 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 99.4 mttt . . . . . 0 C--O 1.252 1.229 0 C-N-CA 125.164 1.386 . . . . 0.0 113.031 -179.225 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.532 0 CA-C-O 121.327 0.404 . . . . 0.0 112.165 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 29.9 m -160.43 163.1 33.29 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 126.153 1.781 . . . . 0.0 111.068 174.82 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.2 t -154.79 170.95 20.41 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.417 1.087 . . . . 0.0 112.601 -178.625 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 77.02 -60.36 3.48 Favored Glycine 0 CA--C 1.533 1.203 0 C-N-CA 126.622 2.058 . . . . 0.0 114.145 177.367 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 8.4 t -62.41 165.87 5.67 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.844 1.258 . . . . 0.0 112.669 176.61 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.2 t -53.67 140.3 29.66 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.338 1.055 . . . . 0.0 112.092 175.785 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -171.48 -174.36 39.09 Favored Glycine 0 CA--C 1.533 1.16 0 CA-C-O 121.873 0.707 . . . . 0.0 114.663 -171.657 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -63.0 164.69 7.88 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.958 1.703 . . . . 0.0 115.562 -174.37 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 30.4 m -122.83 -8.25 8.25 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 C-N-CA 126.651 1.98 . . . . 0.0 113.868 -172.38 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 38.8 t -145.34 125.12 13.38 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 126.071 1.748 . . . . 0.0 109.854 178.114 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 23.2 t-20 -151.56 130.04 6.19 Favored Pre-proline 0 CA--C 1.549 0.931 0 C-N-CA 124.619 1.168 . . . . 0.0 110.9 -176.177 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -79.59 -18.91 10.4 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 C-N-CA 123.577 2.851 . . . . 0.0 114.578 -176.756 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 15.3 t -87.14 -38.76 16.14 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.439 1.096 . . . . 0.0 112.444 -178.183 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.1 ttmp? -60.94 126.68 86.26 Favored Pre-proline 0 CA--C 1.546 0.819 0 C-N-CA 124.817 1.247 . . . . 0.0 110.548 174.426 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -72.84 144.32 38.65 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.795 2.33 . . . . 0.0 112.336 -178.361 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 160.38 164.42 15.39 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 124.288 0.947 . . . . 0.0 113.705 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 12.4 ptm180 -163.34 162.05 24.85 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 126.602 1.961 . . . . 0.0 110.974 172.23 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 47.8 pttt -61.48 142.4 57.04 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 170.299 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 69.7 p -148.22 165.34 31.23 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 126.763 2.025 . . . . 0.0 110.895 179.661 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 19.7 p-10 -51.41 -35.37 38.8 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 114.561 1.319 . . . . 0.0 114.561 175.781 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -69.37 -50.64 44.3 Favored 'General case' 0 CA--C 1.531 0.243 0 O-C-N 121.899 -0.501 . . . . 0.0 110.531 178.875 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 86.9 mt -61.44 -34.88 76.16 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.983 0.913 . . . . 0.0 112.052 175.879 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.5 ' HB2' HD11 ' A' ' 147' ' ' LEU . 7.5 tp60 -59.41 -52.73 64.35 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.253 1.021 . . . . 0.0 111.516 171.736 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 73.3 t80 -55.04 -42.54 72.8 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.128 0.971 . . . . 0.0 112.269 177.019 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.413 ' HG3' ' HB1' ' A' ' 98' ' ' ALA . 96.0 mmm -58.27 -51.11 71.15 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.291 0.636 . . . . 0.0 112.615 174.865 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -79.33 -15.02 58.6 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 114.952 1.464 . . . . 0.0 114.952 179.455 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 35.5 m-20 -103.52 -19.5 14.36 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 119.644 1.111 . . . . 0.0 113.902 -174.72 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 39.3 t -133.64 -48.55 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 123.926 0.89 . . . . 0.0 111.506 -178.876 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.424 HG22 ' HB3' ' A' ' 136' ' ' LYS . 19.9 t -72.3 -64.42 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 CA-C-N 119.015 0.825 . . . . 0.0 110.908 -171.865 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 86.5 t -57.06 -43.3 80.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 124.098 0.959 . . . . 0.0 109.939 171.335 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 12.2 tppt? -58.89 -34.48 71.7 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.195 0.998 . . . . 0.0 113.341 -178.328 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 78.1 m -84.01 -42.97 15.64 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 118.716 0.689 . . . . 0.0 111.555 175.673 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 67.9 mt -61.85 -33.04 73.44 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.567 0.747 . . . . 0.0 112.313 177.693 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 19.8 t-105 -74.71 -28.73 60.93 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.782 1.633 . . . . 0.0 113.303 175.335 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 32.5 mtmm -74.71 -13.55 60.63 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 114.001 1.112 . . . . 0.0 114.001 171.843 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 36.1 t-80 -61.92 154.5 26.11 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.386 1.075 . . . . 0.0 113.507 -175.141 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 65.4 mt-30 -59.87 -18.27 43.13 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.345 1.458 . . . . 0.0 114.148 176.019 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -126.36 20.51 7.38 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.372 1.469 . . . . 0.0 113.882 -174.221 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.1 -28.08 65.11 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 113.774 1.028 . . . . 0.0 113.774 175.177 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' TRP . . . . . 0.408 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 49.7 p-90 -57.89 -37.14 52.56 Favored Pre-proline 0 CA--C 1.548 0.878 0 N-CA-C 117.689 2.477 . . . . 0.0 117.689 -170.171 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.408 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 87.4 Cg_endo -73.02 -5.32 16.99 Favored 'Trans proline' 0 CA--C 1.542 0.924 0 CA-C-N 123.048 2.124 . . . . 0.0 113.925 173.606 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 72.0 m-85 -109.01 -4.87 16.33 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.312 1.445 . . . . 0.0 113.135 178.476 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -61.97 -18.24 59.73 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 114.327 1.232 . . . . 0.0 114.327 179.388 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -141.44 154.41 66.87 Favored Pre-proline 0 CA--C 1.544 0.718 0 C-N-CA 125.995 1.718 . . . . 0.0 110.348 179.36 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -67.67 150.19 79.37 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 122.755 2.303 . . . . 0.0 112.626 176.732 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 89.2 t -62.59 142.24 16.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 123.892 0.877 . . . . 0.0 110.904 171.375 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -125.06 96.0 4.7 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.467 1.507 . . . . 0.0 109.767 174.214 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.8 -29.18 59.29 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -178.15 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 85.3 mt -64.88 -49.04 81.8 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 124.652 1.181 . . . . 0.0 110.831 173.816 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -68.19 -42.05 80.5 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.092 1.357 . . . . 0.0 112.731 -179.501 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.6 mp -78.79 -5.15 52.61 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 124.418 1.087 . . . . 0.0 113.231 176.274 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 61.5 t30 55.34 53.67 9.63 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.213 1.805 . . . . 0.0 113.647 -179.224 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 25.7 mt -113.43 86.39 10.0 Favored Pre-proline 0 CA--C 1.544 0.715 0 C-N-CA 126.285 1.834 . . . . 0.0 110.094 -177.374 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_endo -67.82 -4.1 11.66 Favored 'Trans proline' 0 CA--C 1.543 0.965 0 C-N-CA 123.548 2.832 . . . . 0.0 113.247 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 16.9 p-10 -123.7 1.25 8.8 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 127.35 2.26 . . . . 0.0 114.277 -178.436 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -54.42 -51.1 65.97 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 120.288 1.404 . . . . 0.0 112.034 178.056 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 99.7 m-70 -77.26 1.99 16.95 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.607 1.563 . . . . 0.0 114.281 177.912 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.6 mmtp -95.92 -42.55 8.24 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.835 1.254 . . . . 0.0 110.553 177.0 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.9 mp -76.59 -48.33 26.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 C-N-CA 124.05 0.94 . . . . 0.0 110.279 171.357 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 36.6 mm -96.3 128.7 47.25 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 124.318 1.047 . . . . 0.0 111.35 -177.985 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -95.86 -37.86 10.54 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.831 1.252 . . . . 0.0 111.588 -178.597 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 42.2 m-20 -130.13 78.73 74.17 Favored Pre-proline 0 CA--C 1.547 0.863 0 C-N-CA 125.421 1.488 . . . . 0.0 109.963 -173.063 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -71.13 143.96 45.65 Favored 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 123.948 3.099 . . . . 0.0 111.6 -179.514 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 8.5 tpt -156.88 141.09 16.47 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.316 1.046 . . . . 0.0 111.875 -171.587 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -148.99 150.8 33.45 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 125.765 1.626 . . . . 0.0 112.409 -175.792 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 7.0 ttp -59.04 -36.84 75.68 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.893 1.277 . . . . 0.0 113.77 -171.355 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -59.99 -21.27 55.62 Favored Glycine 0 CA--C 1.533 1.183 0 C-N-CA 125.591 1.567 . . . . 0.0 114.739 175.025 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 35.1 m -90.18 -42.04 11.27 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.724 0.81 . . . . 0.0 111.196 173.367 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 66.4 mt -56.15 -48.28 79.43 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 124.215 1.006 . . . . 0.0 111.407 -178.854 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.78 -33.59 66.78 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 178.531 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 2.5 tppp? -74.31 -41.89 60.41 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.483 1.113 . . . . 0.0 112.362 -178.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 4.6 ptp180 -71.52 -30.9 66.46 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 172.882 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 23.7 mt -61.31 -39.16 89.47 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.292 0.951 . . . . 0.0 113.404 169.547 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -67.58 -13.13 61.8 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 115.354 1.613 . . . . 0.0 115.354 -174.889 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -132.67 175.36 9.39 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.426 1.49 . . . . 0.0 113.727 -178.357 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -77.69 80.84 4.14 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 125.0 1.32 . . . . 0.0 111.999 -178.259 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 49.3 t80 -114.79 -36.5 4.48 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.815 1.246 . . . . 0.0 113.097 -175.889 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -137.92 169.95 16.9 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 127.431 2.292 . . . . 0.0 110.925 171.769 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.1 t-105 -102.19 -23.84 13.99 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.675 1.19 . . . . 0.0 112.763 -175.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 35.3 t -139.34 146.51 40.36 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.897 1.279 . . . . 0.0 111.003 177.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.413 ' HB1' ' HG3' ' A' ' 42' ' ' MET . . . -59.74 -13.99 12.49 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.789 2.036 . . . . 0.0 115.133 176.14 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 53.5 p -52.23 -33.0 39.33 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 120.564 1.529 . . . . 0.0 113.353 172.503 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -74.86 -39.56 61.49 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.608 1.163 . . . . 0.0 112.479 176.412 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -71.89 -31.05 66.03 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 124.142 0.977 . . . . 0.0 112.391 178.157 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 86.2 mtp -62.18 -40.72 96.98 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 125.114 1.365 . . . . 0.0 111.875 170.414 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -66.31 -31.08 71.65 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 174.658 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -67.85 -42.77 80.86 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 119.42 1.009 . . . . 0.0 111.659 170.439 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -59.96 -44.7 94.27 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 121.072 -1.018 . . . . 0.0 112.646 171.818 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 19.3 t30 -57.45 -44.58 84.87 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 121.57 -0.706 . . . . 0.0 111.656 172.806 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 63.7 m -65.66 -35.76 81.71 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.333 1.053 . . . . 0.0 112.528 178.939 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 16.5 ttm -58.89 -60.27 4.13 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.982 0.913 . . . . 0.0 111.475 173.953 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -63.63 -38.58 91.65 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 122.612 0.365 . . . . 0.0 111.781 -177.684 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 72.9 m -64.8 -47.85 76.58 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.377 0.671 . . . . 0.0 112.133 178.036 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -64.64 -30.98 72.01 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 120.155 1.343 . . . . 0.0 112.406 178.754 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 85.5 m -62.35 -45.98 90.75 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.356 0.662 . . . . 0.0 112.229 170.072 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -66.12 -34.45 78.08 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 177.126 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 77.4 mt -69.78 -57.6 7.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 C-N-CA 123.407 0.683 . . . . 0.0 110.782 177.583 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 48.7 t80 -69.45 -26.71 64.73 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -171.069 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 46.0 m-80 -114.76 161.04 18.7 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.091 0.956 . . . . 0.0 112.45 -171.9 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -66.26 146.01 99.01 Favored Pre-proline 0 N--CA 1.473 0.695 0 C-N-CA 124.228 1.011 . . . . 0.0 110.341 176.398 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -65.89 -7.84 17.99 Favored 'Trans proline' 0 CA--C 1.542 0.924 0 C-N-CA 123.659 2.906 . . . . 0.0 114.595 -175.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 56.8 p -115.26 0.96 13.67 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 126.703 2.001 . . . . 0.0 113.175 179.133 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -65.83 148.0 52.47 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 121.476 -0.765 . . . . 0.0 110.844 172.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -51.55 -49.55 61.78 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 123.417 0.687 . . . . 0.0 112.203 178.895 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 9.7 tp -57.28 -30.14 34.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 -179.221 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 42.7 t -73.15 -47.08 48.76 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 O-C-N 121.515 -0.74 . . . . 0.0 110.588 173.832 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 80.3 mt -61.29 -37.39 83.01 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 119.11 0.868 . . . . 0.0 111.649 176.801 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 8.8 mtt -59.12 -51.14 71.32 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.993 1.317 . . . . 0.0 111.915 169.898 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.09 -39.67 86.93 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 176.196 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -62.49 -45.32 93.54 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 119.502 1.046 . . . . 0.0 111.872 174.094 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -66.57 -29.61 69.72 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.304 1.042 . . . . 0.0 113.724 179.637 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 80.4 mt -78.05 -47.61 17.99 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.976 0.91 . . . . 0.0 111.65 169.91 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -62.1 -38.65 89.69 Favored 'General case' 0 N--CA 1.468 0.45 0 O-C-N 121.05 -1.032 . . . . 0.0 113.128 -174.486 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 19.7 pttp -58.26 -42.88 87.44 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 118.783 0.72 . . . . 0.0 111.874 176.179 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 77.0 mt -67.74 -46.49 82.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 C-N-CA 124.3 1.04 . . . . 0.0 110.743 176.073 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 44.8 t80 -50.94 -50.63 57.44 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.142 0.883 . . . . 0.0 111.237 173.753 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.1 mt -62.98 -41.21 99.5 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 179.151 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -61.43 -37.96 85.41 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 119.409 1.004 . . . . 0.0 112.955 173.154 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' LYS . . . . . 0.424 ' HB3' HG22 ' A' ' 46' ' ' VAL . 71.6 mmtt -72.47 -49.5 32.79 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.175 0.99 . . . . 0.0 112.616 179.709 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 7.1 m -69.21 -25.79 30.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 CA-C-N 119.955 1.252 . . . . 0.0 112.126 177.96 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -59.37 -31.02 68.83 Favored 'General case' 0 CA--C 1.541 0.596 0 O-C-N 121.607 -0.683 . . . . 0.0 112.208 171.377 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 29.1 mm100 -97.0 3.84 51.79 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.239 1.415 . . . . 0.0 113.106 177.729 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 9.6 ttm -54.26 140.89 53.32 Favored Pre-proline 0 CA--C 1.546 0.826 0 C-N-CA 124.642 1.177 . . . . 0.0 112.164 174.392 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -68.82 112.62 2.95 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 122.901 2.401 . . . . 0.0 109.008 168.184 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -68.81 -20.13 64.31 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 -173.654 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -82.41 157.7 23.59 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.547 1.539 . . . . 0.0 112.269 176.92 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -117.65 128.22 54.71 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.608 1.563 . . . . 0.0 110.865 -174.848 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 63.4 t -141.88 135.07 29.1 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 126.472 1.909 . . . . 0.0 109.901 -171.972 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -70.55 131.29 43.76 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.534 1.534 . . . . 0.0 112.404 175.602 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 147' ' ' LEU . . . . . 0.5 HD11 ' HB2' ' A' ' 40' ' ' GLN . 93.9 mt -80.61 160.07 25.21 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 177.89 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 95.8 mt -67.58 159.0 80.77 Favored Pre-proline 0 CA--C 1.549 0.942 0 C-N-CA 125.647 1.579 . . . . 0.0 112.813 172.689 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -71.2 153.97 61.98 Favored 'Trans proline' 0 CA--C 1.548 1.187 0 C-N-CA 123.007 2.471 . . . . 0.0 112.424 176.341 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_endo -76.57 170.34 20.11 Favored 'Trans proline' 0 CA--C 1.54 0.811 0 C-N-CA 123.87 3.047 . . . . 0.0 112.913 179.157 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -61.21 155.62 55.26 Favored Pre-proline 0 CA--C 1.553 1.074 0 C-N-CA 124.384 1.073 . . . . 0.0 112.021 169.383 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -74.73 -9.65 21.26 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 123.254 2.636 . . . . 0.0 115.095 -177.483 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 28.2 ttpp -77.17 139.44 39.92 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.737 1.615 . . . . 0.0 111.28 175.251 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . 178.51 174.69 44.98 Favored Glycine 0 CA--C 1.535 1.315 0 C-N-CA 124.297 0.951 . . . . 0.0 113.951 176.451 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.254 1.29 0 C-N-CA 127.818 2.447 . . . . 0.0 113.223 -176.64 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.484 0 N-CA-C 111.263 -0.735 . . . . 0.0 111.263 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.3 t -139.43 17.79 2.56 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.822 1.249 . . . . 0.0 113.296 -178.022 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 40.2 m -156.88 138.35 13.95 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.726 1.61 . . . . 0.0 110.23 171.719 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -110.84 -172.07 19.68 Favored Glycine 0 CA--C 1.533 1.2 0 C-N-CA 125.31 1.433 . . . . 0.0 112.61 177.379 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 47.4 m -54.77 108.64 0.41 Allowed 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.902 1.281 . . . . 0.0 112.09 178.058 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 9.3 t -154.84 159.49 40.58 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.342 1.457 . . . . 0.0 111.38 -176.095 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 155.17 69.58 0.01 OUTLIER Glycine 0 CA--C 1.529 0.916 0 C-N-CA 124.776 1.179 . . . . 0.0 111.612 -174.07 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.2 pm0 -54.02 153.53 4.87 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 115.28 1.585 . . . . 0.0 115.28 -174.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 27.3 m -141.24 -7.27 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 C-N-CA 125.563 1.545 . . . . 0.0 114.311 -169.944 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.4 m -142.88 29.26 1.52 Allowed 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.813 1.245 . . . . 0.0 114.113 -172.886 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -53.45 125.46 44.12 Favored Pre-proline 0 CA--C 1.553 1.061 0 C-N-CA 124.369 1.068 . . . . 0.0 112.718 -175.852 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -79.71 -167.61 0.53 Allowed 'Trans proline' 0 CA--C 1.542 0.913 0 C-N-CA 124.558 3.505 . . . . 0.0 110.959 175.862 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 32.6 m 49.29 29.29 2.63 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 126.96 2.104 . . . . 0.0 114.799 179.093 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.8 ttpp -147.6 139.05 13.55 Favored Pre-proline 0 CA--C 1.544 0.734 0 C-N-CA 127.276 2.23 . . . . 0.0 110.47 -168.528 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -73.56 161.02 43.16 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 123.252 2.635 . . . . 0.0 112.744 177.753 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 155.69 159.2 9.21 Favored Glycine 0 CA--C 1.533 1.164 0 C-N-CA 125.869 1.7 . . . . 0.0 112.165 172.779 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 7.2 ptp180 -160.1 165.46 31.7 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 126.072 1.749 . . . . 0.0 110.44 178.881 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.0 ttpt -75.4 132.52 40.94 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 166.352 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 66.6 p -124.85 170.14 11.35 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 126.115 1.766 . . . . 0.0 108.829 177.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 23.8 p-10 -52.03 -32.09 32.71 Favored 'General case' 0 N--CA 1.475 0.819 0 O-C-N 121.161 -0.962 . . . . 0.0 113.349 173.94 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.9 mm-40 -70.7 -53.44 15.63 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 123.846 0.859 . . . . 0.0 111.745 177.974 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.8 mt -64.25 -32.75 74.46 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.067 0.848 . . . . 0.0 112.551 176.657 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 22.8 tt0 -59.65 -50.22 74.71 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.144 0.977 . . . . 0.0 111.146 170.126 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 62.5 t80 -57.83 -40.9 81.13 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.625 0.77 . . . . 0.0 112.376 176.63 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 82.0 mmm -56.64 -52.44 64.86 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 122.765 0.426 . . . . 0.0 112.007 174.106 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -78.24 -18.1 55.82 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 -178.837 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 42.3 m-20 -99.47 -21.56 15.9 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.594 0.961 . . . . 0.0 113.594 -173.241 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 29.3 t -135.89 -48.45 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 CA-C-O 118.511 -0.757 . . . . 0.0 111.915 -177.898 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 18.4 t -68.23 -63.67 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 CA-C-N 119.151 0.887 . . . . 0.0 110.669 -173.811 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 81.7 t -57.83 -47.13 86.83 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 C-N-CA 124.454 1.101 . . . . 0.0 110.13 173.348 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -57.41 -44.09 84.32 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 118.682 0.674 . . . . 0.0 112.703 -176.341 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 48.1 m -69.87 -46.72 64.9 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 121.977 -0.452 . . . . 0.0 111.654 176.856 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 66.7 mt -61.63 -33.46 73.97 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.236 0.614 . . . . 0.0 112.157 178.658 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 24.0 t-105 -71.29 -29.36 64.96 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.88 1.672 . . . . 0.0 113.413 176.013 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 54.2 mtmt -83.83 -8.34 59.24 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.066 0.947 . . . . 0.0 113.503 177.442 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 43.2 t-80 -62.69 154.67 28.64 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.719 1.208 . . . . 0.0 113.152 -178.249 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -60.29 -17.14 40.45 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.307 1.443 . . . . 0.0 114.176 174.865 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -124.14 15.24 9.13 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.735 1.614 . . . . 0.0 113.984 -174.562 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.82 -30.2 67.66 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.802 1.241 . . . . 0.0 114.14 178.716 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' TRP . . . . . 0.428 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 38.6 p-90 -56.26 -37.85 61.95 Favored Pre-proline 0 CA--C 1.548 0.9 0 N-CA-C 117.466 2.395 . . . . 0.0 117.466 -170.471 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.428 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 72.1 Cg_endo -72.05 -5.71 17.65 Favored 'Trans proline' 0 CA--C 1.544 0.976 0 CA-C-N 123.164 2.166 . . . . 0.0 114.179 173.434 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -108.91 -4.83 16.46 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.352 1.461 . . . . 0.0 113.057 178.323 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 21.3 m-30 -64.29 -16.17 61.63 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 113.927 1.084 . . . . 0.0 113.927 176.107 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -143.37 158.61 57.42 Favored Pre-proline 0 CA--C 1.546 0.826 0 C-N-CA 126.437 1.895 . . . . 0.0 110.726 -177.123 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -64.81 157.67 55.05 Favored 'Trans proline' 0 CA--C 1.536 0.6 0 C-N-CA 123.052 2.501 . . . . 0.0 112.75 175.716 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 36.0 t -75.71 87.3 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 C-N-CA 124.679 1.192 . . . . 0.0 109.434 174.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 58.4 m-20 -69.87 85.81 0.5 Allowed 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.837 1.255 . . . . 0.0 111.78 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.3 -28.24 27.19 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.913 1.285 . . . . 0.0 114.128 178.621 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 82.7 mt -66.44 -49.89 71.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 125.177 1.391 . . . . 0.0 111.152 173.265 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -66.69 -38.63 87.18 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.93 1.292 . . . . 0.0 112.543 178.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 84.7 mt -85.24 -5.29 59.33 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 126.439 1.896 . . . . 0.0 113.205 -178.118 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 51.37 54.88 10.32 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.907 1.683 . . . . 0.0 113.174 -176.948 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 45.0 mt -114.41 81.5 6.79 Favored Pre-proline 0 N--CA 1.474 0.742 0 C-N-CA 125.803 1.641 . . . . 0.0 110.676 -179.655 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -66.57 -14.14 42.79 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 123.423 2.748 . . . . 0.0 113.583 -175.8 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 34.4 m-20 -106.95 5.07 27.89 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.615 1.566 . . . . 0.0 113.269 177.005 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -53.54 -51.65 62.22 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 120.321 1.419 . . . . 0.0 112.788 -175.244 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -76.8 -16.05 59.56 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.857 1.263 . . . . 0.0 113.839 -179.813 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 9.4 mptt -68.37 -42.22 79.48 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.875 0.87 . . . . 0.0 110.363 174.808 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.9 mp -81.1 -55.34 8.37 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 C-N-CA 124.534 1.133 . . . . 0.0 110.431 173.637 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 50.5 mm -85.44 100.69 8.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 CA-C-O 122.322 1.058 . . . . 0.0 111.295 -176.386 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -66.93 -29.38 69.23 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 126.121 1.769 . . . . 0.0 114.091 179.328 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -145.51 78.34 12.06 Favored Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 125.689 1.596 . . . . 0.0 110.909 -171.349 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -68.66 149.67 73.85 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 124.157 3.238 . . . . 0.0 112.087 -178.441 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 8.7 tpt -158.22 148.83 20.46 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.771 1.228 . . . . 0.0 111.1 -171.777 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -152.75 152.08 31.24 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.069 1.348 . . . . 0.0 112.278 178.774 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 6.6 ttp -60.24 -33.73 72.69 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.632 1.173 . . . . 0.0 112.477 -176.541 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -61.52 -23.52 62.82 Favored Glycine 0 CA--C 1.536 1.397 0 C-N-CA 125.734 1.635 . . . . 0.0 114.769 172.577 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 93.3 m -93.98 -38.95 10.91 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 118.363 1.081 . . . . 0.0 111.387 172.079 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 89.9 mt -53.07 -50.03 47.27 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 CA-C-N 119.69 1.132 . . . . 0.0 111.108 176.462 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -57.89 -35.78 71.49 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 176.414 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 22.5 ttmm -70.86 -38.51 73.13 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.229 1.012 . . . . 0.0 113.208 -177.842 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -72.78 -30.48 64.14 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-N 119.122 0.874 . . . . 0.0 113.189 171.062 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 48.8 mt -63.7 -39.09 93.45 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-N 119.744 1.156 . . . . 0.0 113.243 168.62 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -77.52 14.42 1.0 Allowed 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.88 1.272 . . . . 0.0 113.732 176.685 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 32.6 m-80 -137.08 167.51 21.39 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 127.006 2.122 . . . . 0.0 111.317 177.705 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -75.94 37.0 0.15 Allowed 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 125.514 1.526 . . . . 0.0 111.952 173.908 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 30.0 t80 -70.82 -31.03 67.64 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 120.438 -1.413 . . . . 0.0 113.324 -169.254 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -144.12 -178.31 5.88 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 127.127 2.171 . . . . 0.0 110.389 175.196 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 6.6 t-105 -113.99 -25.17 8.68 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.565 1.146 . . . . 0.0 111.485 177.002 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.1 m -130.27 136.45 49.19 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.165 1.386 . . . . 0.0 111.775 -168.493 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -66.24 -16.48 64.04 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 115.669 1.729 . . . . 0.0 115.669 -173.927 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 16.5 m -53.76 -32.31 51.81 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.381 0.991 . . . . 0.0 112.909 175.089 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -69.87 -44.13 70.44 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.822 0.849 . . . . 0.0 112.442 175.632 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 43.4 t -61.72 -37.55 84.62 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.165 0.986 . . . . 0.0 112.466 171.277 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 83.2 mtp -65.96 -40.04 90.95 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.037 0.935 . . . . 0.0 112.155 176.395 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -63.44 -36.31 83.32 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 112.716 0.635 . . . . 0.0 112.716 170.913 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 91.8 m-20 -65.47 -43.67 89.57 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 119.445 1.02 . . . . 0.0 112.12 173.29 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -57.72 -45.78 85.29 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 121.374 -0.829 . . . . 0.0 112.445 171.482 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 13.6 t30 -55.92 -52.43 64.15 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.385 0.674 . . . . 0.0 111.779 174.293 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 53.5 m -57.86 -43.43 85.96 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.831 0.852 . . . . 0.0 112.476 178.715 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 53.2 ttp -56.72 -53.42 57.92 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 118.996 0.817 . . . . 0.0 112.9 177.407 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -69.25 -35.54 76.22 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 179.689 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.7 m -58.75 -49.96 75.68 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.372 1.069 . . . . 0.0 111.983 172.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -57.86 -38.72 76.22 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.316 0.646 . . . . 0.0 112.108 -178.335 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 24.0 m -56.1 -42.22 76.46 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.027 0.931 . . . . 0.0 112.707 172.612 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 7.0 m-85 -71.18 -29.34 65.06 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 176.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 79.3 mt -75.26 -57.75 5.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 123.617 0.767 . . . . 0.0 110.654 179.546 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -71.44 -27.06 63.02 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 114.362 1.245 . . . . 0.0 114.362 -171.739 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 36.6 m-80 -113.1 161.68 16.82 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.591 1.156 . . . . 0.0 111.729 -173.1 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -71.82 151.45 93.19 Favored Pre-proline 0 N--CA 1.471 0.621 0 C-N-CA 123.998 0.919 . . . . 0.0 109.79 176.557 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -65.38 -1.03 4.07 Favored 'Trans proline' 0 CA--C 1.547 1.134 0 C-N-CA 123.763 2.976 . . . . 0.0 114.691 -179.668 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 53.8 p -118.8 -2.28 10.92 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 127.176 2.191 . . . . 0.0 113.167 -179.752 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 58.4 m-20 -68.56 145.87 53.59 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 118.929 0.786 . . . . 0.0 110.804 170.598 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -56.74 -45.1 82.2 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.413 -0.805 . . . . 0.0 112.589 -176.318 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.6 tp -55.88 -29.37 25.96 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 124.946 1.298 . . . . 0.0 114.214 178.725 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 37.3 t -71.07 -48.3 56.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 O-C-N 121.364 -0.835 . . . . 0.0 110.416 172.779 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 66.4 mt -61.41 -36.59 80.72 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 118.829 0.74 . . . . 0.0 111.697 177.623 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 10.8 mtt -58.93 -51.73 68.8 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 124.854 1.261 . . . . 0.0 112.048 170.153 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.82 -39.35 91.46 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.358 0.663 . . . . 0.0 112.681 176.9 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 90.1 mt-30 -61.51 -47.06 87.3 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 119.107 0.867 . . . . 0.0 111.817 174.767 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -63.16 -45.2 92.97 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 123.802 0.841 . . . . 0.0 112.512 178.112 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 81.7 mt -64.96 -45.02 87.43 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.742 0.817 . . . . 0.0 112.084 175.525 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -63.71 -37.46 87.43 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 121.093 -1.004 . . . . 0.0 112.751 -177.071 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -58.53 -40.03 81.81 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 121.399 -0.813 . . . . 0.0 112.272 172.377 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 78.5 mt -74.3 -40.92 50.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 C-N-CA 123.243 0.617 . . . . 0.0 111.349 177.086 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -51.16 -51.36 54.46 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.456 -0.778 . . . . 0.0 110.364 171.894 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 96.1 mt -62.92 -41.31 99.43 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 112.904 0.705 . . . . 0.0 112.904 177.581 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -67.16 -29.98 69.82 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 120.199 1.363 . . . . 0.0 112.845 -179.737 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 71.5 mmtt -74.86 -52.43 11.35 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.953 0.901 . . . . 0.0 112.285 174.34 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.8 m -65.96 -24.81 34.66 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 120.316 1.416 . . . . 0.0 112.151 179.126 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -61.84 -28.54 69.56 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 121.475 -0.765 . . . . 0.0 112.933 171.207 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -96.51 -3.34 43.39 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.462 1.505 . . . . 0.0 112.599 177.849 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 5.9 ttm -57.24 142.01 76.21 Favored Pre-proline 0 CA--C 1.548 0.898 0 C-N-CA 124.298 1.039 . . . . 0.0 110.727 169.686 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_endo -63.16 145.96 93.89 Favored 'Trans proline' 0 CA--C 1.537 0.675 0 C-N-CA 122.563 2.175 . . . . 0.0 110.252 169.707 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -77.75 -17.66 57.32 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 120.827 -1.171 . . . . 0.0 113.344 177.468 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -94.45 154.11 17.6 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.32 1.448 . . . . 0.0 112.605 -177.64 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -128.91 133.28 47.83 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.247 1.419 . . . . 0.0 111.335 -172.168 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 9.1 p -147.87 145.13 18.98 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 124.184 0.994 . . . . 0.0 112.914 -174.289 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -64.15 132.93 51.88 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.304 1.841 . . . . 0.0 111.684 171.121 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 92.8 mt -78.01 173.63 11.98 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 178.722 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 4.4 pp -121.25 153.94 58.53 Favored Pre-proline 0 CA--C 1.547 0.857 0 C-N-CA 126.005 1.722 . . . . 0.0 110.641 173.769 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -73.51 151.69 47.81 Favored 'Trans proline' 0 CA--C 1.545 1.061 0 C-N-CA 122.654 2.236 . . . . 0.0 113.398 -169.528 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -72.46 167.78 26.1 Favored 'Trans proline' 0 CA--C 1.54 0.777 0 C-N-CA 123.878 3.052 . . . . 0.0 112.737 177.288 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -61.02 150.53 78.14 Favored Pre-proline 0 CA--C 1.551 1.019 0 C-N-CA 124.238 1.015 . . . . 0.0 112.71 174.218 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -75.03 76.57 3.37 Favored 'Trans proline' 0 CA--C 1.545 1.051 0 C-N-CA 124.513 3.475 . . . . 0.0 112.086 178.941 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -134.97 155.64 50.41 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 126.241 1.816 . . . . 0.0 111.562 -178.381 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . -78.13 161.89 49.39 Favored Glycine 0 CA--C 1.536 1.375 0 C-N-CA 124.008 0.813 . . . . 0.0 113.491 176.902 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt . . . . . 0 C--O 1.252 1.221 0 C-N-CA 125.938 1.695 . . . . 0.0 111.351 -179.912 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.424 0 N-CA-C 110.883 -0.887 . . . . 0.0 110.883 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 23.2 t -53.44 133.53 40.59 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.87 0.868 . . . . 0.0 111.752 177.004 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 60.2 m -138.11 26.18 2.7 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.957 1.303 . . . . 0.0 113.29 -168.662 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -60.12 155.99 30.15 Favored Glycine 0 CA--C 1.54 1.595 0 C-N-CA 124.266 0.936 . . . . 0.0 114.173 176.854 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 16.7 m -72.73 -18.8 61.48 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 114.905 1.446 . . . . 0.0 114.905 -173.664 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 35.6 m -67.73 168.77 10.73 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.161 1.385 . . . . 0.0 113.446 179.191 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -141.0 156.58 25.59 Favored Glycine 0 CA--C 1.534 1.276 0 C-N-CA 124.993 1.282 . . . . 0.0 112.755 173.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -78.87 154.93 29.36 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.325 1.05 . . . . 0.0 113.65 -174.644 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 29.6 m -134.36 -11.59 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 C-N-CA 125.239 1.416 . . . . 0.0 113.614 178.271 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 81.2 p -145.99 149.77 34.78 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 126.38 1.872 . . . . 0.0 109.995 171.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -154.36 145.96 16.82 Favored Pre-proline 0 CA--C 1.55 0.954 0 C-N-CA 123.967 0.907 . . . . 0.0 112.929 -170.631 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -87.92 -27.45 0.54 Allowed 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 123.622 2.881 . . . . 0.0 113.322 174.247 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 24.9 m -83.68 -38.02 22.0 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 -168.926 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 34.2 ttmt -80.31 134.67 54.9 Favored Pre-proline 0 N--CA 1.476 0.864 0 C-N-CA 123.54 0.736 . . . . 0.0 109.952 176.441 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_endo -71.37 154.67 60.94 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 122.361 2.04 . . . . 0.0 111.754 174.347 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -173.65 159.81 29.72 Favored Glycine 0 CA--C 1.53 0.974 0 C-N-CA 123.976 0.798 . . . . 0.0 113.314 176.06 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.5 ptt180 -157.53 164.84 36.94 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.39 1.876 . . . . 0.0 110.601 174.019 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 8.3 mmmt -71.48 121.02 17.9 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.878 1.271 . . . . 0.0 111.419 170.259 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 34.3 p -135.02 160.01 39.67 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 125.027 1.331 . . . . 0.0 112.376 -179.254 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 36.1 t30 -53.69 -33.21 54.69 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.808 1.643 . . . . 0.0 114.53 174.92 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 70.1 mm-40 -62.93 -56.94 12.81 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.041 0.936 . . . . 0.0 111.148 170.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 89.8 mt -65.42 -31.37 72.43 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 179.306 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.47 ' HB2' HD11 ' A' ' 147' ' ' LEU . 21.9 tt0 -58.44 -55.25 37.4 Favored 'General case' 0 C--O 1.223 -0.298 0 C-N-CA 123.332 0.653 . . . . 0.0 110.082 169.693 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -57.29 -40.61 78.17 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 118.819 0.736 . . . . 0.0 112.305 -178.74 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 95.3 mmm -56.8 -52.36 65.35 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 121.856 -0.527 . . . . 0.0 112.373 172.426 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -83.64 -10.31 58.3 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 114.904 1.446 . . . . 0.0 114.904 -174.323 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -116.75 -18.6 10.21 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.477 1.511 . . . . 0.0 112.744 -170.069 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 10.9 t -133.03 -53.08 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 C-N-CA 123.574 0.75 . . . . 0.0 111.628 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.7 t -66.0 -63.99 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 CA-C-N 118.856 0.753 . . . . 0.0 110.599 -175.41 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 82.8 t -57.15 -47.59 83.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 124.022 0.929 . . . . 0.0 109.757 172.021 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.0 tptp -57.34 -43.12 83.16 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 113.442 0.904 . . . . 0.0 113.442 -171.554 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 91.2 m -77.67 -42.95 32.83 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 118.915 0.78 . . . . 0.0 112.556 174.843 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 79.7 mt -58.31 -30.85 66.99 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.397 0.998 . . . . 0.0 112.258 175.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 40.9 t-105 -75.77 -35.51 60.1 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 126.521 1.929 . . . . 0.0 114.129 179.171 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 21.6 pttp -88.93 -3.64 58.68 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 114.244 1.202 . . . . 0.0 114.244 178.937 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 60.1 t-80 -54.31 152.67 6.1 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.99 2.116 . . . . 0.0 113.318 173.088 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 22.8 tp60 -56.8 -21.39 28.44 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 126.158 1.783 . . . . 0.0 114.738 177.308 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -123.19 15.2 9.81 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.43 1.492 . . . . 0.0 114.077 -173.507 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.06 -27.39 62.65 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 114.444 1.276 . . . . 0.0 114.444 179.832 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' TRP . . . . . 0.401 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 38.0 p-90 -55.64 -37.14 53.72 Favored Pre-proline 0 CA--C 1.55 0.958 0 N-CA-C 117.725 2.491 . . . . 0.0 117.725 -170.853 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.401 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 85.5 Cg_endo -73.28 -5.49 17.24 Favored 'Trans proline' 0 CA--C 1.543 0.949 0 CA-C-N 123.249 2.196 . . . . 0.0 114.022 174.219 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 62.0 m-85 -107.47 -5.53 17.59 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.479 1.512 . . . . 0.0 112.918 179.086 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -64.29 -14.79 58.04 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.673 1.36 . . . . 0.0 114.673 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -138.87 153.98 72.4 Favored Pre-proline 0 CA--C 1.543 0.688 0 C-N-CA 125.597 1.559 . . . . 0.0 110.146 -179.377 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -65.41 149.11 88.4 Favored 'Trans proline' 0 CA--C 1.537 0.632 0 C-N-CA 122.595 2.197 . . . . 0.0 111.898 174.685 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 74.0 t -58.58 138.04 20.14 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 123.505 0.722 . . . . 0.0 110.991 171.702 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -128.7 106.62 9.06 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 125.547 1.539 . . . . 0.0 108.841 171.593 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.08 -28.0 64.16 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.276 1.03 . . . . 0.0 113.576 -178.874 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 79.7 mt -66.94 -50.91 60.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 124.751 1.22 . . . . 0.0 110.913 172.863 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 56.6 mttm -66.09 -39.33 89.9 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.771 1.228 . . . . 0.0 112.854 -177.587 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 55.3 mt -91.29 1.0 57.43 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.851 1.26 . . . . 0.0 113.745 179.624 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 65.0 t30 51.42 53.54 12.65 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 126.237 1.815 . . . . 0.0 113.768 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 36.0 mt -107.47 98.26 22.94 Favored Pre-proline 0 CA--C 1.544 0.718 0 C-N-CA 125.802 1.641 . . . . 0.0 109.769 -177.886 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -69.11 -10.55 29.4 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 122.984 2.456 . . . . 0.0 114.744 -171.318 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -139.95 17.54 2.47 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.261 1.424 . . . . 0.0 113.384 -173.337 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -47.99 -52.01 21.57 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-N 120.025 1.284 . . . . 0.0 113.729 -172.248 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -75.37 -9.62 58.72 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.166 1.387 . . . . 0.0 114.38 -178.7 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 29.4 mmmt -78.7 -44.85 22.63 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 121.229 -0.92 . . . . 0.0 110.59 174.337 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.3 mp -74.14 -45.35 48.13 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 124.111 0.964 . . . . 0.0 110.426 173.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 35.3 mm -101.24 109.97 26.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 CA-C-O 122.252 1.025 . . . . 0.0 111.896 -175.6 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.5 mptp? -79.49 -29.77 41.74 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.754 1.622 . . . . 0.0 113.0 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -138.06 85.1 19.65 Favored Pre-proline 0 CA--C 1.544 0.737 0 C-N-CA 125.207 1.403 . . . . 0.0 110.463 -178.836 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -73.15 144.89 38.28 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 123.529 2.82 . . . . 0.0 111.058 176.369 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.8 tpt -155.0 142.18 19.38 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.969 1.307 . . . . 0.0 110.508 -178.575 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 20.4 m-20 -146.36 150.44 35.69 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.639 1.576 . . . . 0.0 111.422 -175.964 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.9 ttp -61.13 -35.73 77.86 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.331 1.052 . . . . 0.0 112.743 -173.169 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -59.93 -21.86 56.5 Favored Glycine 0 CA--C 1.537 1.428 0 C-N-CA 125.625 1.583 . . . . 0.0 114.433 171.883 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 19.2 m -98.27 -34.08 10.84 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.208 1.403 . . . . 0.0 111.81 174.134 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 90.0 mt -55.36 -50.38 65.75 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 CA-C-N 119.538 1.063 . . . . 0.0 110.655 172.467 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -60.16 -37.04 78.94 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 113.218 0.822 . . . . 0.0 113.218 176.943 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.435 ' HA ' ' HE2' ' A' ' 88' ' ' LYS . 0.5 OUTLIER -62.09 -36.32 81.35 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.319 1.048 . . . . 0.0 113.008 -177.761 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 6.2 ptp180 -80.53 -32.35 36.8 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 173.83 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 65.0 mt -62.01 -32.1 72.55 Favored 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 114.447 1.277 . . . . 0.0 114.447 169.225 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -64.38 -12.23 40.64 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 114.745 1.387 . . . . 0.0 114.745 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 6.9 p30 -134.89 176.27 8.81 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.781 1.632 . . . . 0.0 112.851 177.033 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -78.03 44.94 0.5 Allowed 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 125.286 1.435 . . . . 0.0 113.126 -177.919 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 50.9 t80 -65.18 -30.69 71.62 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 121.278 -0.889 . . . . 0.0 112.977 -174.7 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -141.01 172.16 13.06 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 127.249 2.22 . . . . 0.0 111.479 176.796 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 15.8 t-105 -95.45 -22.25 17.81 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.42 1.088 . . . . 0.0 113.23 177.815 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 24.2 t -145.07 153.22 41.21 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.581 1.152 . . . . 0.0 113.448 -169.889 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -65.18 -21.24 66.74 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 116.285 1.957 . . . . 0.0 116.285 -175.442 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 15.2 m -58.84 -32.7 69.65 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 119.485 1.039 . . . . 0.0 113.24 -175.858 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -63.85 -44.07 94.24 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.408 -0.808 . . . . 0.0 112.17 173.601 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 50.5 t -64.21 -38.07 89.74 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.036 0.935 . . . . 0.0 112.117 175.143 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 78.3 mtp -62.43 -41.12 98.47 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.272 -0.892 . . . . 0.0 112.393 173.581 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -61.39 -39.65 91.46 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 112.27 0.471 . . . . 0.0 112.27 170.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -65.81 -39.85 91.3 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 118.963 0.801 . . . . 0.0 112.713 177.343 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 -60.05 -45.37 93.08 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 121.51 -0.744 . . . . 0.0 112.369 170.485 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 18.1 t30 -57.72 -46.81 83.9 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 121.875 -0.516 . . . . 0.0 112.023 174.628 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 93.1 m -65.36 -34.45 78.36 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.888 0.875 . . . . 0.0 112.764 177.398 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 50.9 ttp -61.21 -55.21 34.77 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 119.608 1.095 . . . . 0.0 111.844 174.495 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 24.0 m-85 -65.18 -38.36 90.24 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 122.004 -0.435 . . . . 0.0 111.977 179.536 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 88.6 m -64.69 -47.78 77.13 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 123.601 0.761 . . . . 0.0 112.397 179.009 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.1 p30 -64.67 -31.28 72.43 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 119.774 1.17 . . . . 0.0 112.568 -179.726 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 56.1 m -60.95 -44.24 97.57 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.542 0.737 . . . . 0.0 112.547 169.522 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -67.84 -31.32 71.07 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 113.736 1.013 . . . . 0.0 113.736 177.291 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 80.9 mt -72.17 -56.65 9.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 123.343 0.657 . . . . 0.0 110.617 177.042 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 41.9 t80 -67.31 -30.54 70.41 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 114.152 1.168 . . . . 0.0 114.152 -173.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -113.47 156.35 23.69 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.03 0.932 . . . . 0.0 112.361 -171.577 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 3.0 mppt? -67.43 148.68 98.64 Favored Pre-proline 0 N--CA 1.471 0.576 0 C-N-CA 124.684 1.194 . . . . 0.0 110.666 176.213 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -65.46 -7.23 15.42 Favored 'Trans proline' 0 CA--C 1.544 0.976 0 C-N-CA 123.749 2.966 . . . . 0.0 114.674 -176.243 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 43.5 p -108.55 -4.74 16.94 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 127.123 2.169 . . . . 0.0 113.268 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -67.79 146.55 53.61 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 118.883 0.765 . . . . 0.0 110.821 174.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -53.27 -47.76 68.85 Favored 'General case' 0 N--CA 1.469 0.519 0 O-C-N 121.59 -0.694 . . . . 0.0 112.258 179.097 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.2 tp -57.39 -30.03 34.79 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 C-N-CA 124.298 1.039 . . . . 0.0 113.786 -178.778 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 42.5 t -71.99 -48.52 49.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 O-C-N 121.535 -0.728 . . . . 0.0 110.442 174.004 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 79.8 mt -61.13 -36.96 81.16 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 118.978 0.808 . . . . 0.0 111.857 177.508 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 13.5 mtt -58.55 -52.73 64.43 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.919 1.288 . . . . 0.0 111.965 169.888 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.61 -38.75 88.76 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.464 0.706 . . . . 0.0 112.704 177.761 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -59.48 -51.11 71.27 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 119.229 0.922 . . . . 0.0 111.687 173.26 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.57 -43.28 99.19 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.752 0.821 . . . . 0.0 112.844 179.725 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 80.0 mt -62.95 -43.75 97.94 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.718 0.807 . . . . 0.0 111.748 173.569 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -60.9 -39.13 88.14 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 121.018 -1.051 . . . . 0.0 112.699 -179.111 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 7.2 mmpt? -61.69 -37.99 86.15 Favored 'General case' 0 N--CA 1.476 0.871 0 O-C-N 121.191 -0.943 . . . . 0.0 111.304 178.027 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 77.7 mt -74.41 -39.95 48.79 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 C-N-CA 123.685 0.794 . . . . 0.0 111.312 176.611 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -51.53 -51.36 55.95 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 118.943 0.792 . . . . 0.0 110.411 172.229 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 93.1 mt -63.67 -40.79 97.71 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 118.532 -0.747 . . . . 0.0 112.819 177.918 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -67.18 -32.69 73.95 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 120.327 1.421 . . . . 0.0 112.426 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 65.3 mmtt -71.23 -53.4 14.49 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.952 0.901 . . . . 0.0 111.753 175.49 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.4 m -65.48 -25.15 36.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 CA-C-N 120.326 1.421 . . . . 0.0 112.222 179.662 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -64.42 -34.9 79.26 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 171.588 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -84.3 -13.28 52.9 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.475 1.11 . . . . 0.0 113.087 173.532 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 48.0 ttp -61.62 141.97 94.6 Favored Pre-proline 0 CA--C 1.543 0.704 0 CA-C-N 119.262 0.937 . . . . 0.0 110.564 172.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -60.53 152.2 69.87 Favored 'Trans proline' 0 CA--C 1.538 0.705 0 C-N-CA 122.716 2.277 . . . . 0.0 111.205 172.504 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -88.8 -21.17 23.9 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 121.777 -0.577 . . . . 0.0 112.388 172.23 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -84.75 167.16 16.37 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.835 1.254 . . . . 0.0 112.396 172.901 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -137.13 146.76 45.42 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.76 1.224 . . . . 0.0 111.175 -176.848 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 8.2 p -144.16 145.18 21.99 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 C-N-CA 124.899 1.279 . . . . 0.0 110.437 176.344 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -69.38 137.92 53.23 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.429 0.692 . . . . 0.0 111.246 173.12 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 147' ' ' LEU . . . . . 0.47 HD11 ' HB2' ' A' ' 40' ' ' GLN . 83.4 mt -78.46 173.65 12.14 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 113.886 1.069 . . . . 0.0 113.886 -175.666 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 98.3 mt -119.68 153.99 54.61 Favored Pre-proline 0 CA--C 1.547 0.831 0 C-N-CA 126.479 1.912 . . . . 0.0 110.615 177.398 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -71.69 155.39 58.79 Favored 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 122.975 2.45 . . . . 0.0 112.661 -176.349 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -71.8 158.6 52.71 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 123.43 2.753 . . . . 0.0 112.322 177.361 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -70.96 152.05 95.0 Favored Pre-proline 0 CA--C 1.553 1.072 0 C-N-CA 123.978 0.911 . . . . 0.0 112.709 176.45 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -75.68 -176.71 3.13 Favored 'Trans proline' 0 CA--C 1.546 1.103 0 C-N-CA 123.861 3.041 . . . . 0.0 112.018 171.09 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 63.6 tttm -47.99 -44.26 30.51 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 126.114 1.766 . . . . 0.0 114.547 -178.143 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . 167.61 31.13 0.02 OUTLIER Glycine 0 CA--C 1.538 1.472 0 N-CA-C 115.338 0.895 . . . . 0.0 115.338 -179.335 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 4.4 mptp? . . . . . 0 C--O 1.252 1.205 0 C-N-CA 125.237 1.415 . . . . 0.0 112.149 -178.994 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.456 0 N-CA-C 111.763 -0.535 . . . . 0.0 111.763 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 42.2 p -67.83 -19.54 65.07 Favored 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 114.735 1.383 . . . . 0.0 114.735 179.495 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 78.8 p -154.17 169.82 22.68 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 126.0 1.72 . . . . 0.0 111.863 178.89 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -167.48 26.98 0.15 Allowed Glycine 0 CA--C 1.536 1.402 0 C-N-CA 123.996 0.808 . . . . 0.0 114.783 -178.849 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 12.5 t -60.97 152.92 26.46 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.458 1.103 . . . . 0.0 112.976 -177.025 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.1 m -161.0 153.44 20.46 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.826 1.25 . . . . 0.0 112.716 174.174 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -177.31 -31.24 0.05 OUTLIER Glycine 0 CA--C 1.538 1.485 0 C-N-CA 125.973 1.749 . . . . 0.0 112.957 174.631 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.57 166.98 22.74 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 126.182 1.793 . . . . 0.0 112.352 168.023 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 19.6 m -136.28 -6.71 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.294 0 C-N-CA 124.943 1.297 . . . . 0.0 113.811 -177.204 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.3 t -149.09 144.86 26.94 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 125.252 1.421 . . . . 0.0 110.877 179.509 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -90.71 152.47 44.9 Favored Pre-proline 0 CA--C 1.55 0.964 0 N-CA-C 113.234 0.828 . . . . 0.0 113.234 -171.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -83.19 -29.46 1.18 Allowed 'Trans proline' 0 CA--C 1.542 0.917 0 C-N-CA 123.607 2.871 . . . . 0.0 113.303 173.782 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.5 t -158.24 -13.67 0.07 Allowed 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 115.484 1.661 . . . . 0.0 115.484 -172.519 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.3 mtpm? -58.9 152.99 46.27 Favored Pre-proline 0 N--CA 1.482 1.159 0 C-N-CA 124.389 1.076 . . . . 0.0 112.668 -178.819 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -67.82 144.14 63.95 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 121.99 1.793 . . . . 0.0 111.547 169.652 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 162.17 150.39 5.96 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 124.981 1.277 . . . . 0.0 113.251 174.811 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 8.0 ptm180 -164.63 165.44 21.01 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.761 2.025 . . . . 0.0 110.87 175.232 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 30.7 tttp -61.83 132.23 52.4 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.143 1.377 . . . . 0.0 110.938 173.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 48.9 p -139.38 165.04 28.26 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.967 1.707 . . . . 0.0 110.141 178.876 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 24.8 t30 -52.6 -32.49 41.69 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 175.929 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 63.4 mm-40 -60.68 -59.92 4.62 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.535 1.134 . . . . 0.0 111.616 169.663 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 94.5 mt -67.12 -32.21 73.2 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.215 1.006 . . . . 0.0 112.911 -177.297 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 -58.8 -51.34 70.42 Favored 'General case' 0 C--O 1.225 -0.225 0 C-N-CA 124.362 1.065 . . . . 0.0 110.223 170.031 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 49.8 t80 -58.07 -39.34 78.27 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 118.909 0.777 . . . . 0.0 112.347 178.366 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 89.0 mmm -57.08 -55.04 39.89 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 121.662 -0.649 . . . . 0.0 112.266 172.308 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -82.32 -4.44 57.23 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 115.108 1.521 . . . . 0.0 115.108 -175.2 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -117.21 -19.64 9.56 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.247 1.419 . . . . 0.0 112.778 -174.041 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.6 t -133.47 -52.72 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 CA-C-O 118.757 -0.64 . . . . 0.0 112.266 179.202 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.8 t -69.08 -67.71 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 CA-C-N 118.794 0.724 . . . . 0.0 110.848 -172.621 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 99.3 t -57.07 -46.11 84.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.928 1.291 . . . . 0.0 109.743 171.587 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 40.3 tptt -58.77 -22.22 57.56 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 114.301 1.222 . . . . 0.0 114.301 -176.233 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 34.2 m -99.43 -41.09 7.56 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.196 0.998 . . . . 0.0 113.151 172.717 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 62.3 mt -60.05 -28.95 68.2 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.257 0.935 . . . . 0.0 112.682 173.842 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 36.0 t-105 -79.04 -33.85 44.38 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 127.123 2.169 . . . . 0.0 113.843 178.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 61.2 pttt -86.56 -5.18 59.21 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 175.682 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 57.4 t-80 -54.28 152.53 6.19 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.507 1.923 . . . . 0.0 113.473 174.526 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 22.7 tp60 -56.83 -21.13 26.66 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 126.029 1.732 . . . . 0.0 114.676 176.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -124.35 19.66 8.91 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.409 1.484 . . . . 0.0 113.916 -175.068 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -74.0 -24.69 59.62 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 114.106 1.151 . . . . 0.0 114.106 175.837 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' TRP . . . . . 0.423 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 49.4 p-90 -57.17 -36.4 46.1 Favored Pre-proline 0 CA--C 1.548 0.876 0 N-CA-C 117.206 2.299 . . . . 0.0 117.206 -173.508 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.423 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 85.0 Cg_endo -74.82 0.02 9.33 Favored 'Trans proline' 0 CA--C 1.545 1.039 0 CA-C-N 123.013 2.112 . . . . 0.0 113.934 171.514 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -117.98 6.19 12.15 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.96 1.704 . . . . 0.0 113.321 -178.83 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 23.3 m-30 -72.31 -14.22 61.69 Favored 'General case' 0 CA--C 1.545 0.758 0 O-C-N 120.28 -1.512 . . . . 0.0 114.059 176.735 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 89.1 mt-30 -151.57 145.99 18.41 Favored Pre-proline 0 CA--C 1.544 0.724 0 C-N-CA 125.233 1.413 . . . . 0.0 110.536 -177.835 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -65.36 151.65 84.49 Favored 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 123.383 2.722 . . . . 0.0 112.765 -178.218 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 41.6 t -64.17 135.79 27.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 124.737 1.215 . . . . 0.0 111.071 -178.703 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 52.8 m-20 -112.71 92.41 4.01 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.925 1.29 . . . . 0.0 110.163 175.33 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.57 -27.42 38.79 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.286 1.034 . . . . 0.0 113.682 175.651 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 81.8 mt -65.71 -49.6 76.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 C-N-CA 125.392 1.477 . . . . 0.0 111.104 173.806 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -65.99 -38.92 89.73 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.48 1.112 . . . . 0.0 112.589 179.21 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 90.3 mt -87.35 -3.6 59.03 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.893 1.677 . . . . 0.0 113.518 -177.268 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 51.14 56.55 7.81 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 125.584 1.554 . . . . 0.0 113.01 -176.424 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 58.0 mt -113.87 78.36 4.05 Favored Pre-proline 0 CA--C 1.543 0.7 0 C-N-CA 126.157 1.783 . . . . 0.0 110.651 -179.811 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -66.28 -17.2 53.87 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 123.323 2.682 . . . . 0.0 113.101 -177.68 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 -100.35 7.13 44.52 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.884 1.674 . . . . 0.0 113.184 175.681 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 85.8 t80 -52.28 -57.62 9.16 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 120.015 1.28 . . . . 0.0 112.117 -177.474 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -74.81 -11.65 60.2 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.888 1.275 . . . . 0.0 114.33 179.606 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 10.1 mptt -72.7 -32.54 65.83 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 121.263 -0.898 . . . . 0.0 111.296 176.349 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.2 mp -99.07 -48.71 11.86 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 125.439 1.496 . . . . 0.0 111.088 175.003 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 28.0 mm -67.18 110.95 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 C-N-CA 123.66 0.784 . . . . 0.0 110.082 178.48 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -68.25 -44.87 74.65 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.972 0.909 . . . . 0.0 112.113 -178.441 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 71.5 m-80 -150.22 117.83 3.56 Favored Pre-proline 0 CA--C 1.546 0.789 0 C-N-CA 126.5 1.92 . . . . 0.0 109.075 173.839 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -74.24 146.95 36.76 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 123.116 2.544 . . . . 0.0 111.478 177.346 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.0 tpt -156.25 146.68 21.63 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.984 1.314 . . . . 0.0 110.52 176.678 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -152.11 153.22 33.48 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.258 1.423 . . . . 0.0 112.099 -171.881 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 2.7 ttp -64.74 -38.3 90.53 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.197 0.599 . . . . 0.0 112.456 -175.426 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -59.26 -34.09 78.49 Favored Glycine 0 CA--C 1.53 1.02 0 C-N-CA 124.63 1.11 . . . . 0.0 113.056 173.552 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 24.2 m -76.23 -47.17 24.91 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 117.868 0.834 . . . . 0.0 111.278 172.056 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 86.7 mt -52.66 -53.14 21.98 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.197 0 C-N-CA 124.568 1.147 . . . . 0.0 111.247 178.128 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.37 -30.42 71.24 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -178.964 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.402 ' HE3' ' HA ' ' A' ' 88' ' ' LYS . 0.1 OUTLIER -65.02 -40.0 94.21 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 117.712 -1.137 . . . . 0.0 113.413 171.012 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . 0.275 6.4 ptp180 -72.68 -30.03 63.9 Favored 'General case' 0 N--CA 1.484 1.24 0 CA-C-N 120.544 1.52 . . . . 0.0 114.135 172.712 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 86.9 mt -66.87 -36.14 81.63 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 119.763 1.165 . . . . 0.0 112.949 167.679 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 88.5 mt-10 -78.02 9.33 3.74 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.685 1.594 . . . . 0.0 113.704 178.308 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 38.8 m-80 -138.42 166.79 23.35 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 127.023 2.129 . . . . 0.0 111.788 179.671 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 13.9 p-10 -79.96 108.41 13.51 Favored 'General case' 0 CA--C 1.544 0.719 0 O-C-N 121.4 -0.813 . . . . 0.0 109.773 168.777 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 49.4 t80 -140.36 -46.26 0.42 Allowed 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -178.277 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -133.15 177.0 8.01 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.836 2.054 . . . . 0.0 111.625 178.427 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.3 t-105 -112.99 -21.86 10.89 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.898 1.279 . . . . 0.0 112.787 -177.598 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 28.2 t -138.07 142.95 40.27 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.046 -1.034 . . . . 0.0 112.337 -172.74 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -68.89 -13.55 62.49 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 115.316 1.599 . . . . 0.0 115.316 -173.647 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 23.2 m -55.45 -29.97 59.66 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 119.412 1.006 . . . . 0.0 112.775 173.873 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 40.0 mm-40 -72.5 -41.37 66.01 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.202 -0.936 . . . . 0.0 112.258 174.953 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 42.2 t -62.23 -38.24 88.45 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.025 0.93 . . . . 0.0 111.998 172.209 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 82.9 mtp -65.6 -40.67 92.92 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 124.124 0.969 . . . . 0.0 112.171 174.885 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 62.6 mt-30 -59.96 -44.5 94.39 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 122.895 0.478 . . . . 0.0 111.606 171.072 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -64.44 -38.56 91.46 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 118.797 0.726 . . . . 0.0 112.663 178.173 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -61.21 -45.04 96.22 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 121.265 -0.897 . . . . 0.0 112.357 170.002 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 33.2 t30 -59.22 -43.05 92.32 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 121.506 -0.747 . . . . 0.0 111.963 174.722 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 85.0 m -62.69 -39.51 94.21 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.192 0.997 . . . . 0.0 112.414 174.835 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 12.9 ttm -58.2 -60.88 3.07 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 119.485 1.039 . . . . 0.0 111.272 174.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -61.01 -41.0 95.68 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.035 0.534 . . . . 0.0 111.966 -177.506 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 77.3 m -64.46 -47.93 77.18 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.294 0.638 . . . . 0.0 112.083 178.706 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -64.7 -31.93 73.38 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 119.493 1.042 . . . . 0.0 112.643 -178.687 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 40.8 m -59.91 -43.7 94.73 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.906 0.883 . . . . 0.0 112.516 169.647 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -68.9 -29.17 67.39 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 179.106 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 86.1 mt -72.25 -57.47 7.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 123.256 0.622 . . . . 0.0 110.906 178.787 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -71.62 -35.03 70.32 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -171.221 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 59.5 m-80 -95.99 162.65 13.47 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.456 1.103 . . . . 0.0 111.733 -178.651 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -73.45 152.07 89.74 Favored Pre-proline 0 N--CA 1.474 0.764 0 O-C-N 121.261 -0.9 . . . . 0.0 110.426 170.545 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -65.87 -1.67 5.45 Favored 'Trans proline' 0 CA--C 1.544 1.019 0 C-N-CA 123.569 2.846 . . . . 0.0 114.922 -178.803 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 65.0 p -118.06 -0.62 11.58 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.703 2.001 . . . . 0.0 113.063 -179.609 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 58.5 m-20 -68.48 144.98 54.45 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 118.719 0.69 . . . . 0.0 110.709 170.791 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -55.87 -45.77 78.43 Favored 'General case' 0 N--CA 1.471 0.625 0 O-C-N 121.682 -0.636 . . . . 0.0 112.504 -175.529 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.5 tp -55.32 -30.4 25.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 124.918 1.287 . . . . 0.0 114.058 177.957 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 48.3 t -73.31 -46.56 49.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 O-C-N 121.427 -0.796 . . . . 0.0 110.582 174.06 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 72.4 mt -61.39 -37.15 82.39 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 119.103 0.865 . . . . 0.0 111.523 177.008 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 8.9 mtt -59.63 -51.21 70.77 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.963 1.305 . . . . 0.0 112.04 169.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.97 -38.75 87.03 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.387 0.675 . . . . 0.0 112.701 176.425 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 90.0 mt-30 -62.5 -45.51 92.69 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 119.329 0.968 . . . . 0.0 112.094 173.795 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.25 -44.28 96.91 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.543 0.737 . . . . 0.0 112.473 177.045 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 85.2 mt -65.4 -45.67 83.06 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.913 0.885 . . . . 0.0 112.042 174.842 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.94 -37.68 88.02 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.138 -0.976 . . . . 0.0 113.075 -176.502 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 55.7 mtmt -58.85 -46.16 88.37 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 121.744 -0.598 . . . . 0.0 111.727 172.883 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 89.6 mt -67.6 -43.9 86.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 123.429 0.692 . . . . 0.0 110.702 178.142 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 34.0 t80 -50.57 -51.09 51.42 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.851 0.861 . . . . 0.0 111.095 174.608 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 99.6 mt -64.0 -40.26 95.96 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 178.766 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 82.8 mm-40 -62.64 -37.25 85.6 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 119.42 1.009 . . . . 0.0 113.004 173.576 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 33.2 mmtm -70.99 -52.66 18.35 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.111 1.364 . . . . 0.0 111.47 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.5 m -67.44 -25.16 32.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 CA-C-N 119.603 1.092 . . . . 0.0 112.366 178.395 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -62.22 -30.4 71.06 Favored 'General case' 0 CA--C 1.54 0.582 0 O-C-N 121.573 -0.705 . . . . 0.0 112.703 172.043 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -88.77 -9.16 52.86 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.478 1.111 . . . . 0.0 112.844 174.92 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 40.1 ttp -67.26 145.2 98.55 Favored Pre-proline 0 CA--C 1.545 0.786 0 C-N-CA 124.074 0.95 . . . . 0.0 110.347 170.033 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -60.13 156.75 38.0 Favored 'Trans proline' 0 CA--C 1.539 0.737 0 C-N-CA 123.23 2.62 . . . . 0.0 111.63 170.159 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.25 -26.74 19.91 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.503 0.721 . . . . 0.0 112.893 172.152 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -85.7 170.38 12.56 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 126.254 1.822 . . . . 0.0 111.333 171.743 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -132.57 171.72 13.45 Favored 'General case' 0 CA--C 1.533 0.304 0 O-C-N 120.683 -1.261 . . . . 0.0 112.294 173.992 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 15.0 p -152.2 142.74 15.5 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 C-N-CA 124.033 0.933 . . . . 0.0 110.656 174.05 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -64.88 136.88 57.36 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.701 1.6 . . . . 0.0 111.686 173.615 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 59.8 mt -99.65 161.36 13.66 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.069 0.947 . . . . 0.0 113.327 -174.054 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 99.3 mt -63.0 156.24 68.54 Favored Pre-proline 0 CA--C 1.55 0.981 0 C-N-CA 125.092 1.357 . . . . 0.0 112.133 169.585 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -71.62 158.78 52.79 Favored 'Trans proline' 0 CA--C 1.546 1.124 0 C-N-CA 123.082 2.521 . . . . 0.0 112.153 176.196 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -71.18 159.68 51.33 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 123.297 2.664 . . . . 0.0 112.619 178.054 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -66.43 153.79 92.17 Favored Pre-proline 0 CA--C 1.552 1.03 0 C-N-CA 124.205 1.002 . . . . 0.0 112.473 174.467 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.44 114.03 3.33 Favored 'Trans proline' 0 CA--C 1.539 0.75 0 C-N-CA 123.413 2.742 . . . . 0.0 110.775 173.27 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -142.79 174.11 10.95 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 126.197 1.799 . . . . 0.0 111.952 -170.977 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . -157.06 -168.94 20.36 Favored Glycine 0 CA--C 1.536 1.35 0 C-N-CA 125.522 1.534 . . . . 0.0 113.375 -178.658 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 36.7 mtmm . . . . . 0 C--O 1.254 1.332 0 C-N-CA 125.89 1.676 . . . . 0.0 113.501 179.955 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.485 0 N-CA-C 111.808 -0.517 . . . . 0.0 111.808 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 59.8 p -75.88 -15.14 60.25 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 115.24 1.57 . . . . 0.0 115.24 -177.253 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.4 t -63.68 144.35 57.09 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.247 1.019 . . . . 0.0 112.506 177.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 179.97 32.76 0.06 OUTLIER Glycine 0 CA--C 1.536 1.363 0 N-CA-C 114.983 0.753 . . . . 0.0 114.983 -176.879 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 22.4 p -63.66 -46.88 83.59 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.305 1.042 . . . . 0.0 113.07 179.232 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.9 p -64.29 148.91 49.18 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 125.481 1.513 . . . . 0.0 113.759 -178.747 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -102.76 -174.56 26.86 Favored Glycine 0 CA--C 1.535 1.334 0 C-N-CA 124.897 1.237 . . . . 0.0 114.199 179.555 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -132.99 172.63 12.37 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 126.33 1.852 . . . . 0.0 112.902 -170.518 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 20.5 m -131.74 7.79 1.75 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 C-N-CA 124.66 1.184 . . . . 0.0 113.461 -176.55 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 11.7 t -148.11 166.71 27.01 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 127.526 2.33 . . . . 0.0 110.085 175.168 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -142.46 149.37 50.77 Favored Pre-proline 0 CA--C 1.545 0.76 0 C-N-CA 124.423 1.089 . . . . 0.0 113.417 -172.861 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -74.01 -32.19 7.27 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.34 2.694 . . . . 0.0 113.567 177.447 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 7.7 t -156.18 -5.09 0.12 Allowed 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 116.566 2.061 . . . . 0.0 116.566 -175.536 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 34.9 ttpt -63.98 131.35 94.93 Favored Pre-proline 0 N--CA 1.481 1.098 0 CA-C-N 120.72 1.6 . . . . 0.0 110.761 179.545 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -71.93 156.34 56.51 Favored 'Trans proline' 0 CA--C 1.54 0.778 0 C-N-CA 122.658 2.239 . . . . 0.0 112.631 -178.657 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -178.29 160.65 26.9 Favored Glycine 0 CA--C 1.532 1.119 0 C-N-CA 124.255 0.931 . . . . 0.0 113.59 176.317 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 32.3 ptt180 -163.23 159.55 22.94 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 126.739 2.016 . . . . 0.0 110.721 172.717 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.2 tttm -71.11 137.25 48.72 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.192 0.997 . . . . 0.0 111.244 174.828 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 76.0 p -144.44 167.24 22.96 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 125.817 1.647 . . . . 0.0 110.922 -175.319 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 25.5 p-10 -51.13 -36.01 38.53 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 113.51 0.929 . . . . 0.0 113.51 169.359 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.5 mm100 -64.67 -54.09 37.24 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.269 1.028 . . . . 0.0 110.762 178.882 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.1 mt -66.97 -34.36 77.59 Favored 'General case' 0 CA--C 1.537 0.442 0 N-CA-C 112.524 0.564 . . . . 0.0 112.524 178.647 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.1 tp60 -57.55 -53.86 53.42 Favored 'General case' 0 C--O 1.222 -0.354 0 C-N-CA 123.036 0.534 . . . . 0.0 110.498 169.957 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 60.5 t80 -56.58 -41.89 77.72 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.348 0.976 . . . . 0.0 112.626 179.701 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 94.8 mmm -57.62 -51.24 70.32 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.69 -0.631 . . . . 0.0 112.184 172.421 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -85.32 -5.29 59.32 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 -173.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 60.0 t30 -124.72 -14.48 6.75 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.764 1.626 . . . . 0.0 113.294 -171.549 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 21.4 t -133.15 -52.8 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 C-N-CA 123.192 0.597 . . . . 0.0 111.058 177.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.4 t -68.95 -65.63 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 123.34 0.656 . . . . 0.0 110.696 -174.488 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 89.9 t -57.8 -46.7 87.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 C-N-CA 124.093 0.957 . . . . 0.0 110.322 173.24 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 69.7 tttt -58.62 -39.19 79.8 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.357 0.663 . . . . 0.0 112.552 -174.734 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 40.9 m -78.03 -43.56 29.05 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 118.461 0.573 . . . . 0.0 112.212 175.651 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 62.8 mt -61.6 -33.32 73.69 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 118.821 0.737 . . . . 0.0 112.411 177.67 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 30.9 t-105 -71.27 -31.44 67.51 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.701 1.6 . . . . 0.0 113.346 176.12 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.7 mtmp? -80.49 -7.42 59.17 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 175.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 53.0 t-80 -63.56 152.94 37.28 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.701 1.2 . . . . 0.0 112.981 -179.853 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 99.9 mm-40 -61.54 -19.63 62.35 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.072 1.349 . . . . 0.0 114.394 177.299 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -117.85 13.06 14.0 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.34 1.456 . . . . 0.0 113.706 -176.289 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.14 -25.93 64.63 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.815 1.246 . . . . 0.0 114.12 177.866 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 69.2 p-90 -56.5 -35.49 35.77 Favored Pre-proline 0 CA--C 1.547 0.865 0 N-CA-C 118.113 2.635 . . . . 0.0 118.113 -169.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -78.71 -6.94 15.54 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 CA-C-N 123.33 2.225 . . . . 0.0 112.985 176.565 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 57.7 m-85 -103.09 -7.67 21.15 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.307 1.443 . . . . 0.0 112.382 179.311 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 20.3 m-30 -62.42 -17.61 59.67 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 114.559 1.318 . . . . 0.0 114.559 179.814 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 89.5 mt-30 -139.7 150.88 64.63 Favored Pre-proline 0 CA--C 1.544 0.727 0 C-N-CA 124.947 1.299 . . . . 0.0 111.127 -179.088 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -70.67 143.89 47.66 Favored 'Trans proline' 0 CA--C 1.537 0.645 0 C-N-CA 123.151 2.567 . . . . 0.0 112.672 178.397 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 63.8 t -64.64 145.32 13.99 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 C-N-CA 124.309 1.043 . . . . 0.0 110.56 169.152 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -130.04 109.51 10.91 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.315 1.446 . . . . 0.0 110.116 173.913 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.32 -29.12 60.86 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.478 1.111 . . . . 0.0 113.645 179.082 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 84.4 mt -66.33 -48.87 79.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 125.227 1.411 . . . . 0.0 110.882 174.488 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 45.9 mmtm -68.46 -39.16 81.54 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.767 1.227 . . . . 0.0 113.126 -178.707 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.5 mp -87.89 -3.97 58.88 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.611 1.164 . . . . 0.0 112.774 179.482 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 52.29 58.15 5.7 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 126.083 1.753 . . . . 0.0 113.243 -177.007 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 44.7 mt -115.63 82.67 10.33 Favored Pre-proline 0 CA--C 1.544 0.749 0 C-N-CA 126.135 1.774 . . . . 0.0 110.512 -177.157 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -67.04 -8.31 21.37 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 123.911 3.074 . . . . 0.0 114.108 -173.419 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 24.9 p-10 -116.02 2.58 13.48 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 127.566 2.346 . . . . 0.0 113.737 179.24 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 58.7 t80 -49.65 -50.68 42.28 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 119.933 1.242 . . . . 0.0 113.199 -175.167 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 99.7 m-70 -76.39 -18.47 58.85 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.878 1.271 . . . . 0.0 114.115 -178.788 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 10.7 mmpt? -69.7 -45.13 68.94 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.071 0.948 . . . . 0.0 110.563 174.654 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.6 mp -72.37 -51.71 27.83 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 C-N-CA 123.44 0.696 . . . . 0.0 109.929 171.241 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 37.7 mm -99.54 103.66 15.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 CA-C-O 122.586 1.184 . . . . 0.0 112.156 -171.774 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 40.3 mmtm -65.47 -32.91 74.78 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.318 1.447 . . . . 0.0 113.146 175.689 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -137.01 76.77 44.87 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 125.217 1.407 . . . . 0.0 111.561 -170.03 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -70.78 128.51 15.19 Favored 'Trans proline' 0 CA--C 1.537 0.658 0 C-N-CA 124.102 3.202 . . . . 0.0 111.052 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 17.7 tpp -155.41 140.99 17.9 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.078 1.751 . . . . 0.0 109.455 -173.461 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -141.26 148.34 39.68 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 127.561 2.344 . . . . 0.0 109.161 172.752 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 13.0 ttp -49.45 -33.11 13.34 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 115.341 1.608 . . . . 0.0 115.341 -170.077 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -57.49 -20.07 36.49 Favored Glycine 0 CA--C 1.538 1.502 0 C-N-CA 125.382 1.468 . . . . 0.0 115.271 173.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 28.7 m -85.58 -40.13 16.6 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.51 1.124 . . . . 0.0 111.694 172.743 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 34.5 mt -56.39 -49.5 76.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 C-N-CA 124.431 1.092 . . . . 0.0 110.945 -177.472 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -58.32 -33.74 69.82 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 178.352 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -70.73 -45.6 64.56 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.415 1.086 . . . . 0.0 112.214 -178.748 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 3.8 ptp180 -69.47 -26.87 64.79 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 113.76 1.022 . . . . 0.0 113.76 172.121 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 45.7 mt -68.97 -42.47 76.56 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 119.339 0.972 . . . . 0.0 113.344 168.922 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -71.73 -36.37 70.45 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.666 0.786 . . . . 0.0 112.83 178.231 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 -74.17 167.62 21.21 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.004 0.922 . . . . 0.0 111.43 169.251 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 61.3 t-20 -89.6 96.51 10.73 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 121.064 -1.022 . . . . 0.0 109.139 168.074 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 57.8 t80 -123.6 -25.61 4.32 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.317 1.047 . . . . 0.0 113.74 -178.313 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -145.61 179.97 7.07 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.737 1.215 . . . . 0.0 113.565 175.814 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 2.3 t-105 -113.0 -27.5 8.04 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 126.057 1.743 . . . . 0.0 112.361 -177.796 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 21.0 p -135.9 137.0 40.95 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 125.164 1.386 . . . . 0.0 112.688 -168.975 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -58.27 -19.88 37.86 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 115.588 1.699 . . . . 0.0 115.588 -178.308 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 11.1 m -56.2 -34.43 66.26 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 119.466 1.03 . . . . 0.0 113.173 176.305 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -67.0 -44.03 81.39 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.508 0.671 . . . . 0.0 111.437 173.447 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 1.9 m -66.53 -33.39 75.57 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 126.046 1.738 . . . . 0.0 112.279 178.953 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 76.0 mtp -68.25 -43.58 77.53 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 125.138 1.375 . . . . 0.0 112.376 172.209 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -63.49 -30.8 71.87 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 118.02 0.373 . . . . 0.0 111.704 176.206 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 93.2 m-20 -68.36 -44.04 76.11 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.727 0.811 . . . . 0.0 112.116 173.212 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -60.54 -45.1 95.11 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 118.936 0.789 . . . . 0.0 112.528 171.956 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 16.8 t30 -56.33 -45.98 80.09 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.241 0.617 . . . . 0.0 111.402 172.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 71.6 m -63.33 -33.36 75.37 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.462 1.105 . . . . 0.0 112.581 176.428 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 12.1 tmm? -68.99 -55.44 10.87 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 124.59 1.156 . . . . 0.0 111.906 -177.751 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 29.6 m-85 -62.58 -39.13 92.74 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.392 0.677 . . . . 0.0 112.423 173.884 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 97.0 m -66.08 -47.19 75.07 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 121.427 -0.796 . . . . 0.0 112.287 -179.662 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -62.98 -30.71 71.8 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 119.891 1.223 . . . . 0.0 112.479 179.473 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 92.1 m -63.45 -43.5 97.21 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.059 0.944 . . . . 0.0 112.54 170.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 15.2 m-30 -65.18 -35.76 82.1 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 175.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 77.6 mt -70.27 -56.83 9.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 C-N-CA 123.214 0.606 . . . . 0.0 110.923 -178.504 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.3 t80 -69.28 -32.5 71.71 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 114.087 1.143 . . . . 0.0 114.087 -172.198 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 60.2 m-80 -101.39 164.76 11.61 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.232 1.013 . . . . 0.0 112.546 -174.235 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -67.07 140.88 96.13 Favored Pre-proline 0 N--CA 1.472 0.659 0 C-N-CA 123.816 0.846 . . . . 0.0 109.831 173.538 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -67.48 -5.32 13.78 Favored 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 123.669 2.912 . . . . 0.0 114.634 -174.637 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 51.7 p -116.6 -0.29 12.45 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.573 1.949 . . . . 0.0 113.187 179.69 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -67.08 151.7 47.13 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 121.601 -0.687 . . . . 0.0 111.222 172.59 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -50.45 -49.88 53.78 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.499 0.719 . . . . 0.0 112.257 178.472 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.5 tp -56.55 -33.18 38.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 -176.843 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 54.6 t -71.25 -49.3 49.14 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 CA-C-O 118.868 -0.586 . . . . 0.0 110.583 173.679 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 76.0 mt -61.47 -37.06 82.24 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.499 1.045 . . . . 0.0 112.115 178.659 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 32.0 mtp -61.97 -48.57 79.77 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 126.027 1.731 . . . . 0.0 111.543 172.281 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.6 -39.72 92.23 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 173.319 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -63.66 -38.7 92.11 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 119.37 0.986 . . . . 0.0 112.696 175.273 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -66.4 -46.32 76.98 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.629 0.772 . . . . 0.0 111.874 175.311 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 86.6 mt -63.73 -44.43 93.58 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.186 0.994 . . . . 0.0 112.308 175.748 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -65.18 -37.06 86.17 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.045 -1.035 . . . . 0.0 113.056 -175.655 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 36.1 mtmm -61.0 -41.94 97.48 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 121.341 -0.85 . . . . 0.0 111.719 172.798 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 81.4 mt -65.62 -45.55 91.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 CA-C-O 118.785 -0.626 . . . . 0.0 110.464 174.669 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 34.1 t80 -50.2 -51.08 47.0 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 119.226 0.921 . . . . 0.0 111.427 174.385 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.4 mt -63.19 -42.24 99.31 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 121.652 -0.655 . . . . 0.0 112.643 179.075 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 93.3 mm-40 -61.56 -36.12 79.73 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 119.341 0.973 . . . . 0.0 113.022 174.086 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 34.5 mmtm -70.98 -53.57 14.38 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.99 1.316 . . . . 0.0 111.409 179.435 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 4.7 m -68.92 -25.54 30.41 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 CA-C-N 119.654 1.115 . . . . 0.0 112.647 179.707 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -59.14 -28.37 66.51 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 173.06 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -93.52 -4.96 50.14 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.943 1.297 . . . . 0.0 112.569 177.603 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 38.8 ttp -67.2 139.16 94.87 Favored Pre-proline 0 CA--C 1.548 0.901 0 C-N-CA 124.028 0.931 . . . . 0.0 110.532 171.577 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -64.91 156.08 64.26 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 123.045 2.497 . . . . 0.0 112.269 175.609 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 62.2 mm-40 -85.37 -16.04 41.2 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.98 0.912 . . . . 0.0 113.172 177.489 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 13.6 mp0 -103.82 146.56 28.46 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.587 1.155 . . . . 0.0 113.097 -175.673 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.43 146.09 27.14 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.305 1.042 . . . . 0.0 111.715 174.056 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 82.4 t -141.46 125.47 16.58 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 C-N-CA 127.338 2.255 . . . . 0.0 108.71 174.071 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -65.61 125.07 24.09 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.84 1.656 . . . . 0.0 111.329 169.921 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 90.6 mt -78.17 159.98 28.26 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.485 0.714 . . . . 0.0 112.75 177.719 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 93.5 mt -65.69 154.61 88.24 Favored Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 123.892 0.877 . . . . 0.0 111.366 169.181 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -70.65 159.6 52.19 Favored 'Trans proline' 0 CA--C 1.546 1.093 0 C-N-CA 122.973 2.448 . . . . 0.0 112.621 -179.299 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.46 170.7 15.62 Favored 'Trans proline' 0 CA--C 1.542 0.915 0 C-N-CA 123.631 2.887 . . . . 0.0 112.991 177.304 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -137.61 156.93 74.52 Favored Pre-proline 0 CA--C 1.549 0.913 0 C-N-CA 125.768 1.627 . . . . 0.0 111.211 -178.023 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -69.58 150.12 68.9 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 122.954 2.436 . . . . 0.0 112.733 -179.36 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 2.2 mppt? -95.03 80.06 3.61 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.497 1.519 . . . . 0.0 109.911 177.517 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . -66.38 -18.39 67.45 Favored Glycine 0 CA--C 1.539 1.584 0 C-N-CA 124.649 1.119 . . . . 0.0 115.106 -179.271 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 22.7 ptmt . . . . . 0 C--O 1.251 1.157 0 C-N-CA 126.86 2.064 . . . . 0.0 112.316 175.332 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.896 0 N-CA-C 114.715 0.646 . . . . 0.0 114.715 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 19.7 ptt180 -161.42 166.49 27.22 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 126.901 2.08 . . . . 0.0 110.678 175.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.486 ' HG3' HD12 ' A' ' 147' ' ' LEU . 0.2 OUTLIER -71.42 117.33 12.82 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.378 1.471 . . . . 0.0 111.882 -177.014 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 69.4 p -126.99 163.21 24.21 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.667 1.187 . . . . 0.0 112.089 -179.252 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -56.54 -35.41 68.09 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.302 1.441 . . . . 0.0 113.636 174.496 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -67.38 -50.21 60.69 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 122.874 0.47 . . . . 0.0 111.255 177.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 89.3 mt -62.05 -35.77 79.64 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.443 -0.786 . . . . 0.0 112.178 173.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 19.1 tp60 -58.75 -49.17 78.62 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 119.012 -0.518 . . . . 0.0 111.201 173.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 55.4 t80 -58.28 -42.57 86.86 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 119.437 1.017 . . . . 0.0 112.402 177.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 97.0 mmm -55.82 -51.42 67.54 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.128 0.571 . . . . 0.0 112.142 173.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.418 ' HB3' HD13 ' A' ' 90' ' ' LEU . 9.5 pt20 -83.46 -12.68 56.07 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 114.971 1.471 . . . . 0.0 114.971 -175.506 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 59.0 t30 -107.4 -22.77 12.45 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.545 1.138 . . . . 0.0 112.869 -172.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 13.5 t -129.69 -49.69 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 C-N-CA 123.361 0.664 . . . . 0.0 112.081 -179.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.5 t -69.6 -64.16 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 CA-C-N 118.694 0.679 . . . . 0.0 110.586 -173.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 73.3 t -57.04 -45.08 83.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.675 0 C-N-CA 124.703 1.201 . . . . 0.0 110.259 172.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.3 tppp? -53.15 -47.34 68.84 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.179 0.991 . . . . 0.0 112.066 -179.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 32.6 m -76.68 -40.95 47.3 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -179.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 59.6 mt -63.25 -33.4 75.41 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.264 0.626 . . . . 0.0 112.329 176.328 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 22.3 t-105 -73.2 -31.06 63.96 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.56 1.544 . . . . 0.0 113.274 174.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 54.8 mtmt -77.65 -9.52 59.02 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 174.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 47.0 t-80 -63.29 149.38 45.79 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.746 1.218 . . . . 0.0 113.221 -179.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 17.1 pt20 -61.31 -12.53 14.06 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 115.265 1.58 . . . . 0.0 115.265 176.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 20.2 m-85 -124.22 17.04 9.13 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.96 1.704 . . . . 0.0 113.645 -179.341 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.51 -27.81 65.51 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 114.168 1.173 . . . . 0.0 114.168 176.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 41.5 p-90 -56.62 -37.78 61.37 Favored Pre-proline 0 CA--C 1.547 0.831 0 N-CA-C 118.096 2.628 . . . . 0.0 118.096 -169.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -75.17 -5.81 17.16 Favored 'Trans proline' 0 CA--C 1.544 0.988 0 CA-C-N 123.221 2.186 . . . . 0.0 113.623 174.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -106.49 -5.61 18.74 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.432 1.493 . . . . 0.0 112.877 178.514 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -61.24 -18.07 56.52 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 114.392 1.256 . . . . 0.0 114.392 178.214 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -143.48 155.98 60.46 Favored Pre-proline 0 CA--C 1.545 0.755 0 C-N-CA 125.868 1.667 . . . . 0.0 110.677 -175.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -65.67 151.32 84.92 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 122.752 2.302 . . . . 0.0 111.912 171.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 60.8 t -66.78 104.67 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 124.051 0.94 . . . . 0.0 110.773 176.3 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 -74.88 85.59 2.23 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.202 1.001 . . . . 0.0 110.089 169.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -51.84 -25.91 8.82 Favored 'General case' 0 CA--C 1.548 0.904 0 N-CA-C 114.053 1.131 . . . . 0.0 114.053 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 81.7 mt -64.17 -49.9 79.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 C-N-CA 125.618 1.567 . . . . 0.0 111.436 171.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -73.88 -40.52 63.15 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 125.239 1.416 . . . . 0.0 112.87 -178.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -74.29 -10.71 59.86 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.928 1.291 . . . . 0.0 113.132 174.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 68.3 m-20 56.11 56.53 5.8 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.48 1.912 . . . . 0.0 112.503 -179.283 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 46.6 mt -115.67 80.51 8.39 Favored Pre-proline 0 CA--C 1.545 0.77 0 C-N-CA 126.318 1.847 . . . . 0.0 110.35 -177.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -68.1 -6.26 16.77 Favored 'Trans proline' 0 CA--C 1.543 0.937 0 C-N-CA 123.977 3.118 . . . . 0.0 114.361 -174.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 29.4 m-20 -122.29 12.44 10.2 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.06 1.744 . . . . 0.0 112.53 178.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 80.0 t80 -48.5 -55.44 11.01 Favored 'General case' 0 N--CA 1.476 0.859 0 O-C-N 120.915 -1.116 . . . . 0.0 113.319 -175.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -73.95 -12.17 60.57 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.825 1.25 . . . . 0.0 114.353 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.61 -34.69 67.54 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 121.123 -0.986 . . . . 0.0 111.807 174.072 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.4 mp -92.28 -47.42 14.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 124.68 1.192 . . . . 0.0 110.906 174.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.556 HD11 ' HB2' ' A' ' 115' ' ' TYR . 38.6 mm -76.99 110.51 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 123.511 0.724 . . . . 0.0 111.335 -177.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -71.31 -35.87 71.41 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.805 1.242 . . . . 0.0 112.836 174.747 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 13.2 p30 -147.69 83.14 7.66 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 125.534 1.534 . . . . 0.0 111.721 -168.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -69.37 131.66 22.27 Favored 'Trans proline' 0 CA--C 1.535 0.566 0 C-N-CA 123.467 2.778 . . . . 0.0 110.919 -177.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 6.4 tpt -156.49 133.73 10.62 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.004 1.322 . . . . 0.0 110.28 -170.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -146.79 151.06 36.53 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.631 1.572 . . . . 0.0 111.22 -176.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.6 ttp -56.23 -36.78 68.86 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.462 1.505 . . . . 0.0 113.284 -170.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -58.94 -25.77 59.86 Favored Glycine 0 CA--C 1.533 1.188 0 C-N-CA 125.014 1.292 . . . . 0.0 114.77 174.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 39.8 m -92.96 -33.63 14.09 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.572 1.149 . . . . 0.0 111.634 175.133 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 44.7 mt -56.78 -50.84 73.32 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 CA-C-N 119.196 0.907 . . . . 0.0 110.497 174.553 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -62.07 -33.06 73.7 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 177.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.431 ' HA ' ' HE3' ' A' ' 88' ' ' LYS . 0.6 OUTLIER -67.45 -27.73 67.29 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -176.501 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 5.1 ptp180 -84.06 -31.93 25.1 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 113.839 1.051 . . . . 0.0 113.839 169.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.418 HD13 ' HB3' ' A' ' 43' ' ' GLN . 87.4 mt -62.04 -33.71 74.87 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 119.541 1.064 . . . . 0.0 113.311 168.075 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -67.73 1.92 2.22 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 125.603 1.561 . . . . 0.0 113.805 172.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 57.8 m-80 -137.57 -169.78 2.6 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 128.494 2.718 . . . . 0.0 110.696 -177.285 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 75.1 m-80 -113.73 44.21 1.66 Allowed 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.537 1.535 . . . . 0.0 111.051 -178.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 41.2 t80 -64.4 -35.95 82.56 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.553 0.741 . . . . 0.0 111.92 -175.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -137.6 176.43 8.71 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 127.098 2.159 . . . . 0.0 111.842 -178.303 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 2.5 t-105 -108.89 -25.29 10.84 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.882 1.673 . . . . 0.0 112.283 -178.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 51.9 p -133.05 145.73 51.06 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.25 1.42 . . . . 0.0 113.678 -168.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -69.9 -19.66 63.4 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 115.229 1.566 . . . . 0.0 115.229 -175.245 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 18.0 m -56.24 -28.81 59.78 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.785 0.834 . . . . 0.0 113.067 174.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -71.98 -44.12 64.03 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.554 0.742 . . . . 0.0 112.299 174.569 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 42.5 t -61.16 -38.97 88.38 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.713 0.805 . . . . 0.0 111.797 172.32 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 83.5 mtp -61.42 -43.17 99.33 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 121.44 -0.787 . . . . 0.0 112.387 172.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . 0.253 2.4 pt20 -67.43 -30.4 70.13 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 175.763 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -68.03 -43.62 78.34 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.374 -0.829 . . . . 0.0 111.961 170.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -59.36 -45.44 91.41 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 121.202 -0.936 . . . . 0.0 112.312 172.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 18.6 t30 -56.83 -47.38 80.44 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 122.965 0.506 . . . . 0.0 111.67 172.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 74.6 m -61.05 -37.91 84.32 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.907 0.883 . . . . 0.0 112.508 178.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 51.9 ttp -59.99 -55.9 28.34 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 119.091 0.86 . . . . 0.0 111.983 173.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -64.74 -42.47 95.18 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 112.207 0.447 . . . . 0.0 112.207 -177.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 98.0 m -64.61 -46.91 80.62 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.444 -0.785 . . . . 0.0 112.355 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -63.56 -32.49 73.97 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 119.909 1.232 . . . . 0.0 112.143 179.317 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 94.8 m -61.97 -43.62 98.46 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.761 0.824 . . . . 0.0 112.927 170.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -67.37 -32.71 73.83 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 178.163 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 89.1 mt -65.12 -56.3 16.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 C-N-CA 123.388 0.675 . . . . 0.0 110.825 177.232 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . 0.556 ' HB2' HD11 ' A' ' 77' ' ' ILE . 31.9 t80 -69.13 -37.25 78.2 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 -172.483 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 64.7 m-80 -100.79 159.3 15.3 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.862 0.865 . . . . 0.0 112.724 -170.6 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 49.2 mmtm -66.82 146.11 99.03 Favored Pre-proline 0 N--CA 1.476 0.867 0 C-N-CA 123.773 0.829 . . . . 0.0 110.571 172.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -66.24 -7.61 17.9 Favored 'Trans proline' 0 CA--C 1.542 0.919 0 C-N-CA 123.604 2.87 . . . . 0.0 114.656 -175.402 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 50.8 p -113.6 -0.66 14.28 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 126.624 1.969 . . . . 0.0 113.235 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -65.89 147.25 53.67 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.568 -0.708 . . . . 0.0 111.027 173.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -51.85 -48.49 63.96 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.568 0.747 . . . . 0.0 112.405 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 9.9 tp -57.02 -30.9 35.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 N-CA-C 114.073 1.138 . . . . 0.0 114.073 -179.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 51.9 t -72.76 -47.44 49.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 O-C-N 121.55 -0.719 . . . . 0.0 110.394 174.121 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 75.0 mt -61.08 -36.74 80.46 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 118.994 0.816 . . . . 0.0 111.808 176.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 11.2 mtt -59.01 -52.64 64.9 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.892 1.277 . . . . 0.0 112.011 169.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.14 -39.78 87.5 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.254 0.621 . . . . 0.0 112.542 176.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 90.3 mt-30 -62.51 -38.36 89.61 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.909 0.884 . . . . 0.0 112.833 174.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -75.49 -34.7 60.89 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.196 0.998 . . . . 0.0 113.214 178.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 72.0 mt -68.87 -45.51 70.81 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.182 0.593 . . . . 0.0 111.383 170.356 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -62.54 -39.95 95.24 Favored 'General case' 0 N--CA 1.468 0.467 0 O-C-N 121.281 -0.887 . . . . 0.0 112.98 -175.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 5.2 ptpp? -61.0 -42.36 98.3 Favored 'General case' 0 N--CA 1.474 0.737 0 O-C-N 121.382 -0.824 . . . . 0.0 112.36 176.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 87.8 mt -66.26 -46.24 87.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 C-N-CA 123.828 0.851 . . . . 0.0 110.632 174.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -50.09 -50.22 48.95 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 119.102 0.864 . . . . 0.0 111.188 174.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.2 mt -63.01 -42.17 99.76 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 178.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -62.0 -35.43 78.52 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 119.444 1.02 . . . . 0.0 112.964 174.143 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 34.6 mmtm -72.98 -52.43 14.52 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.862 1.265 . . . . 0.0 111.635 179.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.0 m -67.92 -25.24 31.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 CA-C-N 119.736 1.153 . . . . 0.0 112.447 178.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -61.69 -30.32 70.67 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.58 -0.7 . . . . 0.0 112.604 170.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -90.24 -9.45 47.99 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.758 1.223 . . . . 0.0 112.683 175.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 40.0 ttp -64.77 141.55 98.35 Favored Pre-proline 0 CA--C 1.547 0.859 0 CA-C-N 119.004 0.82 . . . . 0.0 109.86 169.014 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -51.99 151.69 15.66 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 122.945 2.43 . . . . 0.0 113.43 170.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 18.7 mm100 -90.64 -21.05 21.87 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.385 0.674 . . . . 0.0 112.648 172.161 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -93.97 159.39 15.19 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.673 1.589 . . . . 0.0 111.053 173.514 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -125.3 139.11 53.99 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.07 1.348 . . . . 0.0 111.293 -171.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 9.9 p -146.01 150.73 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 124.315 1.046 . . . . 0.0 111.438 -175.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 24.6 tp10 -69.35 146.69 51.94 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.109 0.964 . . . . 0.0 111.715 171.593 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . 0.486 HD12 ' HG3' ' A' ' 35' ' ' LYS . 88.3 mt . . . . . 0 N--CA 1.473 0.71 0 N-CA-C 113.608 0.966 . . . . 0.0 113.608 173.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.888 0 CA-C-O 121.566 0.537 . . . . 0.0 114.33 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 8.6 ptp180 -164.66 167.83 18.71 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 127.461 2.304 . . . . 0.0 110.175 176.223 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 8.3 tppt? -76.11 114.24 14.54 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 166.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 67.2 p -105.84 169.5 8.45 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 125.18 1.392 . . . . 0.0 110.297 174.012 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 24.0 p-10 -50.52 -37.86 41.36 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 174.266 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -71.51 -48.07 51.26 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.519 0.727 . . . . 0.0 111.595 178.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 75.9 mt -65.54 -30.78 71.57 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.472 -0.767 . . . . 0.0 112.753 177.047 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 39.3 tt0 -59.56 -52.62 64.76 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 123.913 0.885 . . . . 0.0 109.681 168.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 64.9 t80 -58.73 -42.35 88.54 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.025 0.93 . . . . 0.0 112.755 179.453 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 96.7 mmm -53.95 -51.71 62.95 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 118.514 0.597 . . . . 0.0 112.008 174.258 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 4.3 tp60 -75.08 -34.06 61.72 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 121.17 -0.956 . . . . 0.0 113.496 -178.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 52.3 t30 -89.81 -22.67 21.99 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.512 1.125 . . . . 0.0 113.479 -168.035 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 6.0 t -130.64 -50.13 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 CA-C-N 118.103 0.411 . . . . 0.0 111.195 -175.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 17.0 t -68.19 -62.93 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 122.783 0.433 . . . . 0.0 110.189 -175.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 43.1 t -56.4 -48.47 79.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 C-N-CA 125.368 1.467 . . . . 0.0 110.387 173.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 24.6 ttpt -60.37 -43.01 96.98 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -173.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 53.1 m -71.42 -44.96 63.9 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 119.01 0.823 . . . . 0.0 112.22 173.13 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 70.0 mt -60.4 -35.09 74.95 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.315 0.961 . . . . 0.0 112.325 178.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 26.0 t-105 -69.77 -30.1 67.59 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.538 1.535 . . . . 0.0 113.494 176.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -84.38 -6.21 59.36 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 124.302 1.041 . . . . 0.0 113.756 177.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 45.7 t-80 -63.15 154.73 30.21 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.74 1.216 . . . . 0.0 113.154 -179.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 60.9 tt0 -56.47 -24.54 46.52 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.598 1.559 . . . . 0.0 113.931 175.084 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 -122.0 19.28 10.86 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.326 1.451 . . . . 0.0 113.841 -173.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.79 -26.74 63.47 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 176.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 61.3 p-90 -59.58 -35.45 30.05 Favored Pre-proline 0 CA--C 1.548 0.893 0 N-CA-C 117.861 2.541 . . . . 0.0 117.861 -169.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -74.93 -3.42 13.89 Favored 'Trans proline' 0 CA--C 1.544 0.986 0 CA-C-N 123.232 2.19 . . . . 0.0 113.558 174.23 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 56.5 m-85 -109.98 -6.48 15.16 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.472 1.509 . . . . 0.0 113.066 178.259 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 20.4 m-30 -62.87 -16.53 59.04 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 178.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -142.02 156.52 65.08 Favored Pre-proline 0 CA--C 1.544 0.739 0 C-N-CA 126.372 1.869 . . . . 0.0 110.239 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -64.65 152.96 79.91 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 122.673 2.249 . . . . 0.0 112.054 173.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 54.6 t -66.38 101.12 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 C-N-CA 124.088 0.955 . . . . 0.0 110.675 176.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 52.7 m-20 -75.5 84.67 2.58 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.512 1.125 . . . . 0.0 110.613 172.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.97 -28.29 36.65 Favored 'General case' 0 CA--C 1.547 0.827 0 N-CA-C 113.987 1.106 . . . . 0.0 113.987 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 81.9 mt -65.37 -50.1 74.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 124.766 1.226 . . . . 0.0 111.097 172.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -66.33 -41.83 89.05 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.217 1.407 . . . . 0.0 112.56 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.6 mp -80.13 -4.76 54.24 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.631 1.173 . . . . 0.0 113.22 177.278 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 60.3 t30 54.8 55.05 8.28 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 126.107 1.763 . . . . 0.0 113.48 -179.239 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 34.8 mt -114.62 83.13 8.57 Favored Pre-proline 0 CA--C 1.543 0.673 0 C-N-CA 126.387 1.875 . . . . 0.0 110.343 -178.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -68.07 -3.44 10.66 Favored 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 123.884 3.056 . . . . 0.0 114.337 -175.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -127.34 9.86 6.71 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 126.174 1.79 . . . . 0.0 112.821 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 65.7 t80 -51.93 -51.86 54.07 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-N 120.284 1.402 . . . . 0.0 112.89 -175.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -76.17 -10.88 59.75 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.16 1.384 . . . . 0.0 113.89 179.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -72.44 -42.95 64.45 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.82 0.848 . . . . 0.0 110.267 175.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.9 mp -79.11 -55.54 9.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 C-N-CA 124.708 1.203 . . . . 0.0 110.262 172.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 47.9 mm -85.01 104.22 12.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 CA-C-O 122.153 0.978 . . . . 0.0 111.387 -175.489 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -71.24 -29.46 65.15 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.955 1.702 . . . . 0.0 114.058 -179.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -143.75 77.42 15.0 Favored Pre-proline 0 CA--C 1.542 0.639 0 C-N-CA 125.486 1.514 . . . . 0.0 110.712 -172.582 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -67.06 142.84 63.11 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 123.983 3.122 . . . . 0.0 111.648 -179.254 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 8.0 tpt -157.46 137.87 12.86 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.555 1.542 . . . . 0.0 109.846 -176.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -146.54 150.04 34.77 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.955 1.302 . . . . 0.0 111.401 -176.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 9.7 ttp -56.78 -36.72 70.18 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.992 1.317 . . . . 0.0 113.511 -169.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -61.31 -21.59 59.98 Favored Glycine 0 CA--C 1.536 1.405 0 C-N-CA 124.888 1.233 . . . . 0.0 114.77 173.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 24.3 m -97.08 -34.1 11.28 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.807 1.243 . . . . 0.0 111.523 172.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 76.8 mt -55.42 -50.37 66.24 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 119.467 1.031 . . . . 0.0 110.653 173.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 14.1 ptmm? -61.81 -29.71 70.34 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 113.976 1.102 . . . . 0.0 113.976 176.368 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.413 ' HA ' ' HE3' ' A' ' 88' ' ' LYS . 1.5 tpmt? -70.64 -32.9 70.37 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.748 1.219 . . . . 0.0 113.301 -175.735 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 3.8 ptp180 -77.95 -31.43 50.91 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 169.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 80.8 mt -67.6 -28.47 67.78 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 114.04 1.126 . . . . 0.0 114.04 169.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -65.92 -8.48 22.63 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 125.271 1.428 . . . . 0.0 114.149 174.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 -135.17 163.64 29.49 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.702 1.601 . . . . 0.0 112.819 -171.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 -81.12 105.39 12.29 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 169.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -140.53 -40.71 0.42 Allowed 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.308 1.043 . . . . 0.0 112.675 -172.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -130.81 175.53 8.96 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 126.603 1.961 . . . . 0.0 111.25 172.67 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 3.1 t-105 -115.24 -21.2 10.04 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.602 1.161 . . . . 0.0 112.833 -174.308 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 91.7 p -127.19 149.16 50.1 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.387 1.075 . . . . 0.0 112.783 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -64.32 -20.32 66.02 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 114.212 1.19 . . . . 0.0 114.212 175.227 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 83.1 p -51.13 -38.38 51.66 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.022 0.929 . . . . 0.0 113.255 177.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -67.19 -43.16 82.84 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.357 1.063 . . . . 0.0 111.782 179.241 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 49.6 t -66.92 -36.35 82.06 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.23 1.012 . . . . 0.0 112.742 174.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 88.1 mtp -62.42 -41.66 98.87 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 121.425 -0.797 . . . . 0.0 111.964 176.615 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 61.8 mm-40 -64.68 -33.93 77.11 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 112.767 0.655 . . . . 0.0 112.767 173.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 87.5 m-20 -67.69 -41.86 82.98 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 120.967 -1.083 . . . . 0.0 111.78 174.447 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -59.38 -47.58 84.91 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.208 0.603 . . . . 0.0 112.308 169.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.75 -42.0 92.22 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 121.776 -0.577 . . . . 0.0 111.297 177.029 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 62.4 m -62.49 -45.47 92.85 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.72 0.808 . . . . 0.0 111.547 178.095 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 57.5 ttp -55.68 -52.4 63.99 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.157 0.983 . . . . 0.0 112.778 176.235 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -68.46 -37.28 80.04 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.0 m -59.28 -50.15 75.1 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.226 1.01 . . . . 0.0 111.818 173.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -57.97 -37.46 74.22 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.268 0.627 . . . . 0.0 112.18 -178.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 90.3 m -57.29 -43.16 82.94 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.122 0.969 . . . . 0.0 112.386 173.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -70.18 -29.57 66.47 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.3 1.04 . . . . 0.0 113.632 176.592 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 82.2 mt -75.67 -57.13 6.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 123.804 0.842 . . . . 0.0 110.894 179.663 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -69.74 -23.04 63.33 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 114.507 1.299 . . . . 0.0 114.507 -172.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 36.6 m-80 -120.32 165.93 14.21 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.336 1.054 . . . . 0.0 112.724 -170.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -70.19 148.47 95.85 Favored Pre-proline 0 N--CA 1.475 0.813 0 C-N-CA 124.178 0.991 . . . . 0.0 110.477 174.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -65.99 -6.38 14.25 Favored 'Trans proline' 0 CA--C 1.543 0.963 0 C-N-CA 123.634 2.889 . . . . 0.0 114.568 -178.319 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 67.9 p -116.0 1.32 13.26 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 126.641 1.977 . . . . 0.0 113.099 179.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -66.91 147.81 52.75 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 121.478 -0.764 . . . . 0.0 110.833 173.135 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -52.29 -48.55 65.28 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.441 0.696 . . . . 0.0 112.322 178.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.1 tp -58.15 -30.11 38.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 -178.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 39.2 t -71.38 -48.3 54.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 O-C-N 121.538 -0.726 . . . . 0.0 110.383 173.226 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 74.3 mt -61.35 -36.65 80.76 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 118.876 0.762 . . . . 0.0 111.701 177.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 11.7 mtt -59.23 -51.75 68.63 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 124.735 1.214 . . . . 0.0 111.984 169.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -59.97 -40.9 90.68 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 123.191 0.596 . . . . 0.0 112.474 176.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 89.5 mt-30 -61.71 -45.96 91.71 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 119.085 0.857 . . . . 0.0 111.972 174.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -69.0 -28.0 66.2 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.445 1.098 . . . . 0.0 113.862 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 78.7 mt -78.36 -45.09 23.36 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.857 0.863 . . . . 0.0 111.547 169.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -61.04 -40.31 93.12 Favored 'General case' 0 N--CA 1.47 0.569 0 O-C-N 121.124 -0.985 . . . . 0.0 112.777 -175.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 60.6 pttt -59.22 -39.76 83.71 Favored 'General case' 0 N--CA 1.474 0.741 0 O-C-N 121.535 -0.728 . . . . 0.0 112.282 176.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 69.1 mt -72.66 -42.37 62.61 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 C-N-CA 124.457 1.103 . . . . 0.0 111.272 175.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -50.85 -51.58 49.9 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.395 0.998 . . . . 0.0 110.384 171.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 99.1 mt -62.18 -45.03 95.21 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 177.027 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -62.89 -30.61 71.66 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 119.603 1.092 . . . . 0.0 113.402 179.074 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 70.3 mmtt -75.1 -54.92 6.31 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 124.658 1.183 . . . . 0.0 112.262 174.216 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 6.0 m -66.13 -25.03 34.8 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 CA-C-N 120.691 1.587 . . . . 0.0 112.535 -178.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -58.09 -28.47 64.62 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 172.209 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -97.81 -3.18 39.38 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.235 1.414 . . . . 0.0 112.423 178.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 42.9 ttp -62.64 138.27 96.71 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 123.994 0.917 . . . . 0.0 110.728 173.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.07 125.98 15.62 Favored 'Trans proline' 0 CA--C 1.534 0.516 0 C-N-CA 122.864 2.376 . . . . 0.0 110.365 177.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 80.4 mm-40 -76.2 -22.4 55.34 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 113.472 0.915 . . . . 0.0 113.472 -173.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -75.13 159.02 32.14 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.244 1.417 . . . . 0.0 111.585 169.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -122.59 129.65 52.14 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.574 1.55 . . . . 0.0 111.208 -174.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 78.8 t -141.76 131.5 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 125.545 1.538 . . . . 0.0 110.961 -169.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -69.31 125.03 25.42 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.601 1.56 . . . . 0.0 111.074 169.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 97.7 mt . . . . . 0 CA--C 1.54 0.589 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 178.418 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.96 0 CA-C-O 121.234 0.352 . . . . 0.0 113.299 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 34.8 ptt180 -163.79 157.87 19.46 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 126.235 1.814 . . . . 0.0 110.425 175.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 26.0 ttpt -71.45 135.96 47.42 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.451 0.7 . . . . 0.0 110.315 170.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 70.9 p -140.22 166.79 23.71 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 125.951 1.701 . . . . 0.0 110.181 -175.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 25.1 p-10 -46.63 -37.69 8.59 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 170.429 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 -70.31 -55.57 8.87 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.573 0.749 . . . . 0.0 111.683 179.205 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 86.2 mt -62.67 -34.55 77.34 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 121.534 -0.729 . . . . 0.0 112.597 178.284 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -56.24 -54.3 47.01 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.904 0.882 . . . . 0.0 110.842 170.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 75.1 t80 -59.29 -40.54 86.45 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 119.098 0.863 . . . . 0.0 112.925 179.175 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 92.3 mmm -55.48 -50.98 68.47 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 118.754 0.706 . . . . 0.0 111.795 172.453 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -85.56 -3.39 58.86 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 114.874 1.435 . . . . 0.0 114.874 -175.147 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 38.5 m-80 -118.33 -17.48 9.46 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.027 1.331 . . . . 0.0 114.265 -178.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 37.9 t -136.99 -50.18 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-N 119.211 0.914 . . . . 0.0 111.866 -178.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.4 t -67.75 -62.71 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 CA-C-N 119.378 0.99 . . . . 0.0 110.634 -174.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 84.5 t -60.71 -44.46 97.24 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 C-N-CA 123.736 0.814 . . . . 0.0 110.481 174.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt -56.68 -44.23 81.23 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 118.688 0.676 . . . . 0.0 112.401 -178.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 56.4 m -70.56 -47.14 61.75 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 122.672 0.389 . . . . 0.0 111.815 176.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 63.2 mt -61.48 -33.24 73.44 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 123.323 0.649 . . . . 0.0 112.199 179.09 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . 0.454 ' CZ3' ' HE3' ' A' ' 87' ' ' LYS . 21.3 t-105 -72.48 -29.18 63.42 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 125.655 1.582 . . . . 0.0 113.475 175.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt -82.04 -8.96 59.69 Favored 'General case' 0 N--CA 1.479 0.984 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 176.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 44.2 t-80 -62.17 152.76 32.21 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.638 1.175 . . . . 0.0 113.096 -178.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 22.6 tp60 -57.87 -19.84 32.24 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.487 1.515 . . . . 0.0 114.017 174.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 15.4 m-85 -122.9 16.09 10.08 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.709 1.604 . . . . 0.0 113.995 -173.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.34 -29.64 66.39 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 114.149 1.166 . . . . 0.0 114.149 178.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . 0.428 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 39.8 p-90 -56.4 -37.31 56.12 Favored Pre-proline 0 CA--C 1.547 0.841 0 N-CA-C 117.079 2.252 . . . . 0.0 117.079 -171.329 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.428 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 55.8 Cg_endo -67.95 -6.53 17.27 Favored 'Trans proline' 0 C--N 1.356 0.924 0 CA-C-N 122.997 2.106 . . . . 0.0 114.985 172.267 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -113.69 -3.08 13.6 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.424 1.489 . . . . 0.0 113.129 179.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.8 m-30 -63.76 -20.61 65.9 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 113.666 0.987 . . . . 0.0 113.666 176.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -140.65 157.32 68.2 Favored Pre-proline 0 CA--C 1.545 0.772 0 C-N-CA 126.683 1.993 . . . . 0.0 110.048 -177.541 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -65.08 153.46 78.18 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 122.608 2.205 . . . . 0.0 112.144 174.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 63.7 t -65.77 102.51 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 C-N-CA 124.179 0.992 . . . . 0.0 110.963 176.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 42.9 m-20 -74.58 86.76 2.11 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.627 1.171 . . . . 0.0 109.855 169.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -52.47 -25.75 11.02 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.408 1.262 . . . . 0.0 114.408 -177.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 80.7 mt -64.5 -50.58 75.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 125.207 1.403 . . . . 0.0 111.323 171.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 55.2 mttm -73.48 -40.64 63.95 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 125.277 1.431 . . . . 0.0 112.937 -178.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -74.36 -10.65 59.79 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.19 0.996 . . . . 0.0 113.406 173.552 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 60.3 t30 58.87 54.58 5.05 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 126.7 2.0 . . . . 0.0 112.865 177.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 48.4 mt -115.21 81.59 8.29 Favored Pre-proline 0 CA--C 1.545 0.788 0 C-N-CA 126.681 1.993 . . . . 0.0 110.147 -175.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -67.68 -5.78 15.11 Favored 'Trans proline' 0 CA--C 1.543 0.956 0 C-N-CA 124.154 3.236 . . . . 0.0 114.925 -171.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -128.92 15.47 6.33 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.895 1.678 . . . . 0.0 112.51 179.357 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 63.4 t80 -47.25 -55.14 9.2 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 113.987 1.106 . . . . 0.0 113.987 -172.311 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -74.28 -13.23 60.74 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.783 1.233 . . . . 0.0 114.207 -178.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.418 ' HA ' ' HE2' ' A' ' 75' ' ' LYS . 8.9 mmpt? -76.41 -33.12 58.83 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.622 1.169 . . . . 0.0 111.981 175.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.3 mp -91.84 -46.42 14.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 124.687 1.195 . . . . 0.0 110.67 172.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 35.7 mm -84.34 99.01 6.25 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 CA-C-O 122.148 0.975 . . . . 0.0 111.276 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.55 -38.44 87.45 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 126.172 1.789 . . . . 0.0 113.85 177.09 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 -142.52 87.25 9.36 Favored Pre-proline 0 CA--C 1.543 0.706 0 C-N-CA 125.055 1.342 . . . . 0.0 110.616 -176.03 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -68.4 141.98 53.05 Favored 'Trans proline' 0 CA--C 1.538 0.691 0 C-N-CA 123.668 2.912 . . . . 0.0 111.666 -176.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.8 tpt -156.25 134.89 11.68 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.498 1.119 . . . . 0.0 110.773 -171.084 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -147.68 152.87 38.55 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.518 1.527 . . . . 0.0 111.237 -176.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 6.6 ttp -58.01 -36.89 73.33 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.434 1.094 . . . . 0.0 113.62 -170.404 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -59.49 -29.66 66.94 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 124.497 1.046 . . . . 0.0 114.296 174.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 27.9 m -85.88 -31.31 22.28 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.282 1.033 . . . . 0.0 111.786 176.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 62.4 mt -60.57 -52.48 61.04 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 CA-C-N 118.887 0.767 . . . . 0.0 110.661 174.465 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.454 ' HE3' ' CZ3' ' A' ' 51' ' ' TRP . 17.0 ptpt -57.89 -32.84 68.12 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 178.523 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 2.8 tppp? -59.29 -38.55 80.45 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 178.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 5.6 ptp180 -86.46 -19.06 30.15 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 114.213 1.19 . . . . 0.0 114.213 175.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 52.9 mt -70.68 -48.15 56.28 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 119.061 0.846 . . . . 0.0 111.964 167.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -62.86 -14.27 44.01 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 115.076 1.51 . . . . 0.0 115.076 -171.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 46.2 p30 -124.25 14.04 8.98 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 126.141 1.776 . . . . 0.0 113.133 177.181 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . 0.269 6.3 p30 37.24 65.75 0.49 Allowed 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 127.149 2.18 . . . . 0.0 114.403 -174.043 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 74.1 t80 -59.29 -24.2 63.07 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.013 1.325 . . . . 0.0 114.097 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -132.42 -174.31 3.41 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 129.101 2.96 . . . . 0.0 111.863 -169.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 2.3 t-105 -112.67 -27.47 8.17 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.761 1.224 . . . . 0.0 113.382 -174.353 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 39.9 t -134.15 145.29 49.12 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.627 1.171 . . . . 0.0 111.773 -177.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -57.24 -18.86 18.01 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.837 1.655 . . . . 0.0 114.769 172.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 10.8 m -53.82 -32.89 54.42 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.206 1.002 . . . . 0.0 113.132 177.191 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -73.91 -42.61 60.4 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.214 1.006 . . . . 0.0 112.757 175.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 49.5 t -60.4 -40.75 92.06 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.271 1.028 . . . . 0.0 112.091 171.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 81.7 mtp -61.5 -41.59 97.52 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.099 0.96 . . . . 0.0 112.553 174.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -65.5 -34.04 77.34 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 174.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -67.26 -42.79 83.32 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 121.25 -0.907 . . . . 0.0 111.762 173.019 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -60.75 -45.86 92.67 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.254 -0.904 . . . . 0.0 112.599 172.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 35.5 t30 -55.62 -45.06 77.57 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.218 0.607 . . . . 0.0 111.678 173.072 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 88.7 m -62.69 -45.18 93.95 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.389 1.076 . . . . 0.0 112.149 179.104 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 12.7 ttm -55.69 -59.56 4.69 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.537 1.135 . . . . 0.0 112.453 177.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 -65.18 -34.98 79.66 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 121.98 -0.45 . . . . 0.0 112.136 -178.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 16.5 m -58.92 -51.77 68.62 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.322 1.049 . . . . 0.0 111.92 173.27 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -56.43 -40.08 74.16 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.773 0.829 . . . . 0.0 111.763 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 96.6 m -55.8 -50.72 69.73 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.3 0.64 . . . . 0.0 111.955 171.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -62.25 -26.59 68.47 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 114.07 1.137 . . . . 0.0 114.07 178.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 74.4 mt -73.63 -59.17 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 C-N-CA 123.75 0.82 . . . . 0.0 110.615 173.45 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -74.29 -46.42 41.28 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 -172.2 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -97.58 152.01 19.48 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.769 1.228 . . . . 0.0 111.305 -179.296 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 49.5 mmtm -81.9 155.87 70.17 Favored Pre-proline 0 N--CA 1.475 0.815 0 C-N-CA 125.343 1.457 . . . . 0.0 111.558 -175.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . 0.428 ' HA ' HG11 ' A' ' 123' ' ' VAL . 49.9 Cg_endo -62.95 -0.7 2.25 Favored 'Trans proline' 0 CA--C 1.543 0.973 0 C-N-CA 124.181 3.254 . . . . 0.0 115.759 -178.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 64.0 p -114.13 -4.23 13.15 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 126.878 2.071 . . . . 0.0 113.097 178.239 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 74.9 m-20 -76.24 142.74 41.33 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.038 0.836 . . . . 0.0 110.814 172.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -57.62 -46.27 84.31 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 121.49 -0.756 . . . . 0.0 112.299 -176.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.1 tp -53.63 -28.58 16.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 125.823 1.649 . . . . 0.0 114.629 175.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.428 HG11 ' HA ' ' A' ' 118' ' ' PRO . 55.8 t -75.66 -44.54 40.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 O-C-N 121.021 -1.049 . . . . 0.0 110.758 173.434 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 67.1 mt -61.11 -36.15 78.94 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 119.058 0.844 . . . . 0.0 111.579 174.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 10.4 mtt -58.9 -51.64 69.15 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.582 1.153 . . . . 0.0 111.972 169.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.27 -40.55 94.5 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.432 0.693 . . . . 0.0 112.536 177.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -61.36 -49.17 78.04 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.793 0.837 . . . . 0.0 111.664 174.405 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.87 -43.43 98.42 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.735 0.814 . . . . 0.0 112.495 179.419 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 87.2 mt -64.66 -45.79 85.22 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.593 0.757 . . . . 0.0 111.893 173.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -64.38 -36.42 84.08 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.056 -1.027 . . . . 0.0 113.352 -176.213 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 69.5 mttt -57.65 -49.23 77.16 Favored 'General case' 0 N--CA 1.478 0.937 0 O-C-N 121.453 -0.779 . . . . 0.0 111.179 173.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 89.9 mt -66.08 -43.37 92.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 123.918 0.887 . . . . 0.0 111.17 178.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -51.4 -53.3 38.1 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.741 0.816 . . . . 0.0 110.783 173.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 95.6 mt -61.69 -42.61 99.16 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.01 0.524 . . . . 0.0 112.392 177.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.61 -34.59 75.92 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-N 119.084 0.857 . . . . 0.0 113.072 178.506 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -74.69 -54.36 7.55 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.507 1.123 . . . . 0.0 112.401 175.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.9 m -64.94 -23.94 34.48 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 CA-C-N 120.306 1.412 . . . . 0.0 112.509 -178.655 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -59.29 -31.26 68.96 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 170.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 91.5 mt-30 -90.36 -11.75 39.68 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.016 1.326 . . . . 0.0 112.742 176.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 45.3 ttp -64.91 137.32 97.11 Favored Pre-proline 0 CA--C 1.546 0.792 0 CA-C-N 119.066 0.848 . . . . 0.0 110.571 174.3 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -66.65 130.9 24.52 Favored 'Trans proline' 0 CA--C 1.537 0.636 0 C-N-CA 122.911 2.407 . . . . 0.0 111.665 -179.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -68.52 -30.52 69.34 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.069 1.347 . . . . 0.0 112.45 178.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -76.35 158.83 31.08 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.655 1.582 . . . . 0.0 113.21 173.566 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -112.68 139.58 48.16 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 124.939 1.296 . . . . 0.0 110.499 177.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 10.2 p -143.97 134.62 21.36 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-O 122.245 1.021 . . . . 0.0 110.76 169.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 45.9 tt0 -64.28 128.85 37.6 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.412 1.885 . . . . 0.0 111.219 174.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 88.5 mt . . . . . 0 CA--C 1.54 0.577 0 N-CA-C 113.208 0.818 . . . . 0.0 113.208 -177.252 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.962 0 N-CA-C 112.279 -0.328 . . . . 0.0 112.279 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -172.22 165.55 6.01 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.965 1.706 . . . . 0.0 111.384 -174.128 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 26.1 pttm -67.11 139.44 57.52 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.013 0.925 . . . . 0.0 112.822 172.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 45.7 p -148.78 164.75 33.48 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 126.257 1.823 . . . . 0.0 110.582 178.152 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 23.7 p-10 -50.89 -39.24 53.68 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 178.571 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 66.8 mt-30 -72.62 -44.07 62.44 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 121.561 -0.712 . . . . 0.0 111.634 179.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 89.3 mt -64.22 -32.21 73.71 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 118.707 0.685 . . . . 0.0 111.99 174.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -61.18 -52.7 63.72 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-N 118.443 0.565 . . . . 0.0 109.924 168.521 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -55.09 -41.03 71.07 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.27 -0.894 . . . . 0.0 112.635 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 88.7 mmm -57.64 -56.43 22.04 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.878 -0.513 . . . . 0.0 112.042 170.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -77.19 -9.14 58.58 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 114.984 1.476 . . . . 0.0 114.984 -173.445 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -117.75 -23.63 7.51 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.353 1.461 . . . . 0.0 112.598 -169.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 18.7 t -127.53 -54.65 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 C-N-CA 123.429 0.692 . . . . 0.0 111.295 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.6 t -64.23 -59.95 3.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 CA-C-N 118.446 0.567 . . . . 0.0 110.652 -174.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 72.1 t -59.36 -46.38 92.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 124.457 1.103 . . . . 0.0 110.664 174.319 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 36.0 ttmt -57.39 -49.77 75.13 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.278 0.631 . . . . 0.0 112.357 -174.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 61.5 m -67.1 -43.85 81.45 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 118.599 0.636 . . . . 0.0 112.089 176.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 82.9 mt -62.28 -35.18 78.21 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 119.021 0.828 . . . . 0.0 112.481 178.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 20.7 t-105 -72.17 -27.09 62.36 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.76 1.624 . . . . 0.0 113.385 175.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.1 mtmp? -85.94 -4.47 59.17 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 177.328 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 39.7 t-80 -63.93 156.44 27.76 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.98 1.312 . . . . 0.0 113.185 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -57.77 -23.28 51.43 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.503 1.521 . . . . 0.0 113.638 173.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 -123.0 18.93 10.08 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.345 1.458 . . . . 0.0 114.137 -171.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.11 -26.34 63.92 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 176.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 58.9 p-90 -59.22 -35.92 36.41 Favored Pre-proline 0 CA--C 1.547 0.836 0 N-CA-C 117.978 2.585 . . . . 0.0 117.978 -169.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -74.52 -3.5 13.96 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 CA-C-N 123.277 2.206 . . . . 0.0 113.691 173.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 55.9 m-85 -110.3 -5.27 15.3 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.428 1.491 . . . . 0.0 113.14 178.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -62.84 -16.16 57.38 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 179.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -142.18 155.59 64.91 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 125.969 1.708 . . . . 0.0 110.389 -177.206 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -64.48 144.0 83.81 Favored 'Trans proline' 0 CA--C 1.538 0.677 0 C-N-CA 122.641 2.227 . . . . 0.0 111.713 173.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 76.5 t -60.6 115.58 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 123.546 0.738 . . . . 0.0 111.261 175.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 57.9 m-20 -92.44 103.89 16.27 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.249 1.02 . . . . 0.0 109.019 169.146 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.55 -30.08 60.12 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 113.418 0.896 . . . . 0.0 113.418 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 81.9 mt -65.03 -49.88 77.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 124.85 1.26 . . . . 0.0 111.155 174.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -63.84 -37.3 86.89 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.819 1.248 . . . . 0.0 113.403 -177.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.4 mp -89.68 -1.76 58.1 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.231 1.413 . . . . 0.0 112.36 178.216 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 23.0 m120 52.78 52.64 13.57 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 126.162 1.785 . . . . 0.0 113.264 -177.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 29.1 mt -107.71 94.28 11.91 Favored Pre-proline 0 CA--C 1.544 0.713 0 C-N-CA 126.26 1.824 . . . . 0.0 109.767 -179.35 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -68.72 -13.81 37.85 Favored 'Trans proline' 0 CA--C 1.542 0.877 0 C-N-CA 123.084 2.523 . . . . 0.0 114.55 -170.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 -136.65 21.05 3.1 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.573 1.549 . . . . 0.0 112.921 -173.437 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 64.7 t80 -46.14 -50.49 15.45 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.338 1.055 . . . . 0.0 113.827 -175.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 98.8 m-70 -73.48 -17.81 61.19 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 114.454 1.279 . . . . 0.0 114.454 -177.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 43.7 mttp -68.15 -39.53 82.63 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 119.343 0.974 . . . . 0.0 111.855 174.339 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.2 mp -81.37 -46.11 20.46 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 C-N-CA 124.8 1.24 . . . . 0.0 110.288 175.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 49.4 mm -98.57 98.48 7.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 CA-C-O 122.224 1.011 . . . . 0.0 111.353 -176.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.94 -32.5 74.06 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 126.397 1.879 . . . . 0.0 113.868 177.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -141.2 75.78 22.82 Favored Pre-proline 0 CA--C 1.542 0.664 0 C-N-CA 125.259 1.423 . . . . 0.0 110.559 -171.317 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -67.08 142.35 61.17 Favored 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 124.174 3.249 . . . . 0.0 111.289 -178.208 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 8.1 tpt -158.09 136.21 10.8 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.61 1.164 . . . . 0.0 110.221 -170.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -145.98 149.94 35.11 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.929 1.292 . . . . 0.0 111.563 -176.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.4 ttp -57.99 -37.01 73.45 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.667 1.187 . . . . 0.0 113.079 -171.052 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -61.7 -26.1 66.4 Favored Glycine 0 CA--C 1.533 1.178 0 C-N-CA 125.02 1.295 . . . . 0.0 114.597 174.196 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 20.2 m -82.74 -41.73 18.88 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.178 0.991 . . . . 0.0 110.708 170.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 68.4 mt -56.02 -51.9 56.23 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 124.114 0.966 . . . . 0.0 111.39 179.148 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.9 -35.68 71.38 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 113.291 0.848 . . . . 0.0 113.291 176.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -69.39 -34.34 74.37 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.089 0.956 . . . . 0.0 113.409 -177.301 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 4.9 ptp180 -76.89 -30.59 56.25 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 170.196 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 74.5 mt -63.9 -37.4 87.27 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 119.643 1.111 . . . . 0.0 113.011 168.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -75.87 8.55 2.99 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.495 1.518 . . . . 0.0 114.087 177.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 37.0 m-80 -137.3 167.07 22.31 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.652 1.981 . . . . 0.0 111.952 -179.564 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 5.4 p30 -80.62 111.49 17.1 Favored 'General case' 0 CA--C 1.545 0.75 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 168.025 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 56.2 t80 -148.25 -38.12 0.18 Allowed 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.864 0.691 . . . . 0.0 112.864 -171.447 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -138.56 173.12 11.92 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.35 1.86 . . . . 0.0 111.365 169.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.4 t-105 -108.86 -20.33 13.09 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 125.293 1.437 . . . . 0.0 112.162 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 40.5 t -130.34 138.48 50.45 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 126.087 1.755 . . . . 0.0 111.623 -171.132 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -65.92 -17.08 64.42 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 114.968 1.47 . . . . 0.0 114.968 178.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 35.6 p -53.18 -26.92 19.02 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.073 1.349 . . . . 0.0 114.019 172.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 53.7 mm-40 -80.54 -41.89 23.37 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.213 1.005 . . . . 0.0 111.999 177.032 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 52.0 t -60.37 -41.8 94.51 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.417 -0.802 . . . . 0.0 111.994 169.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 88.8 mtp -60.07 -43.88 95.13 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 121.305 -0.872 . . . . 0.0 112.827 175.489 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -72.06 -28.3 63.25 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 179.13 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 -66.32 -44.33 83.68 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.217 -0.927 . . . . 0.0 111.071 169.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -58.5 -47.53 83.78 Favored 'General case' 0 CA--C 1.539 0.519 0 O-C-N 121.273 -0.892 . . . . 0.0 112.422 172.225 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -61.55 -39.3 90.61 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 118.635 0.652 . . . . 0.0 111.724 177.225 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 89.2 m -63.61 -44.71 93.18 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.88 0.872 . . . . 0.0 111.972 176.292 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 52.0 ttp -56.67 -52.7 63.9 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.011 0.924 . . . . 0.0 112.675 176.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -68.48 -34.42 75.9 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 17.5 m -59.34 -52.05 67.31 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.295 1.038 . . . . 0.0 111.807 173.197 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 -57.48 -37.43 72.91 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.89 0.876 . . . . 0.0 112.193 -178.366 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 94.6 m -57.11 -44.12 82.97 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.18 0.992 . . . . 0.0 112.188 173.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -69.65 -30.05 67.66 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.393 1.077 . . . . 0.0 113.68 176.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 82.3 mt -74.26 -57.57 6.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 123.476 0.711 . . . . 0.0 110.747 178.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 37.4 t80 -68.11 -30.25 69.36 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 114.068 1.136 . . . . 0.0 114.068 -173.132 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 37.9 m-80 -113.74 162.92 15.69 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.981 0.912 . . . . 0.0 112.803 -169.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -68.6 148.12 98.06 Favored Pre-proline 0 N--CA 1.472 0.633 0 C-N-CA 124.635 1.174 . . . . 0.0 110.321 175.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -65.85 -6.89 15.18 Favored 'Trans proline' 0 CA--C 1.544 1.016 0 C-N-CA 123.718 2.945 . . . . 0.0 114.654 -176.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 53.9 p -114.3 -0.48 13.85 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 126.686 1.994 . . . . 0.0 113.199 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -66.3 147.2 53.66 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 121.528 -0.732 . . . . 0.0 110.967 173.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -52.56 -47.79 66.58 Favored 'General case' 0 CA--C 1.536 0.432 0 O-C-N 121.562 -0.711 . . . . 0.0 112.422 179.154 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.2 tp -58.37 -30.31 40.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -179.224 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 41.0 t -71.56 -47.43 58.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 O-C-N 121.499 -0.751 . . . . 0.0 110.332 173.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 76.1 mt -61.86 -36.73 82.09 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.124 0.875 . . . . 0.0 111.844 177.409 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 13.5 mtt -59.15 -51.53 69.63 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 124.638 1.175 . . . . 0.0 111.936 170.025 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.94 -39.07 90.82 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.265 0.626 . . . . 0.0 112.675 177.257 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 88.4 mt-30 -61.33 -47.76 84.42 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 119.121 0.873 . . . . 0.0 111.826 173.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -61.61 -45.59 93.44 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.73 0.812 . . . . 0.0 112.48 178.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 83.5 mt -65.91 -44.72 84.38 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.761 0.824 . . . . 0.0 112.268 175.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -65.08 -36.19 83.54 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 120.972 -1.08 . . . . 0.0 112.755 -177.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 55.0 mtmt -58.68 -45.5 89.3 Favored 'General case' 0 N--CA 1.474 0.746 0 O-C-N 121.5 -0.75 . . . . 0.0 111.701 172.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 93.2 mt -66.86 -43.51 89.54 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 123.507 0.723 . . . . 0.0 110.927 176.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -51.69 -51.42 56.12 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.757 0.823 . . . . 0.0 111.136 173.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 91.9 mt -61.98 -41.77 98.39 Favored 'General case' 0 CA--C 1.541 0.603 0 O-C-N 121.738 -0.601 . . . . 0.0 112.573 178.015 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 91.2 mm-40 -61.44 -36.47 80.49 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 119.392 0.997 . . . . 0.0 113.173 174.269 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 66.9 mmtt -72.62 -51.57 19.09 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.973 0.909 . . . . 0.0 112.435 177.311 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 6.0 m -67.98 -24.85 30.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 CA-C-N 120.333 1.424 . . . . 0.0 112.352 179.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -59.14 -27.19 65.39 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.535 -0.728 . . . . 0.0 112.833 171.18 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -99.84 2.22 43.7 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.539 1.536 . . . . 0.0 112.427 178.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 11.2 ttm -55.7 141.05 66.21 Favored Pre-proline 0 CA--C 1.548 0.869 0 C-N-CA 124.671 1.188 . . . . 0.0 111.824 172.553 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -67.24 122.15 9.38 Favored 'Trans proline' 0 CA--C 1.538 0.68 0 C-N-CA 122.996 2.464 . . . . 0.0 109.566 169.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -70.63 -17.99 62.87 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -171.453 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 9.8 mp0 -94.39 159.58 15.05 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.551 1.54 . . . . 0.0 111.941 179.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -120.96 129.81 53.59 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.113 1.365 . . . . 0.0 110.856 -175.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 9.5 p -152.63 151.41 11.87 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 124.624 1.17 . . . . 0.0 112.338 -179.329 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -57.24 137.91 55.38 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.55 1.54 . . . . 0.0 112.619 169.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 52.0 mt . . . . . 0 N--CA 1.47 0.54 0 C-N-CA 123.486 0.714 . . . . 0.0 112.444 169.635 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.232 0 N-CA-C 112.056 -0.418 . . . . 0.0 112.056 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 37.7 ptt180 -155.11 156.8 36.45 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.569 1.548 . . . . 0.0 110.74 172.074 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 36.3 mtpt -76.02 143.16 41.61 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 121.285 0.564 . . . . 0.0 110.053 168.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 67.0 p -139.45 165.41 27.31 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 125.134 1.373 . . . . 0.0 109.953 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 27.1 p-10 -52.49 -31.33 34.58 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 171.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.5 mm100 -67.91 -50.43 56.25 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.775 0.83 . . . . 0.0 111.377 176.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.0 mt -65.51 -32.65 74.37 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.736 -0.603 . . . . 0.0 112.519 175.255 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -61.6 -50.63 71.82 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 118.341 0.518 . . . . 0.0 110.77 169.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 65.4 t80 -57.61 -41.26 80.91 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.624 0.77 . . . . 0.0 112.313 178.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 91.0 mmm -56.91 -50.41 72.65 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 121.886 -0.509 . . . . 0.0 112.115 171.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -83.2 -10.07 58.8 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.704 1.372 . . . . 0.0 114.704 -174.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 61.9 t30 -119.79 -15.87 8.82 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.196 1.399 . . . . 0.0 113.297 -169.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 42.0 t -130.28 -53.56 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 C-N-CA 123.281 0.632 . . . . 0.0 110.96 176.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.6 t -69.83 -65.72 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 123.119 0.568 . . . . 0.0 110.77 -172.033 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 79.4 t -57.19 -46.0 84.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 124.398 1.079 . . . . 0.0 110.368 173.02 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.8 tttt -59.84 -40.05 87.19 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.386 0.674 . . . . 0.0 112.734 -175.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 62.7 m -73.85 -45.45 50.99 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 118.343 0.52 . . . . 0.0 111.801 174.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 67.9 mt -62.03 -33.46 74.41 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.295 0.638 . . . . 0.0 112.388 179.134 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 25.0 t-105 -69.46 -31.26 69.44 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.428 1.491 . . . . 0.0 113.188 175.085 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 56.4 mtmt -82.49 -5.34 58.65 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 113.692 0.997 . . . . 0.0 113.692 176.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 39.4 t-80 -64.22 156.38 28.92 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.6 1.16 . . . . 0.0 113.401 -179.023 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 19.2 mm100 -59.69 -23.27 62.98 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.241 1.416 . . . . 0.0 114.104 175.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -124.65 20.22 8.6 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.214 1.406 . . . . 0.0 113.48 -172.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.64 -26.59 64.49 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.102 1.361 . . . . 0.0 113.958 176.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 64.1 p-90 -58.87 -34.16 22.22 Favored Pre-proline 0 CA--C 1.547 0.84 0 N-CA-C 117.875 2.546 . . . . 0.0 117.875 -169.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -77.75 -0.18 10.4 Favored 'Trans proline' 0 CA--C 1.544 0.994 0 CA-C-N 123.213 2.183 . . . . 0.0 113.387 175.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -114.63 -3.67 12.88 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.759 1.624 . . . . 0.0 113.158 178.182 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 18.4 m-30 -62.68 -7.52 5.0 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 115.276 1.584 . . . . 0.0 115.276 179.443 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 25.1 pt20 -159.66 157.98 26.89 Favored Pre-proline 0 CA--C 1.545 0.773 0 C-N-CA 126.188 1.795 . . . . 0.0 110.009 -169.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -66.08 142.25 67.14 Favored 'Trans proline' 0 CA--C 1.538 0.676 0 C-N-CA 122.702 2.268 . . . . 0.0 111.731 177.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 68.1 t -60.3 139.0 20.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 123.859 0.864 . . . . 0.0 111.322 173.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 50.6 m-20 -114.4 107.09 15.09 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.079 1.352 . . . . 0.0 109.497 169.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.32 -26.89 63.59 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.148 0.979 . . . . 0.0 113.419 177.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 80.3 mt -66.56 -50.17 68.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 124.979 1.311 . . . . 0.0 110.864 173.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -64.56 -40.66 95.98 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.547 1.139 . . . . 0.0 112.695 -178.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 47.7 mt -88.78 -0.76 57.63 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.555 1.142 . . . . 0.0 114.007 179.621 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 61.0 t30 52.28 58.07 5.8 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.019 1.728 . . . . 0.0 113.68 -179.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 54.2 mt -114.42 83.21 8.32 Favored Pre-proline 0 CA--C 1.547 0.842 0 C-N-CA 126.331 1.852 . . . . 0.0 110.089 -176.074 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -67.79 -7.44 19.53 Favored 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 124.207 3.271 . . . . 0.0 115.456 -169.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -130.38 19.04 5.31 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.774 1.63 . . . . 0.0 112.257 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 70.4 t80 -46.96 -56.44 6.39 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.496 1.118 . . . . 0.0 113.526 -173.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -76.23 -3.07 34.44 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 114.608 1.336 . . . . 0.0 114.608 -179.128 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -84.1 -42.0 16.53 Favored 'General case' 0 N--CA 1.477 0.879 0 O-C-N 121.127 -0.983 . . . . 0.0 110.855 173.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.2 mp -81.67 -51.04 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 124.103 0.961 . . . . 0.0 110.408 173.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.418 HD11 ' HB2' ' A' ' 115' ' ' TYR . 44.2 mm -71.92 114.47 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 CA-C-O 121.556 0.693 . . . . 0.0 110.142 178.864 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 70.6 mmtt -83.85 -27.93 28.37 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.619 1.168 . . . . 0.0 113.045 179.595 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 21.4 p30 -153.16 81.63 5.05 Favored Pre-proline 0 CA--C 1.548 0.866 0 C-N-CA 126.09 1.756 . . . . 0.0 111.326 -170.025 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -69.17 138.11 38.86 Favored 'Trans proline' 0 CA--C 1.54 0.791 0 C-N-CA 123.498 2.799 . . . . 0.0 111.097 -179.126 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.8 tpt -154.59 141.19 18.91 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.236 1.414 . . . . 0.0 110.03 -178.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -144.68 148.14 33.87 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.397 1.479 . . . . 0.0 111.139 -177.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.6 ttp -57.19 -36.2 70.55 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.903 1.281 . . . . 0.0 113.3 -172.216 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.89 -22.82 60.54 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 125.127 1.346 . . . . 0.0 114.603 173.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 24.5 m -97.12 -34.59 11.09 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.846 1.258 . . . . 0.0 111.425 174.229 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 81.4 mt -53.94 -50.93 50.08 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 CA-C-N 119.31 0.959 . . . . 0.0 110.569 173.145 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -61.88 -32.5 72.87 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 178.096 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.432 ' HA ' ' HE3' ' A' ' 88' ' ' LYS . 1.1 tpmt? -68.78 -31.9 71.26 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -175.238 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 3.8 ptp180 -78.08 -26.45 48.17 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 113.941 1.089 . . . . 0.0 113.941 170.041 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 82.2 mt -70.66 -31.45 68.38 Favored 'General case' 0 N--CA 1.481 1.092 0 CA-C-N 119.648 1.113 . . . . 0.0 113.037 168.414 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -68.18 3.61 1.58 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.401 1.48 . . . . 0.0 113.476 171.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -130.74 163.18 27.85 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 127.685 2.394 . . . . 0.0 110.484 175.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -83.31 37.5 0.56 Allowed 'General case' 0 CA--C 1.55 0.966 0 O-C-N 120.834 -1.166 . . . . 0.0 111.581 169.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -60.76 -32.14 71.46 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.088 1.355 . . . . 0.0 114.32 -168.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -132.99 175.88 8.98 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 127.602 2.361 . . . . 0.0 111.057 178.199 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 9.7 t-105 -100.95 -25.91 13.92 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.893 1.277 . . . . 0.0 112.886 -178.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 34.7 t -143.77 148.64 35.91 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.287 1.035 . . . . 0.0 112.82 -170.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -65.36 -18.8 65.6 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 115.991 1.848 . . . . 0.0 115.991 -174.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 32.6 t -56.08 -32.48 64.16 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.398 0.999 . . . . 0.0 112.603 178.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -63.53 -45.97 88.13 Favored 'General case' 0 CA--C 1.544 0.727 0 O-C-N 121.272 -0.892 . . . . 0.0 112.264 173.499 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 48.8 t -65.28 -37.1 86.13 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.869 0.868 . . . . 0.0 112.602 174.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 82.5 mtp -65.65 -40.47 92.51 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.724 0.81 . . . . 0.0 111.881 175.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -62.1 -39.8 93.72 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.369 0.668 . . . . 0.0 112.076 170.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 85.2 m-20 -64.28 -39.58 94.23 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.366 0.985 . . . . 0.0 112.73 175.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -61.01 -46.98 88.54 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.5 -0.75 . . . . 0.0 112.315 170.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 17.5 t30 -56.63 -45.25 81.66 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.084 0.553 . . . . 0.0 111.893 174.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 52.3 m -62.51 -40.36 96.47 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.381 1.072 . . . . 0.0 112.687 175.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 53.1 ttp -59.52 -52.32 66.09 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 119.708 1.14 . . . . 0.0 112.061 177.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -68.45 -39.81 81.32 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 179.619 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 85.6 m -64.72 -47.55 77.89 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.588 0.755 . . . . 0.0 112.037 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -64.69 -31.94 73.39 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 119.024 0.829 . . . . 0.0 112.121 -179.551 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 81.3 m -61.66 -43.44 98.86 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.816 0.846 . . . . 0.0 112.794 170.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -68.02 -32.2 72.41 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.929 1.085 . . . . 0.0 113.929 178.66 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 92.3 mt -64.38 -57.63 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 C-N-CA 123.471 0.708 . . . . 0.0 110.994 177.21 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . 0.418 ' HB2' HD11 ' A' ' 77' ' ' ILE . 31.0 t80 -68.79 -35.94 77.65 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 114.375 1.25 . . . . 0.0 114.375 -172.301 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 64.1 m-80 -103.98 159.84 15.33 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.804 0.841 . . . . 0.0 113.164 -169.22 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 3.4 mppt? -66.0 148.44 98.34 Favored Pre-proline 0 N--CA 1.472 0.667 0 C-N-CA 124.187 0.995 . . . . 0.0 110.523 172.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -65.37 -7.8 16.96 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 123.563 2.842 . . . . 0.0 114.567 -177.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 69.5 p -115.53 1.79 13.69 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 126.473 1.909 . . . . 0.0 113.108 179.518 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -65.89 143.73 57.26 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 121.491 -0.756 . . . . 0.0 110.509 173.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -52.59 -45.62 66.59 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.633 -0.667 . . . . 0.0 112.526 -178.422 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 9.5 tp -56.55 -34.7 42.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 124.637 1.175 . . . . 0.0 113.885 177.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 55.7 t -71.49 -42.52 72.71 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 C-N-CA 123.403 0.681 . . . . 0.0 110.65 175.124 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 66.5 mt -62.37 -36.24 81.65 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.099 0.863 . . . . 0.0 111.917 175.196 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -58.11 -53.45 58.11 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 118.298 0.499 . . . . 0.0 110.919 170.597 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -59.39 -41.43 89.35 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 123.745 0.818 . . . . 0.0 112.399 179.314 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -61.16 -39.9 91.84 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.999 0.92 . . . . 0.0 113.12 175.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -79.13 -31.57 44.17 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 85.1 mt -71.02 -46.4 62.2 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.351 0.66 . . . . 0.0 111.297 170.053 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -63.31 -38.04 89.6 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 121.102 -0.999 . . . . 0.0 113.244 -173.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 4.9 ptpp? -60.14 -39.36 86.06 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 121.456 -0.778 . . . . 0.0 112.543 175.136 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 78.4 mt -73.18 -41.2 58.53 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 C-N-CA 124.193 0.997 . . . . 0.0 111.518 175.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -50.96 -52.14 45.51 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 119.162 0.892 . . . . 0.0 110.438 172.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.3 mt -63.63 -40.1 96.03 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 118.558 -0.734 . . . . 0.0 112.909 177.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -68.43 -30.56 69.48 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 120.373 1.442 . . . . 0.0 112.657 179.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 69.0 mmtt -75.94 -48.19 22.19 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 117.89 -1.052 . . . . 0.0 112.301 176.122 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.9 m -67.84 -25.79 33.33 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 CA-C-N 120.765 1.62 . . . . 0.0 112.04 176.398 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -62.19 -30.53 71.13 Favored 'General case' 0 CA--C 1.541 0.609 0 O-C-N 121.492 -0.755 . . . . 0.0 112.477 171.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -91.29 -3.26 57.02 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.062 1.345 . . . . 0.0 112.913 176.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 5.9 ttm -57.0 141.2 76.5 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 124.152 0.981 . . . . 0.0 111.271 171.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -63.05 144.23 92.31 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 C-N-CA 122.494 2.129 . . . . 0.0 109.911 168.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -74.87 -23.46 58.4 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 114.239 1.199 . . . . 0.0 114.239 -179.115 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -100.04 155.25 17.82 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.636 1.574 . . . . 0.0 113.024 -169.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -112.79 137.1 51.62 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.962 1.705 . . . . 0.0 111.229 -174.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 12.7 p -146.62 141.18 20.69 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 C-N-CA 124.657 1.183 . . . . 0.0 110.735 172.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -68.52 134.71 50.47 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.509 1.124 . . . . 0.0 111.074 175.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 96.0 mt . . . . . 0 CA--C 1.539 0.546 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 -175.988 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.038 0 N-CA-C 114.474 0.55 . . . . 0.0 114.474 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 -162.9 163.55 26.3 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 127.65 2.38 . . . . 0.0 109.586 170.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.8 ttmm -73.0 142.57 47.74 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 122.907 0.483 . . . . 0.0 111.634 177.462 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 82.6 p -138.7 165.16 27.68 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.935 1.694 . . . . 0.0 109.51 -179.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 22.2 t30 -51.36 -31.43 22.11 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 114.168 1.173 . . . . 0.0 114.168 174.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 69.3 mt-30 -74.84 -48.79 23.23 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.166 -0.959 . . . . 0.0 112.791 174.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 89.1 mt -61.95 -31.43 71.77 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 120.331 1.423 . . . . 0.0 112.479 173.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.5 tp60 -60.8 -52.67 64.09 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.107 0.963 . . . . 0.0 110.906 170.462 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 83.5 t80 -55.83 -41.95 75.02 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.088 0.955 . . . . 0.0 112.446 176.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 87.9 mmm -55.21 -53.99 49.0 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 122.685 0.394 . . . . 0.0 111.267 172.066 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -70.67 -22.93 62.43 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 114.833 1.42 . . . . 0.0 114.833 -178.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 18.8 m-80 -108.04 -17.23 14.09 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 115.074 1.509 . . . . 0.0 115.074 -168.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.6 t -138.83 -41.08 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 CA-C-N 119.078 0.854 . . . . 0.0 112.036 -176.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 11.9 t -71.62 -69.96 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 176.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 69.5 t -58.36 -48.63 84.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 126.138 1.775 . . . . 0.0 111.495 177.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 70.2 tttt -56.54 -43.43 79.86 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.491 0.716 . . . . 0.0 112.884 -171.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 60.4 m -85.28 -34.93 21.81 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.327 0.651 . . . . 0.0 112.455 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 68.6 mt -59.65 -32.85 70.83 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 119.629 1.104 . . . . 0.0 111.712 169.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 29.3 t-105 -73.14 -34.41 66.07 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 126.048 1.739 . . . . 0.0 113.162 175.068 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp -76.03 -11.17 59.9 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.554 1.142 . . . . 0.0 113.982 174.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 55.7 t-80 -61.23 150.83 33.36 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.168 1.387 . . . . 0.0 113.181 -178.188 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -60.37 -20.94 61.41 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.014 1.326 . . . . 0.0 113.727 178.357 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -116.06 16.81 16.01 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.535 1.534 . . . . 0.0 113.643 -178.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.67 -29.85 65.06 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 113.979 1.103 . . . . 0.0 113.979 177.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 68.1 p-90 -57.67 -34.05 22.65 Favored Pre-proline 0 CA--C 1.548 0.9 0 N-CA-C 118.019 2.6 . . . . 0.0 118.019 -170.334 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -75.51 -4.78 15.75 Favored 'Trans proline' 0 CA--C 1.543 0.966 0 CA-C-N 123.598 2.321 . . . . 0.0 113.408 174.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -108.16 -4.52 17.59 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.38 1.472 . . . . 0.0 112.968 178.195 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.7 m-30 -64.47 -17.89 64.27 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 114.011 1.115 . . . . 0.0 114.011 179.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 7.7 mp0 -139.36 155.06 72.31 Favored Pre-proline 0 CA--C 1.544 0.747 0 C-N-CA 125.726 1.611 . . . . 0.0 110.203 -176.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -65.68 141.56 66.77 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 122.252 1.968 . . . . 0.0 111.888 174.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 50.7 t -56.93 145.54 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 124.561 1.144 . . . . 0.0 111.627 172.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -121.64 120.57 35.13 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 124.55 1.14 . . . . 0.0 110.049 169.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.55 -31.28 70.39 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 123.2 0.6 . . . . 0.0 112.59 178.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 81.8 mt -67.37 -49.69 69.38 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 C-N-CA 124.525 1.13 . . . . 0.0 110.923 173.552 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm -64.34 -39.35 93.72 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.219 1.408 . . . . 0.0 113.445 -176.296 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.4 mp -90.93 0.57 57.48 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.249 1.02 . . . . 0.0 113.058 177.233 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 65.9 t30 54.18 53.91 10.33 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 126.001 1.721 . . . . 0.0 113.636 -179.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 52.6 mt -111.51 95.31 26.39 Favored Pre-proline 0 CA--C 1.546 0.797 0 C-N-CA 126.415 1.886 . . . . 0.0 110.212 -174.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -68.92 -8.37 23.33 Favored 'Trans proline' 0 CA--C 1.544 1.022 0 C-N-CA 123.455 2.77 . . . . 0.0 114.632 -174.001 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -138.41 21.39 2.75 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 125.569 1.548 . . . . 0.0 112.881 -174.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 47.5 t80 -50.61 -55.13 17.73 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 120.44 -1.413 . . . . 0.0 113.484 -174.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -76.7 -10.56 59.47 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.692 1.197 . . . . 0.0 114.208 -179.154 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.3 mmmm -72.93 -44.33 61.32 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.404 1.082 . . . . 0.0 110.117 176.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.4 mp -81.41 -52.4 13.97 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 123.963 0.905 . . . . 0.0 110.075 172.542 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 20.5 mm -81.43 104.89 10.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 CA-C-O 122.183 0.992 . . . . 0.0 111.629 -176.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 69.8 mmtt -69.7 -35.09 74.78 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.856 1.662 . . . . 0.0 113.603 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 70.5 m-80 -143.1 94.34 6.35 Favored Pre-proline 0 CA--C 1.545 0.776 0 C-N-CA 125.79 1.636 . . . . 0.0 110.013 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -70.67 149.21 60.71 Favored 'Trans proline' 0 CA--C 1.538 0.721 0 C-N-CA 123.141 2.561 . . . . 0.0 111.103 178.161 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -153.93 136.06 14.77 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.434 1.094 . . . . 0.0 110.182 -174.596 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -143.82 148.98 36.32 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.56 1.944 . . . . 0.0 110.815 177.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.6 ttp -57.94 -34.31 69.76 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.797 1.239 . . . . 0.0 113.043 -171.469 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -56.87 -27.6 56.53 Favored Glycine 0 CA--C 1.532 1.145 0 C-N-CA 125.375 1.464 . . . . 0.0 114.394 173.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 43.7 m -78.38 -45.92 21.23 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 118.032 0.916 . . . . 0.0 110.878 169.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.9 mt -55.82 -53.76 34.01 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 C-N-CA 125.076 1.35 . . . . 0.0 111.754 -175.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 4.8 ptpt -54.15 -38.2 65.26 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 174.069 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.548 ' HE2' ' HA ' ' A' ' 88' ' ' LYS . 0.2 OUTLIER -71.03 -39.31 72.41 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.156 0.982 . . . . 0.0 113.179 -176.996 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 12.4 ptp180 -72.43 -32.34 66.23 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 113.683 0.994 . . . . 0.0 113.683 172.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 53.2 mt -61.19 -43.54 98.71 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.416 0.686 . . . . 0.0 112.821 169.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -59.63 -39.37 84.1 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 -176.138 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -108.55 17.21 22.26 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 -171.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 27.1 m-20 54.79 59.72 3.92 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.467 1.907 . . . . 0.0 114.159 174.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 76.6 t80 -63.55 -20.5 65.69 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.401 1.08 . . . . 0.0 113.588 178.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -145.06 177.48 8.74 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 129.483 3.113 . . . . 0.0 110.768 -173.62 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.7 t-105 -104.47 -27.5 11.88 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.264 1.026 . . . . 0.0 112.843 174.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 20.2 m -126.15 138.62 53.68 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.078 0.951 . . . . 0.0 113.273 -168.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -65.52 -19.74 66.05 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 115.939 1.829 . . . . 0.0 115.939 -175.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 16.8 m -56.55 -28.0 59.05 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.179 0.9 . . . . 0.0 112.826 173.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 56.5 mm-40 -70.35 -43.72 69.61 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.629 0.771 . . . . 0.0 112.03 173.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 42.8 t -62.51 -36.41 82.46 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 121.437 -0.789 . . . . 0.0 112.46 172.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 79.0 mtp -63.64 -40.04 95.87 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 121.392 -0.818 . . . . 0.0 112.36 175.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.06 -32.01 73.28 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.262 0.625 . . . . 0.0 112.144 174.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -72.85 -42.45 63.71 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.505 0.722 . . . . 0.0 111.554 178.087 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 -59.49 -46.28 89.26 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 118.546 0.612 . . . . 0.0 112.148 169.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 24.5 t30 -56.84 -44.51 82.17 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.02 0.528 . . . . 0.0 112.054 174.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 36.8 m -66.54 -36.41 82.6 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.852 0.861 . . . . 0.0 112.265 178.174 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 48.5 ttp -61.62 -55.47 30.25 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.27 -0.894 . . . . 0.0 112.083 174.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -65.72 -38.66 89.79 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 122.039 -0.413 . . . . 0.0 111.845 -179.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 91.8 m -66.0 -46.3 78.47 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 121.572 -0.705 . . . . 0.0 112.46 178.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.1 p30 -63.79 -31.64 72.88 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 120.117 1.326 . . . . 0.0 112.315 178.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 33.4 m -59.78 -47.51 85.39 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 118.917 -0.563 . . . . 0.0 112.047 169.089 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -68.51 -31.06 70.04 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 114.048 1.129 . . . . 0.0 114.048 179.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 88.2 mt -67.78 -59.3 3.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 123.304 0.642 . . . . 0.0 110.607 175.195 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 32.2 t80 -71.79 -35.15 69.9 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 114.023 1.119 . . . . 0.0 114.023 -171.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -105.8 155.09 19.64 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.334 1.053 . . . . 0.0 111.64 -172.308 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -72.91 154.04 91.0 Favored Pre-proline 0 N--CA 1.471 0.609 0 C-N-CA 124.304 1.041 . . . . 0.0 110.429 178.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -64.78 -0.82 3.45 Favored 'Trans proline' 0 CA--C 1.545 1.05 0 C-N-CA 123.748 2.965 . . . . 0.0 114.883 -179.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 64.5 p -116.31 -2.58 12.08 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 126.999 2.12 . . . . 0.0 113.134 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 62.4 m-20 -71.51 143.21 50.06 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 119.08 0.854 . . . . 0.0 110.449 171.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -56.05 -47.34 78.09 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 121.538 -0.726 . . . . 0.0 112.373 -175.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.5 tp -52.34 -30.91 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 125.201 1.4 . . . . 0.0 114.332 177.029 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 52.4 t -74.05 -47.19 43.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 O-C-N 121.569 -0.707 . . . . 0.0 110.809 174.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 76.1 mt -61.48 -37.35 83.32 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 119.237 0.926 . . . . 0.0 111.66 177.105 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 7.8 mtp -60.13 -50.77 72.36 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.506 1.523 . . . . 0.0 111.999 170.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.91 -39.68 90.27 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.55 0.74 . . . . 0.0 112.824 175.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 88.9 mt-30 -60.83 -48.53 81.4 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 119.413 1.006 . . . . 0.0 111.823 173.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -61.19 -42.64 98.94 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.512 0.725 . . . . 0.0 112.671 178.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 86.7 mt -66.02 -45.84 80.04 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.607 0.763 . . . . 0.0 112.067 173.381 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -64.43 -39.65 94.24 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 121.054 -1.028 . . . . 0.0 112.621 -176.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 5.2 mtpm? -56.3 -36.98 69.27 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 121.529 -0.732 . . . . 0.0 112.041 175.038 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 68.4 mt -75.24 -46.65 38.15 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 123.627 0.771 . . . . 0.0 111.073 173.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 43.9 t80 -49.25 -48.22 45.92 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 119.933 1.242 . . . . 0.0 111.771 174.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.3 mt -65.43 -38.89 91.25 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.32 -0.862 . . . . 0.0 113.046 178.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -67.6 -29.37 68.69 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 119.97 1.259 . . . . 0.0 112.376 176.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 28.7 mmtp -75.53 -49.98 17.05 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.25 1.42 . . . . 0.0 112.577 178.624 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 7.1 m -69.84 -25.41 28.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 119.289 0.949 . . . . 0.0 111.736 178.163 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -61.65 -29.81 70.31 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.665 -0.647 . . . . 0.0 112.453 170.157 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -96.96 1.26 50.14 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.595 1.558 . . . . 0.0 112.626 177.268 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 8.4 ttm -54.13 139.67 54.51 Favored Pre-proline 0 CA--C 1.544 0.725 0 C-N-CA 124.271 1.028 . . . . 0.0 111.306 172.226 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -66.51 117.95 5.14 Favored 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 122.463 2.109 . . . . 0.0 108.568 169.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 -65.64 -28.49 69.15 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 -173.044 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -83.75 164.4 19.61 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.135 1.774 . . . . 0.0 111.953 172.138 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -132.24 143.22 49.77 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.111 0.964 . . . . 0.0 111.731 -175.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 55.0 t -130.69 133.29 63.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 125.504 1.521 . . . . 0.0 110.371 -176.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -68.07 117.05 9.41 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.68 1.592 . . . . 0.0 111.221 170.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 80.6 mt . . . . . 0 N--CA 1.472 0.654 0 N-CA-C 113.245 0.831 . . . . 0.0 113.245 -178.32 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.975 0 CA-C-O 121.053 0.252 . . . . 0.0 113.24 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 37.8 ptt180 -159.17 160.47 35.53 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.91 1.684 . . . . 0.0 110.982 175.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 22.5 ptmt -70.87 132.85 45.89 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.584 0.753 . . . . 0.0 110.837 169.408 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 77.4 p -140.62 161.59 37.39 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 125.076 1.35 . . . . 0.0 111.38 -177.087 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 26.5 p-10 -48.99 -38.94 24.71 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 114.066 1.135 . . . . 0.0 114.066 170.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -69.7 -51.22 36.39 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.65 0.78 . . . . 0.0 111.557 178.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.5 mt -65.73 -30.18 70.81 Favored 'General case' 0 CA--C 1.54 0.582 0 O-C-N 121.652 -0.655 . . . . 0.0 112.36 177.423 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 44.7 tt0 -60.8 -52.54 64.66 Favored 'General case' 0 C--O 1.224 -0.268 0 C-N-CA 123.427 0.691 . . . . 0.0 110.237 169.056 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -56.25 -42.18 76.96 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 118.836 0.744 . . . . 0.0 112.15 179.14 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 96.5 mmm -55.98 -50.71 70.06 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 172.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -84.44 -11.5 56.09 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -174.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 66.6 t30 -117.19 -18.86 9.88 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.55 1.54 . . . . 0.0 112.872 -170.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 6.0 t -133.6 -49.67 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 C-N-CA 123.606 0.762 . . . . 0.0 111.869 -177.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 22.3 t -69.28 -64.22 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 CA-C-N 119.095 0.861 . . . . 0.0 110.794 -176.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 45.0 t -53.83 -50.07 54.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 124.864 1.265 . . . . 0.0 109.841 171.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.3 tppt? -60.74 -26.35 67.13 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 -174.095 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 21.0 m -98.66 -39.65 8.57 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-N 118.948 0.795 . . . . 0.0 112.429 177.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 80.7 mt -59.0 -30.14 67.77 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.485 -0.759 . . . . 0.0 112.121 171.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . 0.429 ' CE3' ' HD3' ' A' ' 87' ' ' LYS . 27.5 t-105 -75.56 -39.22 58.47 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 114.826 1.417 . . . . 0.0 114.826 179.061 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 8.9 ptpp? -76.62 -10.42 59.38 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 177.116 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 60.3 t-80 -54.74 152.5 7.03 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.073 1.749 . . . . 0.0 113.456 -178.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 58.9 mt-30 -54.37 -25.57 25.11 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.813 1.645 . . . . 0.0 114.437 177.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -125.19 18.62 8.33 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.041 1.337 . . . . 0.0 113.705 -172.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.13 -24.85 63.25 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.391 1.476 . . . . 0.0 114.177 176.17 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 64.6 p-90 -58.14 -33.42 17.74 Favored Pre-proline 0 CA--C 1.547 0.851 0 N-CA-C 117.592 2.441 . . . . 0.0 117.592 -170.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -81.27 2.29 8.68 Favored 'Trans proline' 0 CA--C 1.547 1.133 0 CA-C-N 123.041 2.122 . . . . 0.0 113.237 175.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -113.38 -5.29 13.55 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.493 1.517 . . . . 0.0 113.572 178.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 23.4 m-30 -64.19 -17.99 64.06 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 119.848 1.204 . . . . 0.0 113.952 177.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -144.03 158.31 55.8 Favored Pre-proline 0 CA--C 1.546 0.819 0 C-N-CA 126.55 1.94 . . . . 0.0 110.625 -176.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -67.48 159.5 52.18 Favored 'Trans proline' 0 CA--C 1.537 0.635 0 C-N-CA 123.061 2.507 . . . . 0.0 112.476 172.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 60.1 t -70.86 107.08 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 123.85 0.86 . . . . 0.0 109.458 170.066 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 -72.39 79.95 1.03 Allowed 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.282 1.033 . . . . 0.0 110.517 169.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -51.16 -27.72 9.35 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.917 1.287 . . . . 0.0 114.348 -177.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 85.2 mt -64.0 -48.38 86.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 125.592 1.557 . . . . 0.0 111.566 172.136 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -75.96 -39.83 55.23 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.57 1.548 . . . . 0.0 112.899 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -74.74 -9.65 58.77 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.874 1.67 . . . . 0.0 113.094 176.085 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 57.75 55.0 5.77 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.426 1.891 . . . . 0.0 112.527 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 55.8 mt -116.1 78.96 8.07 Favored Pre-proline 0 CA--C 1.543 0.706 0 C-N-CA 126.241 1.816 . . . . 0.0 110.703 -178.444 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -66.87 -16.67 50.56 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 123.302 2.668 . . . . 0.0 112.999 -179.166 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 -100.96 7.54 43.5 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.903 1.681 . . . . 0.0 113.103 175.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 79.0 t80 -52.75 -56.48 15.34 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 120.462 -1.399 . . . . 0.0 112.398 -176.506 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -74.07 -15.08 61.08 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.776 1.23 . . . . 0.0 114.128 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 9.9 mptt -69.92 -31.88 69.88 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.042 0.937 . . . . 0.0 111.592 177.251 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.4 mp -102.05 -45.2 10.81 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 125.688 1.595 . . . . 0.0 111.27 176.077 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.599 HD11 ' HB2' ' A' ' 115' ' ' TYR . 34.4 mm -76.42 101.68 2.86 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 121.929 0.871 . . . . 0.0 111.151 179.006 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.68 -40.72 95.89 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.747 1.619 . . . . 0.0 112.983 172.026 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -144.22 98.77 5.05 Favored Pre-proline 0 CA--C 1.545 0.766 0 C-N-CA 125.347 1.459 . . . . 0.0 110.575 -176.362 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -74.49 147.31 36.16 Favored 'Trans proline' 0 CA--C 1.539 0.773 0 C-N-CA 123.206 2.604 . . . . 0.0 111.083 175.361 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.3 tpt -155.68 148.26 23.98 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.832 1.253 . . . . 0.0 110.557 178.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -147.46 154.45 40.81 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 125.686 1.595 . . . . 0.0 111.368 179.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.5 ttp -62.03 -36.96 83.14 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 123.856 0.862 . . . . 0.0 112.563 -171.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -56.11 -49.11 69.5 Favored Glycine 0 CA--C 1.532 1.142 0 C-N-CA 124.242 0.925 . . . . 0.0 112.615 177.198 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 85.2 m -69.67 -33.71 72.96 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 117.661 -1.161 . . . . 0.0 112.648 174.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 97.7 mt -56.56 -49.54 77.2 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 CA-C-N 120.663 1.574 . . . . 0.0 110.826 172.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.429 ' HD3' ' CE3' ' A' ' 51' ' ' TRP . 0.4 OUTLIER -60.35 -35.36 75.5 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 118.698 0.681 . . . . 0.0 112.511 174.941 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.452 ' HA ' ' HE3' ' A' ' 88' ' ' LYS . 1.4 tpmt? -65.73 -41.9 91.69 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 -179.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 13.3 ptp180 -67.68 -24.08 65.38 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 173.265 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 74.8 mt -75.66 -39.06 58.24 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 167.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -63.05 -27.26 69.28 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 114.845 1.424 . . . . 0.0 114.845 -176.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -137.04 136.28 38.27 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.907 1.683 . . . . 0.0 110.642 -179.312 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 -51.99 134.4 32.0 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.227 1.411 . . . . 0.0 113.81 -169.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 44.1 t80 -155.54 -34.48 0.09 Allowed 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.588 1.555 . . . . 0.0 112.981 179.109 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -134.86 176.79 8.33 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.234 1.414 . . . . 0.0 112.045 179.127 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 12.0 t-105 -115.16 -21.1 10.13 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.114 1.365 . . . . 0.0 113.31 -169.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 44.3 t -144.63 151.53 39.14 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 125.489 1.516 . . . . 0.0 111.207 -178.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -58.56 -22.55 56.13 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 115.572 1.693 . . . . 0.0 115.572 -177.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 39.5 m -54.8 -31.52 59.11 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 -179.044 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -68.87 -46.07 69.37 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 121.374 -0.829 . . . . 0.0 112.17 173.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 46.4 t -63.75 -36.34 83.54 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.515 1.126 . . . . 0.0 112.354 177.433 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 81.6 mtp -58.67 -40.56 83.89 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 123.93 0.892 . . . . 0.0 112.535 174.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -66.68 -32.57 73.98 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 174.314 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 -69.36 -39.29 78.17 Favored 'General case' 0 CA--C 1.541 0.634 0 O-C-N 120.98 -1.075 . . . . 0.0 111.759 173.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -60.35 -47.13 87.36 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.446 -0.784 . . . . 0.0 112.145 169.442 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -60.19 -41.08 92.16 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 121.665 -0.647 . . . . 0.0 111.429 175.4 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 86.0 m -62.31 -40.14 95.35 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.764 0.826 . . . . 0.0 111.756 177.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 48.0 ttp -59.64 -50.75 72.67 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.481 0.713 . . . . 0.0 112.305 175.431 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -71.08 -41.67 70.38 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -179.532 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 41.7 m -64.97 -46.75 80.17 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 121.358 -0.839 . . . . 0.0 112.09 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -63.23 -32.83 74.33 Favored 'General case' 0 CA--C 1.547 0.854 0 CA-C-N 119.585 1.084 . . . . 0.0 112.004 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 67.4 m -61.06 -43.23 99.2 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.904 0.882 . . . . 0.0 113.136 170.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 17.9 m-85 -67.52 -31.91 72.35 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 177.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 87.3 mt -68.18 -56.06 14.11 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.825 0 C-N-CA 123.266 0.626 . . . . 0.0 110.785 177.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . 0.599 ' HB2' HD11 ' A' ' 77' ' ' ILE . 34.5 t80 -69.41 -36.79 77.06 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 114.389 1.255 . . . . 0.0 114.389 -172.296 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 60.1 m-80 -101.01 158.71 15.8 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.245 1.018 . . . . 0.0 111.872 -172.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 3.7 mptp? -70.35 151.07 95.81 Favored Pre-proline 0 N--CA 1.47 0.568 0 C-N-CA 123.822 0.849 . . . . 0.0 109.671 174.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -65.45 -1.03 4.14 Favored 'Trans proline' 0 CA--C 1.546 1.076 0 C-N-CA 123.714 2.943 . . . . 0.0 114.725 -179.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 52.6 p -119.96 -2.19 10.32 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 127.266 2.226 . . . . 0.0 113.207 -179.431 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -67.44 145.54 54.91 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 118.837 0.744 . . . . 0.0 110.545 169.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -58.01 -40.89 81.93 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 121.561 -0.712 . . . . 0.0 112.386 -173.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 9.9 tp -55.59 -35.73 39.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 125.517 1.527 . . . . 0.0 113.877 178.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 46.4 t -67.35 -44.79 86.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 123.216 0.606 . . . . 0.0 110.456 174.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 53.0 mt -62.66 -36.17 82.0 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 118.588 0.631 . . . . 0.0 111.774 177.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 1.1 mmt -58.93 -52.16 66.94 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 122.765 0.426 . . . . 0.0 111.27 170.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -62.06 -38.82 90.21 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.459 0.703 . . . . 0.0 112.307 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -60.17 -47.48 85.75 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 119.227 0.921 . . . . 0.0 112.2 173.639 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -63.83 -44.56 92.84 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.437 0.695 . . . . 0.0 112.617 178.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 92.5 mt -65.91 -44.86 83.96 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.927 0.891 . . . . 0.0 112.135 176.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -63.26 -39.17 93.84 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 119.374 0.988 . . . . 0.0 112.615 -176.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -58.82 -40.86 85.39 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 121.381 -0.824 . . . . 0.0 112.107 175.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 85.0 mt -72.7 -41.78 62.29 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 123.624 0.77 . . . . 0.0 111.209 175.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -51.96 -51.39 57.42 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.891 0.768 . . . . 0.0 110.68 173.354 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 99.0 mt -62.58 -40.89 98.3 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.327 0.651 . . . . 0.0 112.665 177.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.73 -35.38 80.87 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 119.634 1.106 . . . . 0.0 112.729 176.498 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 71.0 mmtt -70.47 -52.87 19.0 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.748 1.219 . . . . 0.0 111.885 177.209 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 6.4 m -66.53 -24.12 32.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 CA-C-N 120.09 1.314 . . . . 0.0 112.313 179.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -64.79 -35.11 80.05 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.769 -0.582 . . . . 0.0 112.364 170.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -81.8 -16.72 50.01 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.372 1.069 . . . . 0.0 112.904 173.027 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 49.3 ttp -63.68 137.73 97.18 Favored Pre-proline 0 CA--C 1.546 0.818 0 CA-C-N 119.266 0.939 . . . . 0.0 110.937 174.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -68.48 136.23 35.98 Favored 'Trans proline' 0 CA--C 1.536 0.605 0 C-N-CA 122.786 2.324 . . . . 0.0 111.73 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -74.6 -22.95 58.68 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.216 1.006 . . . . 0.0 112.797 175.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -77.16 156.37 31.65 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.251 1.42 . . . . 0.0 111.783 173.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -126.58 135.78 51.69 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.377 1.471 . . . . 0.0 110.795 -174.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 12.7 p -148.22 140.32 18.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 C-N-CA 124.668 1.187 . . . . 0.0 110.946 174.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -70.15 132.32 45.62 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.5 1.12 . . . . 0.0 111.045 174.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 77.6 mt . . . . . 0 N--CA 1.471 0.599 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 -175.765 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.85 0 CA-C-O 122.252 0.918 . . . . 0.0 115.094 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 8.8 ptp180 -164.33 162.87 22.56 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 128.403 2.681 . . . . 0.0 108.724 173.566 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 50.5 tttt -73.51 124.38 25.75 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 168.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 62.6 p -122.26 165.76 15.7 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 125.043 1.337 . . . . 0.0 110.743 -176.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -50.33 -35.19 26.6 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.424 1.09 . . . . 0.0 113.589 171.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -70.76 -49.38 47.4 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 121.512 -0.743 . . . . 0.0 112.11 176.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.5 mt -64.2 -32.58 74.22 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 121.676 -0.64 . . . . 0.0 112.275 175.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 8.6 tp60 -60.51 -50.83 72.0 Favored 'General case' 0 C--O 1.223 -0.335 0 CA-C-O 118.47 -0.776 . . . . 0.0 110.434 170.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 60.9 t80 -56.83 -43.87 81.49 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.809 1.186 . . . . 0.0 112.269 177.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 93.3 mmm -55.08 -52.2 63.96 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 122.946 0.498 . . . . 0.0 112.083 172.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 -72.48 -30.95 64.99 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 -177.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -91.56 -25.87 19.01 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.429 1.492 . . . . 0.0 113.271 -168.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 34.3 t -128.4 -52.18 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 C-N-CA 123.224 0.61 . . . . 0.0 111.443 -176.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 16.3 t -69.85 -65.87 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 C-N-CA 123.624 0.769 . . . . 0.0 110.468 -171.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 48.8 t -54.21 -49.74 60.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 C-N-CA 125.624 1.57 . . . . 0.0 110.13 173.067 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -53.33 -52.65 58.5 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 118.824 -0.608 . . . . 0.0 111.63 -177.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 25.4 m -70.91 -40.16 72.32 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 118.576 0.625 . . . . 0.0 112.407 -178.429 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 62.7 mt -59.67 -29.59 68.16 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 118.682 0.674 . . . . 0.0 112.141 172.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . 0.465 ' CZ3' ' HE3' ' A' ' 87' ' ' LYS . 26.8 t-105 -79.83 -33.88 39.89 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.902 1.681 . . . . 0.0 114.234 179.209 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 15.4 ptmt -80.05 -9.51 59.7 Favored 'General case' 0 N--CA 1.483 1.193 0 CA-C-N 119.968 1.258 . . . . 0.0 114.166 174.587 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 50.1 t-80 -55.42 151.57 9.96 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.771 1.628 . . . . 0.0 113.519 177.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.62 -17.38 21.63 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.765 1.626 . . . . 0.0 114.442 176.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -125.85 17.04 8.01 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.48 1.512 . . . . 0.0 114.043 -173.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.32 -29.97 65.65 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 177.263 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . 0.409 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 41.5 p-90 -54.84 -36.98 50.77 Favored Pre-proline 0 CA--C 1.549 0.919 0 N-CA-C 117.543 2.423 . . . . 0.0 117.543 -171.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.409 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 73.1 Cg_endo -70.53 -3.03 11.69 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 CA-C-N 123.187 2.174 . . . . 0.0 114.7 173.136 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 -115.78 -3.25 12.24 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.345 1.458 . . . . 0.0 113.363 178.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -63.64 -27.45 69.24 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 119.511 1.051 . . . . 0.0 113.435 178.577 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -138.16 153.83 73.54 Favored Pre-proline 0 CA--C 1.542 0.652 0 C-N-CA 126.138 1.775 . . . . 0.0 110.003 -173.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -66.3 141.21 61.5 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 C-N-CA 122.416 2.077 . . . . 0.0 113.308 -175.316 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 54.5 t -57.08 136.23 20.28 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 124.716 1.206 . . . . 0.0 110.432 169.42 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -127.95 101.48 6.34 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 125.304 1.442 . . . . 0.0 109.983 178.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.0 -30.06 61.26 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.499 1.12 . . . . 0.0 113.924 -179.387 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 83.6 mt -67.77 -48.84 74.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 125.02 1.328 . . . . 0.0 111.109 175.085 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -66.21 -37.54 85.82 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.945 1.298 . . . . 0.0 112.96 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 72.3 mt -95.24 0.55 54.03 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.335 1.854 . . . . 0.0 113.103 -174.302 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 51.6 57.5 6.5 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.914 1.686 . . . . 0.0 113.036 -179.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 36.8 mt -113.92 78.24 4.06 Favored Pre-proline 0 CA--C 1.546 0.815 0 C-N-CA 126.042 1.737 . . . . 0.0 110.021 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -66.56 -7.34 17.62 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 124.387 3.392 . . . . 0.0 115.292 -169.421 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -130.71 17.79 5.22 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.942 1.697 . . . . 0.0 112.204 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 69.8 t80 -46.55 -54.61 9.03 Favored 'General case' 0 N--CA 1.476 0.849 0 O-C-N 120.997 -1.064 . . . . 0.0 113.486 -174.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -76.24 -8.88 58.03 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.013 1.325 . . . . 0.0 114.477 -179.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.1 mmmp? -77.86 -39.13 44.36 Favored 'General case' 0 N--CA 1.476 0.857 0 O-C-N 121.214 -0.929 . . . . 0.0 110.866 173.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.3 mp -82.61 -50.38 15.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 124.219 1.007 . . . . 0.0 110.565 174.026 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.593 HD11 ' HB2' ' A' ' 115' ' ' TYR . 34.4 mm -76.87 109.08 10.88 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.625 0 C-N-CA 123.642 0.777 . . . . 0.0 111.319 -178.257 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.22 -40.24 93.24 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.506 1.123 . . . . 0.0 112.464 171.364 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -154.44 106.18 2.39 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 125.98 1.712 . . . . 0.0 110.905 -172.677 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -76.71 163.26 31.81 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 123.6 2.867 . . . . 0.0 111.934 178.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.406 ' HE2' ' H ' ' A' ' 82' ' ' ASP . 0.0 OUTLIER -158.19 153.14 25.24 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.954 0.901 . . . . 0.0 111.981 175.025 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.406 ' H ' ' HE2' ' A' ' 81' ' ' MET . 10.8 m-20 -153.19 132.32 12.65 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 126.906 2.082 . . . . 0.0 110.566 -171.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 7.2 ttp -59.82 -36.2 76.29 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.254 1.022 . . . . 0.0 113.37 -172.032 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -58.15 -24.85 56.0 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 124.662 1.125 . . . . 0.0 114.503 175.06 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 91.2 m -94.25 -17.44 22.66 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.267 1.427 . . . . 0.0 112.524 178.158 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.5 mt -72.43 -52.86 21.51 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 O-C-N 120.803 -1.185 . . . . 0.0 110.302 170.577 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.465 ' HE3' ' CZ3' ' A' ' 51' ' ' TRP . 16.6 ptpt -57.8 -29.0 64.54 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -178.56 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 3.0 tppp? -66.8 -45.35 78.65 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.98 1.312 . . . . 0.0 112.697 -177.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 1.4 ptt180 -77.55 -27.7 51.62 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.169 0.987 . . . . 0.0 113.009 178.25 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 64.6 mt -60.98 -34.15 74.33 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 168.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -73.12 -38.85 66.17 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 118.864 0.756 . . . . 0.0 112.362 173.809 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -69.8 178.13 2.76 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 125.261 1.425 . . . . 0.0 112.896 171.071 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 41.5 p-10 -99.12 34.2 2.19 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.832 2.053 . . . . 0.0 111.936 174.284 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 65.5 t80 -63.87 -36.32 83.54 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.409 1.084 . . . . 0.0 113.696 -169.232 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -136.63 -177.99 4.98 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 128.184 2.594 . . . . 0.0 110.78 177.551 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 7.4 t-105 -115.0 -29.91 6.54 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.984 1.314 . . . . 0.0 112.464 -178.13 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 54.3 m -132.17 141.24 49.02 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.062 0.945 . . . . 0.0 112.665 -168.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -63.45 -16.63 61.15 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 115.943 1.831 . . . . 0.0 115.943 -173.52 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 14.7 m -55.32 -30.85 61.01 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.969 0.907 . . . . 0.0 112.989 175.012 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -65.49 -50.52 65.01 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 121.544 -0.723 . . . . 0.0 111.332 173.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 53.2 t -59.96 -37.74 80.44 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.25 1.02 . . . . 0.0 112.567 175.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 85.5 mtp -62.01 -42.68 99.42 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 121.184 -0.947 . . . . 0.0 112.393 173.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -64.95 -35.93 82.76 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 112.702 0.63 . . . . 0.0 112.702 173.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 55.8 m-20 -61.37 -48.02 83.17 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.487 1.039 . . . . 0.0 112.084 172.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -60.79 -43.71 97.76 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.622 -0.674 . . . . 0.0 112.767 174.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 18.1 t30 -55.2 -52.11 64.4 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.113 0.565 . . . . 0.0 111.526 173.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 96.5 m -61.01 -35.99 78.31 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.748 0.819 . . . . 0.0 112.737 177.546 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 27.7 ttp -61.3 -49.9 75.17 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 119.421 1.009 . . . . 0.0 112.554 176.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -70.9 -42.29 70.17 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 179.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 62.5 m -63.86 -46.76 83.54 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.764 0.825 . . . . 0.0 112.664 179.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -64.38 -33.78 76.65 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 119.852 1.206 . . . . 0.0 112.108 -179.296 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 19.2 m -59.15 -41.72 89.01 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.76 0.824 . . . . 0.0 112.989 169.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -68.73 -29.39 67.8 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 177.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 87.5 mt -69.12 -56.69 11.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 123.383 0.673 . . . . 0.0 110.986 176.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . 0.593 ' HB2' HD11 ' A' ' 77' ' ' ILE . 33.7 t80 -67.9 -31.51 71.34 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 114.577 1.325 . . . . 0.0 114.577 -173.167 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 60.8 m-80 -110.18 160.43 16.5 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.474 1.11 . . . . 0.0 112.053 -170.332 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 49.0 mmtm -72.18 152.14 92.46 Favored Pre-proline 0 N--CA 1.474 0.752 0 O-C-N 121.499 -0.75 . . . . 0.0 110.343 172.363 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -65.74 -1.24 4.68 Favored 'Trans proline' 0 CA--C 1.545 1.042 0 C-N-CA 123.676 2.917 . . . . 0.0 115.043 -177.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 67.7 p -119.01 -0.59 11.11 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.663 1.985 . . . . 0.0 113.126 -179.429 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -68.45 146.5 53.12 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 118.794 0.724 . . . . 0.0 110.68 170.344 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -55.39 -49.53 72.09 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 121.681 -0.637 . . . . 0.0 112.209 -175.562 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.5 tp -51.99 -31.12 13.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 125.232 1.413 . . . . 0.0 114.54 177.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 55.2 t -73.84 -48.96 37.23 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 O-C-N 121.541 -0.725 . . . . 0.0 110.719 174.174 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 77.2 mt -61.33 -37.4 83.14 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 119.124 0.875 . . . . 0.0 111.848 177.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 10.6 mtp -57.91 -52.62 64.72 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.869 1.668 . . . . 0.0 111.918 169.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.43 -39.23 90.02 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 113.04 0.755 . . . . 0.0 113.04 176.164 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . 0.428 ' O ' ' HE2' ' A' ' 131' ' ' LYS . 89.4 mt-30 -61.55 -47.79 83.96 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 119.312 0.96 . . . . 0.0 112.012 174.342 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.34 -40.44 96.38 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.698 -0.626 . . . . 0.0 112.514 177.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 82.6 mt -65.37 -44.73 86.7 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.436 0.694 . . . . 0.0 111.904 172.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -59.34 -48.09 82.95 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.343 0.974 . . . . 0.0 113.173 -175.093 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.428 ' HE2' ' O ' ' A' ' 127' ' ' GLN . 1.1 mppt? -60.45 -32.83 71.76 Favored 'General case' 0 CA--C 1.533 0.31 0 O-C-N 120.947 -1.096 . . . . 0.0 113.693 176.646 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 73.8 mt -76.18 -40.79 36.93 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 CA-C-N 118.803 0.729 . . . . 0.0 111.362 174.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -51.45 -51.61 53.47 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.383 -0.823 . . . . 0.0 109.965 170.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.3 mt -61.3 -43.18 99.3 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.507 0.723 . . . . 0.0 112.939 177.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -64.92 -31.58 72.88 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 120.056 1.298 . . . . 0.0 112.76 -178.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -76.14 -52.0 11.02 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.774 0.83 . . . . 0.0 112.191 175.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.3 m -65.61 -24.79 35.22 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 CA-C-N 120.338 1.426 . . . . 0.0 112.586 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -60.25 -30.69 69.59 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 112.889 0.699 . . . . 0.0 112.889 171.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 80.0 mt-30 -91.71 -9.17 44.75 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.752 1.221 . . . . 0.0 112.925 175.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 46.2 ttp -64.64 142.07 98.42 Favored Pre-proline 0 CA--C 1.549 0.918 0 O-C-N 121.282 -0.886 . . . . 0.0 110.807 173.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_exo -50.25 162.37 0.86 Allowed 'Trans proline' 0 CA--C 1.542 0.908 0 C-N-CA 123.787 2.991 . . . . 0.0 114.728 169.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 -93.65 -11.55 31.38 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.414 1.086 . . . . 0.0 113.53 172.321 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -124.18 163.2 22.05 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 127.097 2.159 . . . . 0.0 111.07 -175.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -124.93 162.42 24.48 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 114.973 1.471 . . . . 0.0 114.973 -177.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 65.3 t -138.48 135.28 43.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 125.999 1.72 . . . . 0.0 109.889 -176.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -65.38 121.38 14.72 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.338 1.455 . . . . 0.0 111.142 170.206 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 84.4 mt . . . . . 0 CA--C 1.538 0.517 0 CA-C-O 121.615 0.722 . . . . 0.0 112.4 177.324 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.12 0 CA-C-O 121.086 0.27 . . . . 0.0 112.855 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 33.1 ptt180 -154.91 156.84 36.83 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 126.026 1.73 . . . . 0.0 111.038 177.375 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.8 tttt -73.38 140.04 46.35 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.444 0.698 . . . . 0.0 110.758 170.107 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 70.0 p -142.13 168.3 20.08 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 126.373 1.869 . . . . 0.0 109.695 -177.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 24.9 p-10 -49.87 -32.87 15.42 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 169.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.3 mm-40 -67.59 -57.04 7.15 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.01 0.924 . . . . 0.0 111.351 178.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 89.6 mt -65.37 -33.32 75.67 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.527 -0.733 . . . . 0.0 112.689 178.167 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -58.45 -50.24 74.44 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.98 0.912 . . . . 0.0 111.318 170.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -59.6 -40.09 86.31 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.543 0.737 . . . . 0.0 112.603 177.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 90.4 mmm -56.38 -49.14 75.29 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 121.86 -0.525 . . . . 0.0 112.331 173.459 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -77.9 -18.38 56.22 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 114.772 1.397 . . . . 0.0 114.772 178.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 56.7 m-20 -102.96 -21.3 13.97 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 -171.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 59.0 t -131.84 -48.61 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 123.989 0.916 . . . . 0.0 111.645 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.4 t -72.31 -66.57 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 CA-C-N 118.863 0.756 . . . . 0.0 110.86 -170.423 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 89.8 t -58.76 -40.8 80.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 124.157 0.983 . . . . 0.0 110.362 172.338 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.5 tppp? -54.63 -47.64 73.21 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.892 0.877 . . . . 0.0 112.427 178.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 62.4 m -73.06 -44.33 60.78 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 122.923 0.489 . . . . 0.0 111.624 178.34 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 55.3 mt -62.86 -32.54 73.79 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.471 0.708 . . . . 0.0 112.426 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 18.0 t-105 -75.26 -30.09 60.36 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.319 1.447 . . . . 0.0 113.192 174.164 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 54.2 mtmt -79.03 -9.14 59.45 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.514 0.931 . . . . 0.0 113.514 175.105 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 35.6 t-80 -62.89 154.53 29.88 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.754 1.222 . . . . 0.0 113.494 -178.106 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -58.11 -24.48 58.86 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.475 1.51 . . . . 0.0 113.815 174.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -123.36 22.23 9.34 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.158 1.383 . . . . 0.0 113.657 -172.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.57 -26.08 63.38 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.725 1.21 . . . . 0.0 113.843 173.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 64.6 p-90 -59.14 -33.9 20.02 Favored Pre-proline 0 CA--C 1.546 0.804 0 N-CA-C 117.735 2.494 . . . . 0.0 117.735 -170.155 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -73.84 -2.61 12.48 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 CA-C-N 123.216 2.184 . . . . 0.0 113.781 173.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -115.75 -2.11 12.49 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.547 1.539 . . . . 0.0 113.474 179.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -63.06 -24.99 68.17 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 120.913 -1.117 . . . . 0.0 113.565 177.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -139.69 153.94 70.62 Favored Pre-proline 0 CA--C 1.543 0.681 0 C-N-CA 126.134 1.774 . . . . 0.0 110.377 -174.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -66.28 142.02 64.94 Favored 'Trans proline' 0 CA--C 1.537 0.652 0 C-N-CA 122.774 2.316 . . . . 0.0 112.569 179.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 49.5 t -59.13 142.31 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 124.452 1.101 . . . . 0.0 111.491 171.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -120.52 95.65 4.81 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.482 1.513 . . . . 0.0 109.536 171.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.25 -27.31 45.55 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.653 1.181 . . . . 0.0 113.877 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 77.9 mt -63.44 -53.46 45.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 124.437 1.095 . . . . 0.0 110.59 173.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 4.3 mptp? -66.16 -35.76 81.33 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.401 1.48 . . . . 0.0 112.707 -179.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 47.1 mt -81.08 -3.3 51.5 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 114.039 1.125 . . . . 0.0 114.039 174.318 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 62.7 t30 54.56 52.93 11.44 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.937 1.695 . . . . 0.0 113.677 -178.318 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 45.9 mt -115.47 80.61 8.02 Favored Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 126.644 1.978 . . . . 0.0 110.431 -177.06 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -67.47 -10.42 28.66 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 123.806 3.004 . . . . 0.0 113.917 -175.372 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -126.05 22.41 7.31 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.153 1.781 . . . . 0.0 112.397 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 71.6 t80 -51.04 -57.81 7.69 Favored 'General case' 0 N--CA 1.474 0.741 0 O-C-N 120.844 -1.16 . . . . 0.0 112.476 177.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -74.02 -12.7 60.7 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.973 1.309 . . . . 0.0 114.499 -178.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -71.61 -32.97 68.57 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.053 0.941 . . . . 0.0 111.645 177.725 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.9 mp -103.01 -43.51 9.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 125.82 1.648 . . . . 0.0 111.667 -178.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 22.6 mm -61.17 114.82 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 124.231 1.013 . . . . 0.0 110.244 173.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -63.41 -46.1 87.96 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.452 1.101 . . . . 0.0 111.756 179.011 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -156.19 127.94 3.85 Favored Pre-proline 0 CA--C 1.545 0.757 0 C-N-CA 125.606 1.562 . . . . 0.0 110.847 169.389 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -76.45 155.48 36.33 Favored 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 123.564 2.842 . . . . 0.0 112.232 -177.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 33.5 tpp -163.12 140.94 7.9 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.629 1.571 . . . . 0.0 110.115 174.479 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 25.8 m-20 -139.12 134.97 33.59 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 126.574 1.949 . . . . 0.0 108.42 169.375 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.5 ttp -46.96 -30.86 2.8 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 127.348 2.259 . . . . 0.0 116.24 -168.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.3 -30.41 40.13 Favored Glycine 0 CA--C 1.54 1.631 0 CA-C-N 119.08 0.854 . . . . 0.0 114.141 172.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 2.2 m -70.89 -35.63 72.41 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 125.259 1.424 . . . . 0.0 112.363 175.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 46.6 mt -67.94 -52.25 41.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.552 1.141 . . . . 0.0 110.008 -176.106 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.49 -40.12 77.94 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 174.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 3.2 tppp? -59.83 -39.85 86.48 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.014 0.926 . . . . 0.0 112.797 179.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 1.5 ptm180 -87.24 -28.35 22.4 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 39.6 mt -61.85 -34.88 76.77 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.127 0.971 . . . . 0.0 112.833 167.052 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -74.31 9.59 1.61 Allowed 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 124.962 1.305 . . . . 0.0 113.758 174.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 46.0 m-80 -129.29 161.02 31.19 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 127.36 2.264 . . . . 0.0 110.015 173.34 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 10.3 p-10 -78.34 36.89 0.25 Allowed 'General case' 0 CA--C 1.551 1.006 0 O-C-N 120.767 -1.208 . . . . 0.0 112.177 169.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -62.6 -34.18 76.47 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.073 1.349 . . . . 0.0 113.235 -169.604 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -134.54 -179.38 5.55 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 127.089 2.156 . . . . 0.0 111.296 174.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 4.3 t-105 -110.97 -26.24 9.38 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.217 1.407 . . . . 0.0 112.789 -177.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 62.1 m -134.29 143.74 47.92 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.664 1.186 . . . . 0.0 112.632 -170.091 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -65.3 -16.18 63.3 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 115.232 1.567 . . . . 0.0 115.232 -177.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 11.4 p -51.83 -36.21 47.3 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.497 1.119 . . . . 0.0 113.476 172.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -69.65 -42.0 74.82 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.764 0.825 . . . . 0.0 112.227 176.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 49.4 t -64.81 -35.33 80.75 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.162 0.985 . . . . 0.0 112.459 172.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 89.4 mtp -66.84 -42.32 85.96 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 121.323 -0.861 . . . . 0.0 111.817 173.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -63.73 -29.62 70.81 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 173.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -66.81 -45.95 76.73 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 119.341 0.973 . . . . 0.0 112.301 171.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -63.37 -41.28 98.8 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 121.322 -0.861 . . . . 0.0 112.687 173.091 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 22.7 t30 -57.66 -46.15 84.6 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.831 -0.543 . . . . 0.0 111.578 172.202 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 81.4 m -56.02 -49.82 72.61 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.19 0.996 . . . . 0.0 111.417 175.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 27.3 ttm -56.72 -61.29 2.53 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.224 1.01 . . . . 0.0 112.313 179.255 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -63.16 -40.79 98.56 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -175.107 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 66.5 m -66.72 -45.79 77.55 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.442 -0.786 . . . . 0.0 112.167 176.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -63.19 -30.84 71.91 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 120.102 1.319 . . . . 0.0 112.586 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 82.7 m -60.58 -45.17 94.92 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.266 1.026 . . . . 0.0 112.217 170.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -69.71 -29.56 66.99 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 179.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 88.6 mt -71.21 -55.83 12.56 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 CA-C-N 118.41 0.55 . . . . 0.0 110.126 178.027 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -71.3 -30.45 66.26 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 114.567 1.321 . . . . 0.0 114.567 -172.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 44.4 m-80 -113.61 158.25 21.06 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.012 0.925 . . . . 0.0 112.654 -171.011 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -66.16 147.89 98.66 Favored Pre-proline 0 N--CA 1.472 0.672 0 C-N-CA 124.61 1.164 . . . . 0.0 110.834 176.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -65.72 -6.94 15.06 Favored 'Trans proline' 0 CA--C 1.543 0.954 0 C-N-CA 123.828 3.019 . . . . 0.0 114.973 -175.161 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 70.7 p -116.46 1.18 12.93 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 126.265 1.826 . . . . 0.0 113.096 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -67.53 146.04 54.33 Favored 'General case' 0 CA--C 1.541 0.633 0 O-C-N 121.451 -0.781 . . . . 0.0 110.941 174.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -51.97 -46.25 64.74 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.7 0.8 . . . . 0.0 112.808 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 9.6 tp -57.43 -34.56 46.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 124.488 1.115 . . . . 0.0 113.747 179.39 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 45.4 t -69.95 -43.55 79.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 123.428 0.691 . . . . 0.0 110.67 174.203 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 69.5 mt -63.25 -35.8 81.53 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 119.003 0.819 . . . . 0.0 111.94 176.416 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -57.79 -53.4 58.62 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 118.26 0.482 . . . . 0.0 110.738 170.381 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.87 -39.99 91.26 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.483 0.713 . . . . 0.0 112.611 179.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -60.72 -50.12 74.77 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.07 0.85 . . . . 0.0 112.036 174.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.87 -41.33 99.36 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.427 0.691 . . . . 0.0 112.41 -179.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 85.4 mt -65.48 -45.74 82.47 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.635 0.774 . . . . 0.0 111.848 173.472 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -60.37 -43.24 96.74 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.566 1.075 . . . . 0.0 113.165 -176.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 66.1 mttt -58.23 -38.24 76.46 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.53 0.732 . . . . 0.0 111.857 178.104 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 70.1 mt -78.16 -41.62 26.84 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 123.406 0.682 . . . . 0.0 111.729 176.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 29.2 t80 -50.42 -51.57 45.26 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 119.131 0.878 . . . . 0.0 110.413 172.448 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 99.4 mt -62.04 -42.48 99.22 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.891 0.7 . . . . 0.0 112.891 178.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -67.89 -30.65 70.05 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 120.009 1.277 . . . . 0.0 112.755 179.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 69.2 mmtt -75.52 -48.39 22.76 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 117.616 -1.183 . . . . 0.0 112.435 175.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.7 m -68.43 -25.98 32.51 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 CA-C-N 121.094 1.77 . . . . 0.0 112.362 177.253 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -59.85 -31.12 69.46 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.748 -0.595 . . . . 0.0 112.431 171.394 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 21.6 mm100 -89.97 -5.85 56.26 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.125 1.37 . . . . 0.0 113.027 176.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 40.8 ttp -63.43 137.26 97.03 Favored Pre-proline 0 CA--C 1.546 0.819 0 C-N-CA 123.802 0.841 . . . . 0.0 110.418 171.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_endo -61.63 148.7 92.42 Favored 'Trans proline' 0 CA--C 1.534 0.514 0 C-N-CA 122.601 2.201 . . . . 0.0 111.023 174.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 -92.09 -13.46 30.77 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -174.487 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 9.5 mp0 -100.01 150.54 22.33 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 126.184 1.794 . . . . 0.0 111.862 176.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -98.84 140.93 32.28 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.04 1.336 . . . . 0.0 110.315 177.237 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 8.5 p -146.29 138.04 19.34 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 CA-C-O 122.299 1.047 . . . . 0.0 111.162 169.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -65.51 131.84 47.39 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.452 1.901 . . . . 0.0 111.64 176.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 98.6 mt . . . . . 0 N--CA 1.471 0.6 0 N-CA-C 114.068 1.136 . . . . 0.0 114.068 -177.095 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.394 0 N-CA-C 111.766 -0.533 . . . . 0.0 111.766 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 34.6 ptt180 -153.02 152.57 31.52 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.471 1.508 . . . . 0.0 110.675 172.169 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 74.0 tttt -71.75 139.24 48.99 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.362 0.665 . . . . 0.0 110.4 169.531 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 61.9 p -140.41 168.56 19.52 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.864 1.666 . . . . 0.0 110.421 -176.468 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 26.2 p-10 -48.94 -37.36 19.75 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 114.29 1.219 . . . . 0.0 114.29 172.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -72.11 -46.17 57.7 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 121.521 -0.737 . . . . 0.0 111.767 178.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 79.4 mt -65.44 -32.62 74.34 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 121.805 -0.559 . . . . 0.0 112.222 175.097 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 44.3 tt0 -59.6 -52.48 65.36 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 123.292 0.637 . . . . 0.0 109.863 168.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -56.4 -41.38 76.2 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.503 0.721 . . . . 0.0 112.516 179.179 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 89.9 mmm -57.15 -56.03 27.08 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 118.303 0.502 . . . . 0.0 112.017 171.496 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.2 pt20 -77.46 -11.53 59.86 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.952 1.464 . . . . 0.0 114.952 -175.243 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -115.48 -21.14 9.92 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.771 1.228 . . . . 0.0 113.334 -169.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 16.0 t -129.2 -51.4 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 C-N-CA 123.225 0.61 . . . . 0.0 111.229 -179.243 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.5 t -68.04 -63.01 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 123.246 0.618 . . . . 0.0 110.469 -176.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 69.0 t -57.79 -48.36 83.86 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 124.518 1.127 . . . . 0.0 110.523 174.429 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm -58.22 -44.34 88.16 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 118.482 0.583 . . . . 0.0 112.24 -175.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 40.5 m -71.01 -43.05 68.75 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 177.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 75.7 mt -63.16 -33.83 76.31 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.291 0.636 . . . . 0.0 112.355 176.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . 0.464 ' CZ3' ' HE3' ' A' ' 87' ' ' LYS . 19.3 t-105 -70.75 -28.33 64.61 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.741 1.616 . . . . 0.0 113.353 175.056 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.4 mtmp? -83.92 -4.13 58.47 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.291 1.036 . . . . 0.0 113.533 176.122 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 36.1 t-80 -65.99 158.91 27.01 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.902 1.281 . . . . 0.0 113.301 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -58.84 -24.53 62.15 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.518 1.527 . . . . 0.0 113.88 175.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 -125.4 22.1 7.79 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.802 1.241 . . . . 0.0 114.057 -171.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.72 -28.27 65.68 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 176.211 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . 0.427 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 45.0 p-90 -56.69 -37.6 59.41 Favored Pre-proline 0 CA--C 1.547 0.855 0 N-CA-C 117.324 2.342 . . . . 0.0 117.324 -170.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.427 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 64.0 Cg_endo -70.22 -5.53 16.72 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 CA-C-N 123.042 2.122 . . . . 0.0 114.592 172.325 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 80.7 m-85 -113.19 -1.06 14.45 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.345 1.458 . . . . 0.0 113.302 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -64.02 -17.83 63.72 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 113.914 1.079 . . . . 0.0 113.914 175.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 -142.88 157.06 62.01 Favored Pre-proline 0 CA--C 1.546 0.797 0 C-N-CA 125.958 1.703 . . . . 0.0 111.047 -172.311 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -65.42 152.48 81.85 Favored 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 122.998 2.465 . . . . 0.0 112.34 173.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 36.5 t -71.85 144.75 12.92 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 124.485 1.114 . . . . 0.0 110.56 177.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -128.97 97.07 4.52 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.197 1.399 . . . . 0.0 110.604 178.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.0 -28.46 57.35 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.563 1.145 . . . . 0.0 113.858 178.607 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 82.6 mt -66.72 -49.34 75.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 125.071 1.348 . . . . 0.0 111.021 174.614 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 9.6 mtpm? -67.75 -37.73 82.54 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.636 1.174 . . . . 0.0 112.745 -179.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 85.0 mt -90.63 -1.2 57.88 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.952 1.701 . . . . 0.0 113.513 -177.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 51.96 57.43 6.51 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 125.754 1.622 . . . . 0.0 113.296 -178.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 53.9 mt -113.6 83.59 7.25 Favored Pre-proline 0 CA--C 1.547 0.854 0 C-N-CA 125.9 1.68 . . . . 0.0 110.655 -177.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -67.66 -11.6 32.68 Favored 'Trans proline' 0 CA--C 1.541 0.858 0 C-N-CA 123.975 3.117 . . . . 0.0 114.61 -170.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.432 ' HA ' ' HE3' ' A' ' 75' ' ' LYS . 40.9 m-20 -125.8 21.53 7.61 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.416 1.486 . . . . 0.0 113.048 177.878 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -48.28 -55.39 10.7 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 121.212 -0.93 . . . . 0.0 113.009 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -77.39 -16.25 58.94 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 114.672 1.36 . . . . 0.0 114.672 -177.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.432 ' HE3' ' HA ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -68.66 -39.64 80.54 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.141 -0.975 . . . . 0.0 111.714 172.656 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.3 mp -88.65 -46.2 15.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 124.35 1.06 . . . . 0.0 111.189 175.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.574 HD11 ' HB2' ' A' ' 115' ' ' TYR . 32.3 mm -80.34 104.51 8.78 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-O 121.685 0.755 . . . . 0.0 111.189 178.514 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -69.34 -36.65 77.11 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.84 1.256 . . . . 0.0 112.578 174.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -146.35 103.46 4.04 Favored Pre-proline 0 CA--C 1.547 0.83 0 C-N-CA 125.69 1.596 . . . . 0.0 110.686 -178.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -76.32 149.17 31.16 Favored 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 123.403 2.735 . . . . 0.0 111.232 174.191 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 6.8 tpt -157.83 148.66 21.02 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.726 1.211 . . . . 0.0 111.105 177.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -150.56 154.85 38.33 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.771 1.628 . . . . 0.0 111.533 -178.644 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 4.5 ttp -64.07 -33.23 75.28 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.911 0.885 . . . . 0.0 113.369 -174.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.67 -44.97 97.26 Favored Glycine 0 CA--C 1.532 1.138 0 C-N-CA 124.697 1.141 . . . . 0.0 112.899 173.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 57.7 m -68.56 -39.78 80.91 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 121.789 -0.83 . . . . 0.0 111.827 172.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 95.3 mt -55.56 -53.23 38.82 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 CA-C-N 120.104 1.32 . . . . 0.0 111.22 176.119 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.464 ' HE3' ' CZ3' ' A' ' 51' ' ' TRP . 16.3 ptpt -59.74 -30.52 68.89 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 177.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm -66.83 -44.9 79.91 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.814 0.846 . . . . 0.0 112.867 177.037 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 6.9 ptp180 -75.17 -19.6 59.77 Favored 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 172.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 46.3 mt -70.76 -51.55 26.41 Favored 'General case' 0 CA--C 1.543 0.673 0 CA-C-N 119.152 0.887 . . . . 0.0 111.328 167.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -71.46 -41.53 69.29 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 113.461 0.912 . . . . 0.0 113.461 -176.315 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -86.34 110.75 19.89 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 169.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 46.2 t30 -48.79 115.63 1.33 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.54 1.136 . . . . 0.0 112.915 -175.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 54.7 t80 -137.0 -26.76 1.02 Allowed 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 114.365 1.246 . . . . 0.0 114.365 -172.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -138.56 170.79 15.38 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.801 1.24 . . . . 0.0 112.708 178.196 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 8.8 t-105 -99.92 -21.45 15.67 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.136 1.375 . . . . 0.0 112.657 -176.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.7 p -141.42 148.29 39.32 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.452 1.501 . . . . 0.0 113.105 -169.53 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -72.19 -17.18 61.95 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 115.221 1.563 . . . . 0.0 115.221 -176.359 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 5.7 p -52.88 -37.03 60.02 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.033 0.933 . . . . 0.0 113.004 174.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -67.45 -43.72 80.4 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.705 -0.622 . . . . 0.0 112.474 178.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 45.4 t -60.17 -40.77 91.1 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.119 0.968 . . . . 0.0 112.617 170.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 83.9 mtp -62.35 -42.61 99.53 Favored 'General case' 0 N--CA 1.473 0.679 0 O-C-N 121.303 -0.873 . . . . 0.0 112.579 176.136 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 58.0 mm-40 -66.45 -32.99 74.7 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 173.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -66.46 -41.27 89.33 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 120.736 -1.227 . . . . 0.0 111.922 171.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -60.67 -45.49 93.95 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.264 -0.898 . . . . 0.0 112.47 170.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.91 -42.62 94.3 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.434 -0.791 . . . . 0.0 110.924 173.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 88.0 m -60.26 -40.23 89.59 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.976 0.91 . . . . 0.0 111.883 178.312 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 17.2 ttm -57.31 -59.61 4.87 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 119.001 0.819 . . . . 0.0 111.534 173.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -64.17 -43.46 95.08 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -176.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 97.5 m -63.71 -47.44 81.13 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.973 0.909 . . . . 0.0 112.054 179.025 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -64.2 -34.25 77.66 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-N 119.711 1.142 . . . . 0.0 112.224 -179.079 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 24.6 m -58.4 -43.8 88.71 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 113.232 0.827 . . . . 0.0 113.232 170.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 14.9 m-85 -68.45 -29.1 67.67 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.861 1.06 . . . . 0.0 113.861 178.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 86.8 mt -70.08 -56.57 10.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 123.27 0.628 . . . . 0.0 110.647 176.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . 0.574 ' HB2' HD11 ' A' ' 77' ' ' ILE . 33.7 t80 -69.33 -35.3 75.78 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 114.371 1.248 . . . . 0.0 114.371 -173.572 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 55.6 m-80 -105.58 154.96 19.68 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.25 1.02 . . . . 0.0 111.535 -172.423 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 53.3 mttm -68.3 151.58 97.12 Favored Pre-proline 0 N--CA 1.471 0.577 0 C-N-CA 123.988 0.915 . . . . 0.0 111.037 175.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -65.24 -1.03 3.97 Favored 'Trans proline' 0 CA--C 1.547 1.168 0 C-N-CA 123.601 2.868 . . . . 0.0 114.763 -179.238 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 52.0 p -117.67 -2.41 11.43 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 127.123 2.169 . . . . 0.0 113.151 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 -69.31 144.38 53.55 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 118.966 0.803 . . . . 0.0 110.648 171.106 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -56.29 -46.27 79.83 Favored 'General case' 0 N--CA 1.471 0.616 0 O-C-N 121.649 -0.657 . . . . 0.0 112.514 -175.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.4 tp -54.42 -30.29 21.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 125.118 1.367 . . . . 0.0 114.209 177.6 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 45.5 t -72.81 -47.18 50.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 O-C-N 121.422 -0.798 . . . . 0.0 110.555 174.015 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 71.8 mt -61.46 -37.08 82.27 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 118.93 0.786 . . . . 0.0 111.599 176.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 7.7 mtt -59.01 -51.91 68.01 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.921 1.288 . . . . 0.0 111.971 169.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.28 -39.65 87.63 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.353 0.661 . . . . 0.0 112.72 176.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 89.3 mt-30 -62.41 -45.36 93.45 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 119.24 0.927 . . . . 0.0 111.902 174.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -67.41 -29.69 69.26 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.246 1.018 . . . . 0.0 113.615 179.149 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 81.5 mt -76.14 -48.52 20.3 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.832 0.853 . . . . 0.0 111.49 169.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -62.05 -37.81 86.39 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 113.376 0.88 . . . . 0.0 113.376 -173.546 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 59.5 pttt -58.9 -44.21 91.15 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 121.593 -0.692 . . . . 0.0 111.679 176.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 65.9 mt -70.99 -39.97 75.71 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 124.413 1.085 . . . . 0.0 110.91 176.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -51.11 -49.5 60.64 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.903 1.229 . . . . 0.0 110.808 171.43 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.7 mt -63.9 -39.68 94.75 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 176.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -57.3 -41.09 79.17 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-N 119.688 1.131 . . . . 0.0 112.652 172.184 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 36.7 mmtm -75.69 -48.83 20.32 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.961 1.304 . . . . 0.0 111.786 -175.309 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.8 m -68.78 -25.96 31.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 CA-C-N 120.121 1.328 . . . . 0.0 112.218 176.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -61.59 -28.3 69.25 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 121.495 -0.753 . . . . 0.0 112.449 171.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -96.51 1.73 51.73 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.399 1.48 . . . . 0.0 112.687 177.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 8.9 ttm -54.28 141.53 51.71 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 124.951 1.3 . . . . 0.0 112.482 174.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -67.6 114.84 3.44 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 123.076 2.517 . . . . 0.0 109.233 168.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -71.44 -20.58 62.08 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 -169.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -84.41 160.24 20.65 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.74 1.616 . . . . 0.0 112.056 177.149 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -116.43 133.07 56.44 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.116 1.367 . . . . 0.0 110.986 178.04 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 13.0 p -149.28 142.94 18.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 C-N-CA 124.848 1.259 . . . . 0.0 111.286 173.027 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -70.77 137.75 49.86 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.656 1.182 . . . . 0.0 111.636 176.066 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 95.9 mt . . . . . 0 N--CA 1.47 0.553 0 N-CA-C 114.058 1.133 . . . . 0.0 114.058 -175.854 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.207 0 N-CA-C 111.753 -0.539 . . . . 0.0 111.753 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 34.9 ptt180 -162.83 161.2 25.92 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.918 1.687 . . . . 0.0 110.693 179.317 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.589 ' HB3' HD12 ' A' ' 147' ' ' LEU . 46.6 mttp -76.93 141.23 40.57 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 121.398 0.618 . . . . 0.0 110.425 167.516 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 81.0 p -141.04 164.16 31.02 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 125.585 1.554 . . . . 0.0 110.004 176.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -52.68 -30.97 34.82 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 170.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.4 mm-40 -67.9 -54.74 16.45 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.884 0.874 . . . . 0.0 111.188 177.144 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.3 mt -65.03 -32.88 74.82 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 121.489 -0.757 . . . . 0.0 112.52 176.326 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.515 ' HB2' HD11 ' A' ' 147' ' ' LEU . 53.4 tt0 -57.16 -52.81 63.8 Favored 'General case' 0 C--O 1.224 -0.26 0 C-N-CA 123.977 0.911 . . . . 0.0 110.92 170.065 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -60.21 -41.18 92.49 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.453 0.701 . . . . 0.0 112.596 179.197 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 93.9 mmm -55.85 -48.35 75.67 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 121.747 -0.595 . . . . 0.0 111.794 171.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -86.42 -5.57 59.13 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 115.114 1.524 . . . . 0.0 115.114 -175.739 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 30.6 m-20 -117.0 -18.36 10.12 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 125.157 1.383 . . . . 0.0 113.481 -176.117 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 46.9 t -133.85 -50.66 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 123.934 0.894 . . . . 0.0 111.686 179.602 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.0 t -71.54 -67.48 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-N 119.407 1.003 . . . . 0.0 110.802 -171.468 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 59.1 t -57.61 -41.85 80.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 123.655 0.782 . . . . 0.0 109.965 171.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.74 -45.02 86.44 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 118.87 0.759 . . . . 0.0 113.005 -177.604 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 62.4 m -71.76 -44.46 64.0 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 122.925 0.49 . . . . 0.0 111.364 176.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 66.6 mt -62.0 -32.49 72.97 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.572 0.749 . . . . 0.0 112.277 178.145 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 16.9 t-105 -73.17 -29.53 62.92 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.022 1.729 . . . . 0.0 112.955 176.066 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 56.5 mtmt -84.25 -5.28 59.24 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.256 1.022 . . . . 0.0 113.462 176.568 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 37.3 t-80 -65.02 156.18 32.23 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.695 1.198 . . . . 0.0 113.564 -178.439 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 18.4 tp60 -58.74 -20.82 52.62 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.604 1.562 . . . . 0.0 114.057 174.49 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -125.12 19.97 8.26 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.399 1.479 . . . . 0.0 113.791 -174.44 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.3 -30.01 65.73 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 177.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . 0.446 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 39.4 p-90 -54.57 -37.84 59.34 Favored Pre-proline 0 CA--C 1.547 0.863 0 N-CA-C 117.094 2.257 . . . . 0.0 117.094 -172.517 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.446 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 56.9 Cg_endo -67.99 -7.28 19.29 Favored 'Trans proline' 0 C--N 1.354 0.866 0 CA-C-N 122.959 2.092 . . . . 0.0 115.012 172.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 72.7 m-85 -114.5 -1.45 13.43 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.132 1.373 . . . . 0.0 113.284 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 20.1 m-30 -65.18 -22.53 66.92 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 113.458 0.91 . . . . 0.0 113.458 176.212 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -138.4 155.46 73.89 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 126.515 1.926 . . . . 0.0 110.005 -176.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -67.24 147.63 78.95 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 122.571 2.18 . . . . 0.0 112.4 178.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 76.6 t -59.75 142.34 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 123.903 0.881 . . . . 0.0 111.258 170.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -122.97 101.24 7.31 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 125.689 1.596 . . . . 0.0 109.497 171.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.27 -27.23 61.91 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 -179.26 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 84.3 mt -64.81 -49.61 79.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 124.855 1.262 . . . . 0.0 110.846 172.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -68.36 -42.31 79.37 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.97 1.308 . . . . 0.0 112.788 -178.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.4 mp -80.74 -4.32 54.04 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.358 1.063 . . . . 0.0 113.329 176.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 61.7 t30 55.02 56.28 6.76 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 126.266 1.826 . . . . 0.0 113.501 -179.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 51.5 mt -115.28 84.05 11.04 Favored Pre-proline 0 CA--C 1.545 0.77 0 C-N-CA 126.312 1.845 . . . . 0.0 110.741 -175.436 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -68.3 -3.88 11.71 Favored 'Trans proline' 0 CA--C 1.544 1.009 0 C-N-CA 123.945 3.097 . . . . 0.0 114.633 -174.368 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -131.24 14.78 5.11 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 126.051 1.74 . . . . 0.0 112.528 -178.681 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 40.9 t80 -51.13 -55.05 19.75 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 120.729 -1.232 . . . . 0.0 113.364 -173.212 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -79.44 -9.44 59.6 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.346 1.059 . . . . 0.0 113.854 178.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -70.65 -47.27 60.88 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.006 0.922 . . . . 0.0 110.337 177.325 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.9 mp -77.11 -50.39 20.85 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 C-N-CA 124.137 0.975 . . . . 0.0 109.84 172.096 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 40.9 mm -91.4 103.04 14.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 CA-C-O 122.48 1.134 . . . . 0.0 112.097 -171.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt -68.06 -32.26 72.48 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.936 1.694 . . . . 0.0 113.487 179.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -147.59 91.67 4.94 Favored Pre-proline 0 CA--C 1.545 0.761 0 C-N-CA 125.715 1.606 . . . . 0.0 110.209 -178.044 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -78.76 159.61 27.97 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 123.499 2.799 . . . . 0.0 111.356 174.522 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 40.8 mmm -147.05 160.87 41.88 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.522 1.129 . . . . 0.0 112.751 168.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -146.81 146.79 30.36 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 127.099 2.159 . . . . 0.0 110.228 175.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.2 ttp -61.84 -35.19 77.55 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.163 0.985 . . . . 0.0 113.63 -170.362 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -57.87 -42.4 94.65 Favored Glycine 0 CA--C 1.531 1.075 0 C-N-CA 123.831 0.729 . . . . 0.0 113.219 177.448 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 19.7 m -67.13 -41.58 85.9 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.826 0.85 . . . . 0.0 111.602 176.147 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 95.0 mt -60.02 -52.06 65.58 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 124.257 1.023 . . . . 0.0 110.493 177.444 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 25.2 ttpp -57.75 -37.4 73.56 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 125.417 1.487 . . . . 0.0 112.888 176.391 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 34.0 ttmt -62.69 -41.88 99.34 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 113.458 0.91 . . . . 0.0 113.458 178.613 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -74.03 -27.09 60.77 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 114.537 1.31 . . . . 0.0 114.537 172.777 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 62.5 mt -61.8 -48.62 79.78 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 118.675 0.67 . . . . 0.0 111.29 168.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -59.29 -42.01 90.28 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.054 0.942 . . . . 0.0 111.977 176.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 -83.51 2.56 36.34 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 125.086 1.354 . . . . 0.0 113.987 179.371 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 34.86 56.72 0.74 Allowed 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 127.579 2.352 . . . . 0.0 115.091 -171.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 71.2 t80 -58.83 -24.37 61.91 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 127.358 2.263 . . . . 0.0 114.948 -176.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -133.22 -175.48 3.81 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 129.043 2.937 . . . . 0.0 111.568 -169.852 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 14.4 t-105 -110.45 -27.45 9.01 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.382 1.073 . . . . 0.0 113.142 -171.511 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 16.9 m -145.95 151.69 38.22 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.724 1.21 . . . . 0.0 112.703 -171.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -66.0 -21.23 66.39 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 116.502 2.038 . . . . 0.0 116.502 -172.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 47.0 t -53.85 -36.7 62.88 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 119.282 0.946 . . . . 0.0 112.552 178.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -65.86 -44.78 84.39 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 121.088 -1.008 . . . . 0.0 112.015 179.087 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 53.1 t -57.92 -41.91 83.68 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.088 0.955 . . . . 0.0 112.37 171.123 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 79.9 mtp -61.86 -40.33 94.99 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.999 0.92 . . . . 0.0 112.975 175.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 65.0 mt-30 -62.57 -37.32 85.72 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.093 0.957 . . . . 0.0 112.682 175.269 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -71.96 -33.91 68.55 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.0 -1.063 . . . . 0.0 113.281 174.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -64.25 -45.0 90.07 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 119.346 0.975 . . . . 0.0 112.212 169.538 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 24.1 t30 -56.27 -42.12 76.95 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.866 -0.521 . . . . 0.0 111.534 171.502 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 60.4 m -64.98 -39.57 93.68 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.128 0.971 . . . . 0.0 112.491 176.357 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 21.1 ttm -58.98 -61.09 2.9 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.941 0.897 . . . . 0.0 111.352 174.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -62.91 -39.79 95.63 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 -176.351 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 90.5 m -65.11 -47.33 77.53 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.195 0.598 . . . . 0.0 112.07 178.424 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -64.71 -32.53 74.25 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 119.615 1.098 . . . . 0.0 112.549 -179.227 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 55.9 m -59.8 -45.15 93.2 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.717 0.807 . . . . 0.0 112.543 169.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 14.3 m-85 -67.84 -32.55 73.15 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 177.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 85.6 mt -69.41 -58.19 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 123.576 0.75 . . . . 0.0 111.05 176.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 43.2 t80 -68.31 -34.61 76.45 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 114.246 1.202 . . . . 0.0 114.246 -170.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 60.5 m-80 -101.03 164.7 11.68 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.51 1.124 . . . . 0.0 111.987 -173.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -72.61 150.84 91.32 Favored Pre-proline 0 N--CA 1.476 0.836 0 O-C-N 121.368 -0.833 . . . . 0.0 109.921 170.25 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -66.08 -1.65 5.62 Favored 'Trans proline' 0 CA--C 1.546 1.108 0 C-N-CA 123.393 2.728 . . . . 0.0 114.68 -178.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 50.7 p -118.24 -1.34 11.35 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.994 2.118 . . . . 0.0 113.113 -179.056 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 54.4 m-20 -67.46 145.9 54.53 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.535 -0.728 . . . . 0.0 110.822 170.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -56.22 -46.69 79.4 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.619 -0.675 . . . . 0.0 112.406 -176.068 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.5 tp -54.73 -29.13 20.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 125.227 1.411 . . . . 0.0 114.442 177.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 38.6 t -73.17 -45.57 53.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 O-C-N 121.281 -0.887 . . . . 0.0 110.517 173.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 73.5 mt -63.31 -36.87 85.12 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 118.977 0.808 . . . . 0.0 111.405 176.689 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 7.6 mtt -59.17 -52.11 67.12 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.019 1.328 . . . . 0.0 111.648 169.541 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.54 -38.8 85.64 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.483 0.713 . . . . 0.0 112.707 176.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -62.74 -49.41 75.15 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.955 0.798 . . . . 0.0 112.146 174.049 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -61.25 -39.51 90.62 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.493 0.717 . . . . 0.0 112.295 179.595 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 80.5 mt -66.08 -48.42 71.02 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.487 0.715 . . . . 0.0 111.872 170.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -62.27 -39.72 93.85 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 120.78 -1.2 . . . . 0.0 113.53 -175.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 14.2 mttm -60.02 -29.33 68.42 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.672 0.789 . . . . 0.0 112.595 174.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 59.4 mt -86.61 -39.98 13.79 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 C-N-CA 123.615 0.766 . . . . 0.0 112.055 174.134 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 35.6 t80 -50.43 -53.17 31.49 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.366 0.985 . . . . 0.0 110.455 172.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.2 mt -62.97 -40.24 97.1 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 112.951 0.723 . . . . 0.0 112.951 -179.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.5 pt20 -71.33 -29.67 65.28 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 119.694 1.134 . . . . 0.0 112.847 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -75.69 -48.44 21.97 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 117.638 -1.173 . . . . 0.0 112.439 174.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 6.1 m -66.97 -26.28 36.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 CA-C-N 121.031 1.741 . . . . 0.0 112.075 177.033 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -60.64 -29.99 69.6 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 172.139 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -89.99 -6.25 55.83 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 124.712 1.205 . . . . 0.0 112.838 175.648 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 39.7 ttp -63.77 139.45 97.63 Favored Pre-proline 0 CA--C 1.547 0.847 0 O-C-N 121.251 -0.906 . . . . 0.0 110.278 170.834 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -63.75 154.62 68.34 Favored 'Trans proline' 0 CA--C 1.538 0.699 0 C-N-CA 122.758 2.305 . . . . 0.0 111.907 175.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 20.1 mm100 -84.54 -18.07 36.89 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 176.055 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -96.35 155.22 16.86 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.357 1.463 . . . . 0.0 112.934 -179.441 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -122.32 138.25 54.57 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.652 1.181 . . . . 0.0 111.065 -175.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 9.7 p -145.16 140.08 22.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 C-N-CA 125.289 1.436 . . . . 0.0 110.672 176.121 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -70.24 135.78 49.32 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.67 1.188 . . . . 0.0 111.354 176.385 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . 0.589 HD12 ' HB3' ' A' ' 35' ' ' LYS . 84.1 mt . . . . . 0 CA--C 1.54 0.585 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 -173.04 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.191 0 CA-C-O 121.111 0.284 . . . . 0.0 113.367 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.5 ptt180 -158.4 152.46 23.93 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 126.55 1.94 . . . . 0.0 109.858 168.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 26.2 ttpt -82.63 141.64 32.36 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 121.455 0.645 . . . . 0.0 111.127 174.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 59.3 p -135.74 166.63 22.81 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 125.562 1.545 . . . . 0.0 111.143 -169.24 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 27.3 p-10 -47.54 -38.34 13.95 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.288 1.035 . . . . 0.0 113.767 172.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 15.0 tt0 -72.72 -42.12 64.49 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.424 1.09 . . . . 0.0 112.323 -179.344 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 73.3 mt -67.18 -31.65 72.2 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.566 0.746 . . . . 0.0 112.137 171.262 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -60.96 -48.46 81.7 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 118.539 0.609 . . . . 0.0 110.413 169.551 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -55.76 -41.07 73.44 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.466 0.706 . . . . 0.0 112.415 177.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 90.3 mmm -57.0 -52.87 63.55 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 119.004 -0.522 . . . . 0.0 112.401 172.468 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -77.87 -17.26 57.55 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 114.772 1.397 . . . . 0.0 114.772 -178.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -106.27 -22.35 12.85 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.002 0.921 . . . . 0.0 113.317 -169.122 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 33.7 t -127.96 -51.68 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 C-N-CA 123.234 0.614 . . . . 0.0 111.207 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.7 t -67.72 -62.34 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.206 0.602 . . . . 0.0 110.566 -174.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 55.6 t -57.19 -50.62 76.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 124.375 1.07 . . . . 0.0 110.222 173.138 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm -57.03 -43.49 81.98 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 118.658 0.663 . . . . 0.0 112.407 -174.261 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 56.4 m -69.4 -47.62 63.6 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 117.956 0.344 . . . . 0.0 111.901 176.576 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 70.9 mt -61.43 -33.85 74.41 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.43 0.692 . . . . 0.0 112.313 178.806 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . 0.445 ' CZ3' ' HE3' ' A' ' 87' ' ' LYS . 22.2 t-105 -70.07 -29.64 66.69 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.828 1.651 . . . . 0.0 113.413 176.218 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.4 mtmp? -82.7 -7.1 59.67 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.012 0.925 . . . . 0.0 113.403 177.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 41.0 t-80 -64.76 152.86 41.53 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.707 1.203 . . . . 0.0 113.018 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 26.8 mp0 -60.85 -19.29 59.73 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.578 1.551 . . . . 0.0 113.948 175.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -119.78 15.24 12.64 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.56 1.544 . . . . 0.0 113.672 -175.162 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.93 -26.21 63.09 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.184 1.394 . . . . 0.0 114.345 178.245 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 68.1 p-90 -57.54 -33.89 21.62 Favored Pre-proline 0 CA--C 1.549 0.938 0 N-CA-C 117.967 2.58 . . . . 0.0 117.967 -170.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -77.24 -1.28 11.44 Favored 'Trans proline' 0 CA--C 1.543 0.972 0 CA-C-N 123.437 2.263 . . . . 0.0 113.281 174.755 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 88.4 m-85 -112.03 -4.87 14.37 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.576 1.55 . . . . 0.0 113.411 179.372 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -65.02 -14.76 61.22 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 176.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 69.8 mt-30 -142.91 157.7 60.68 Favored Pre-proline 0 CA--C 1.547 0.861 0 C-N-CA 126.252 1.821 . . . . 0.0 111.069 -176.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -65.65 157.06 60.58 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 123.336 2.691 . . . . 0.0 113.309 176.082 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 21.8 t -77.09 85.8 0.84 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 125.085 1.354 . . . . 0.0 110.015 178.511 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -71.31 86.11 0.8 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.025 1.33 . . . . 0.0 111.303 177.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.37 -27.88 26.23 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 124.893 1.277 . . . . 0.0 114.395 -178.492 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 82.0 mt -65.77 -49.96 73.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 124.831 1.252 . . . . 0.0 111.109 173.664 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 85.5 mttt -67.3 -40.37 86.03 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.932 1.293 . . . . 0.0 112.4 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.9 mp -82.65 -3.59 56.51 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.869 1.667 . . . . 0.0 112.7 -179.44 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 51.76 56.35 7.97 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.977 1.711 . . . . 0.0 113.123 -178.258 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 28.0 mt -112.76 81.87 4.66 Favored Pre-proline 0 CA--C 1.545 0.751 0 C-N-CA 126.179 1.792 . . . . 0.0 109.926 179.221 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -67.38 -7.82 20.25 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 124.026 3.151 . . . . 0.0 114.827 -170.095 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -132.17 17.49 4.54 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.926 1.691 . . . . 0.0 112.515 -179.156 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -48.12 -51.99 22.38 Favored 'General case' 0 N--CA 1.477 0.911 0 O-C-N 120.86 -1.15 . . . . 0.0 112.985 -175.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -76.19 -6.14 49.95 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.633 1.573 . . . . 0.0 114.496 -179.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.4 mmmp? -84.4 -37.04 21.97 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.979 0.912 . . . . 0.0 111.269 174.757 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.3 mp -81.31 -48.1 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 124.087 0.955 . . . . 0.0 110.099 171.624 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 22.0 mm -86.8 111.67 21.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 123.824 0.85 . . . . 0.0 111.596 -176.518 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 29.6 mmmt -63.14 -32.66 74.1 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.488 1.515 . . . . 0.0 112.878 175.262 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 21.7 p-10 -157.3 96.81 2.04 Favored Pre-proline 0 CA--C 1.551 0.992 0 C-N-CA 126.089 1.756 . . . . 0.0 111.904 -169.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -77.32 149.39 27.78 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 123.557 2.838 . . . . 0.0 111.763 176.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 6.7 tpt -158.42 150.33 21.47 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.663 1.185 . . . . 0.0 111.864 179.358 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -150.21 155.21 39.33 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 126.079 1.751 . . . . 0.0 112.172 -178.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.9 ttp -65.24 -33.68 76.57 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 113.45 0.908 . . . . 0.0 113.45 -174.696 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.93 -44.41 98.17 Favored Glycine 0 CA--C 1.531 1.094 0 C-N-CA 124.594 1.093 . . . . 0.0 112.909 175.242 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 65.0 m -67.2 -42.98 83.25 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 118.382 -0.818 . . . . 0.0 111.597 172.093 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 76.2 mt -52.84 -53.85 19.23 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 CA-C-N 119.801 1.182 . . . . 0.0 111.667 178.15 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.445 ' HE3' ' CZ3' ' A' ' 51' ' ' TRP . 16.0 ptpt -59.95 -29.18 68.23 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 113.891 1.071 . . . . 0.0 113.891 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.6 tpmt? -69.96 -45.59 67.07 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.421 1.089 . . . . 0.0 112.453 177.343 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 5.4 ptp180 -73.07 -27.09 61.53 Favored 'General case' 0 N--CA 1.481 1.095 0 N-CA-C 113.874 1.065 . . . . 0.0 113.874 174.116 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 33.2 mt -67.91 -43.19 79.8 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 113.161 0.8 . . . . 0.0 113.161 168.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -64.67 -46.58 81.81 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 119.006 0.821 . . . . 0.0 112.305 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 64.2 m-80 -75.08 173.91 10.11 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.409 1.484 . . . . 0.0 112.337 174.117 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 60.4 t-20 -87.11 114.17 23.49 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 121.364 -0.835 . . . . 0.0 109.01 168.15 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -137.09 -33.77 0.75 Allowed 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.363 1.065 . . . . 0.0 113.676 179.019 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -139.45 164.84 28.8 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.765 1.626 . . . . 0.0 111.824 177.416 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 5.6 t-105 -91.63 -22.56 20.22 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.736 1.214 . . . . 0.0 112.829 -179.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 7.5 t -143.9 149.01 36.22 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.561 1.144 . . . . 0.0 113.285 -169.353 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -70.96 -18.59 62.62 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 115.764 1.764 . . . . 0.0 115.764 -172.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 11.4 t -60.51 -25.72 66.31 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.403 1.002 . . . . 0.0 113.004 178.491 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -67.08 -42.25 84.98 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 121.31 -0.869 . . . . 0.0 111.87 173.068 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 42.3 t -65.1 -35.4 81.03 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.819 0.847 . . . . 0.0 112.248 172.556 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 80.8 mtp -63.69 -41.43 98.13 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 121.453 -0.78 . . . . 0.0 112.003 173.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -62.17 -39.36 92.39 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 171.373 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 92.4 m-20 -65.0 -42.19 94.7 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 119.414 1.007 . . . . 0.0 112.303 175.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -61.33 -45.79 92.98 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 121.236 -0.915 . . . . 0.0 112.635 172.098 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 31.9 t30 -58.63 -41.11 85.18 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.653 -0.654 . . . . 0.0 111.752 173.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 85.6 m -66.01 -36.56 83.61 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.055 1.342 . . . . 0.0 112.672 178.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 17.3 ttm -58.67 -57.79 11.42 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.025 0.93 . . . . 0.0 111.365 174.179 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 19.3 m-85 -64.86 -38.18 90.11 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 122.831 0.452 . . . . 0.0 112.141 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 92.6 m -64.63 -48.09 76.14 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.502 0.721 . . . . 0.0 112.167 178.414 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -64.23 -30.14 71.21 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 119.785 1.175 . . . . 0.0 112.578 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 98.8 m -61.39 -43.68 98.45 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.356 0.663 . . . . 0.0 112.66 170.052 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 -68.3 -32.26 72.27 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 177.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 73.5 mt -73.24 -57.51 6.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 123.214 0.606 . . . . 0.0 111.091 179.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -68.59 -27.18 65.82 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 114.111 1.152 . . . . 0.0 114.111 -172.242 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 -113.74 164.61 13.49 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.479 1.112 . . . . 0.0 112.506 -171.373 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -71.06 146.02 92.16 Favored Pre-proline 0 N--CA 1.474 0.741 0 C-N-CA 123.918 0.887 . . . . 0.0 110.513 175.629 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -66.87 -5.25 12.89 Favored 'Trans proline' 0 CA--C 1.543 0.97 0 C-N-CA 123.839 3.026 . . . . 0.0 114.659 -176.14 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 45.3 p -112.98 -3.55 14.03 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 126.999 2.12 . . . . 0.0 113.169 -179.652 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 37.1 t0 -68.91 152.38 45.35 Favored 'General case' 0 CA--C 1.542 0.658 0 O-C-N 121.462 -0.774 . . . . 0.0 111.319 174.099 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -54.65 -48.28 72.49 Favored 'General case' 0 N--CA 1.47 0.546 0 O-C-N 121.625 -0.672 . . . . 0.0 111.927 -179.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.5 tp -55.94 -31.98 31.9 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 -177.011 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 49.0 t -71.05 -51.21 36.89 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 C-N-CA 123.362 0.665 . . . . 0.0 110.647 173.406 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 75.5 mt -61.13 -37.46 82.92 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 119.082 0.856 . . . . 0.0 112.005 179.715 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 37.3 mtp -60.59 -49.52 77.21 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 126.183 1.793 . . . . 0.0 111.672 171.416 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -62.1 -39.61 93.07 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 175.043 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 90.6 mt-30 -61.88 -44.47 96.75 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 119.209 0.913 . . . . 0.0 111.98 175.465 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.62 -42.76 95.29 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.656 0.782 . . . . 0.0 112.785 176.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 85.3 mt -63.26 -44.89 93.84 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.282 0.633 . . . . 0.0 111.634 172.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -60.85 -41.43 95.86 Favored 'General case' 0 CA--C 1.538 0.483 0 O-C-N 121.145 -0.972 . . . . 0.0 112.744 -177.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 55.5 mtmt -60.06 -28.49 67.84 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 175.297 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 58.5 mt -84.9 -39.89 14.56 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 C-N-CA 123.481 0.712 . . . . 0.0 111.901 173.251 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -51.88 -51.34 57.49 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.134 -0.978 . . . . 0.0 110.554 172.034 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 99.3 mt -62.35 -40.88 97.84 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.596 0.758 . . . . 0.0 113.006 179.229 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -70.83 -28.4 64.59 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.663 1.119 . . . . 0.0 112.996 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 70.8 mmtt -76.14 -47.09 25.61 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 117.925 -1.036 . . . . 0.0 112.74 173.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 9.1 m -68.41 -24.92 30.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 CA-C-N 121.024 1.738 . . . . 0.0 112.187 176.024 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -60.19 -28.08 67.66 Favored 'General case' 0 CA--C 1.541 0.633 0 O-C-N 121.523 -0.736 . . . . 0.0 112.682 171.058 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 93.7 mt-30 -98.58 2.75 47.69 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.358 1.463 . . . . 0.0 112.769 177.709 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 8.1 ttm -53.45 141.76 42.48 Favored Pre-proline 0 CA--C 1.545 0.769 0 C-N-CA 124.863 1.265 . . . . 0.0 112.78 175.265 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -68.95 111.34 2.62 Favored 'Trans proline' 0 CA--C 1.537 0.666 0 C-N-CA 123.111 2.541 . . . . 0.0 109.02 168.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 -69.3 -22.1 63.82 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 -172.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -84.81 156.77 21.2 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.649 1.579 . . . . 0.0 111.662 175.355 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -131.09 128.84 41.01 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.739 1.216 . . . . 0.0 112.547 -168.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 7.7 p -150.46 146.0 16.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 125.134 1.374 . . . . 0.0 111.88 -178.521 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -63.22 140.66 58.9 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.008 1.323 . . . . 0.0 112.383 175.745 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 83.3 mt . . . . . 0 N--CA 1.472 0.643 0 N-CA-C 114.202 1.186 . . . . 0.0 114.202 -177.633 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.164 0 N-CA-C 112.621 -0.191 . . . . 0.0 112.621 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 36.0 ptt180 -144.86 154.43 42.63 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.198 1.399 . . . . 0.0 110.58 169.44 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.6 tptm -81.93 130.73 35.16 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.365 1.066 . . . . 0.0 110.279 177.438 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 65.3 p -135.24 165.22 25.93 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.972 1.309 . . . . 0.0 111.936 -169.459 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -50.31 -35.43 27.41 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 112.354 0.502 . . . . 0.0 112.354 174.617 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 14.2 mp0 -57.91 -65.1 0.69 Allowed 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.137 1.375 . . . . 0.0 111.263 173.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 76.1 mt -63.37 -32.71 74.21 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -175.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 -62.22 -54.65 37.81 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 118.473 0.578 . . . . 0.0 110.77 169.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 65.4 t80 -56.86 -38.26 72.46 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.881 0.872 . . . . 0.0 112.632 -179.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 86.1 mmm -55.07 -49.39 71.77 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 172.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -82.92 -18.03 41.57 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 120.385 1.448 . . . . 0.0 114.524 179.206 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 59.5 t30 -99.09 -24.56 14.85 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.77 1.228 . . . . 0.0 112.767 -170.405 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 39.9 t -130.38 -49.83 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 C-N-CA 123.945 0.898 . . . . 0.0 111.576 -179.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 17.1 t -72.17 -68.14 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 CA-C-N 118.943 0.792 . . . . 0.0 111.058 -170.667 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 60.4 t -58.54 -40.57 79.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 124.578 1.151 . . . . 0.0 110.199 172.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.4 tppt? -52.84 -51.03 62.49 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 118.837 0.744 . . . . 0.0 112.262 177.151 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 72.5 m -70.52 -43.42 69.64 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.191 0.596 . . . . 0.0 111.82 179.253 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 46.5 mt -63.71 -32.04 73.41 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.396 0.679 . . . . 0.0 112.333 179.216 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 14.3 t-105 -74.33 -30.73 62.16 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.887 1.675 . . . . 0.0 113.058 173.038 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp -79.12 -8.8 59.28 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.135 0.974 . . . . 0.0 113.402 175.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 38.6 t-80 -63.02 156.05 25.84 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.278 1.431 . . . . 0.0 113.436 -178.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 19.1 mm100 -60.34 -22.16 62.92 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.052 1.341 . . . . 0.0 114.039 174.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -124.31 21.24 8.76 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.155 1.382 . . . . 0.0 113.666 -172.577 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.01 -24.77 62.44 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.093 1.357 . . . . 0.0 113.95 174.377 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 64.4 p-90 -59.38 -33.88 19.39 Favored Pre-proline 0 CA--C 1.547 0.827 0 N-CA-C 117.538 2.421 . . . . 0.0 117.538 -170.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -79.31 2.47 8.3 Favored 'Trans proline' 0 CA--C 1.547 1.132 0 CA-C-N 122.985 2.102 . . . . 0.0 113.058 172.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -117.9 9.89 13.0 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.273 1.829 . . . . 0.0 113.206 178.077 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 22.5 m-30 -74.6 -17.02 60.78 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 120.396 -1.44 . . . . 0.0 113.538 174.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 31.4 mm-40 -149.21 148.58 27.15 Favored Pre-proline 0 CA--C 1.546 0.805 0 C-N-CA 126.495 1.918 . . . . 0.0 110.753 -178.685 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -68.05 163.26 36.54 Favored 'Trans proline' 0 CA--C 1.537 0.627 0 C-N-CA 124.085 3.19 . . . . 0.0 113.572 -177.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 46.9 t -72.59 89.12 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 124.685 1.194 . . . . 0.0 110.012 173.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -69.57 78.77 0.41 Allowed 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.824 1.25 . . . . 0.0 109.96 169.165 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -52.28 -24.92 8.22 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.677 1.362 . . . . 0.0 114.677 -174.739 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 84.9 mt -62.94 -48.89 85.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 125.204 1.401 . . . . 0.0 111.32 170.651 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 56.5 mttm -76.01 -40.97 52.44 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 125.912 1.685 . . . . 0.0 112.836 -179.159 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -72.12 -11.03 60.56 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.244 1.018 . . . . 0.0 113.555 172.43 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.5 t30 58.46 54.07 5.8 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 126.697 1.999 . . . . 0.0 112.71 178.652 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 37.2 mt -114.61 81.29 6.91 Favored Pre-proline 0 CA--C 1.543 0.691 0 C-N-CA 126.289 1.836 . . . . 0.0 110.17 -178.274 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -66.15 -12.66 36.44 Favored 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 123.325 2.683 . . . . 0.0 113.296 -177.383 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 35.0 m-20 -111.42 6.01 20.02 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 126.074 1.75 . . . . 0.0 113.365 177.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -54.26 -52.22 62.07 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 120.472 1.487 . . . . 0.0 112.15 -178.335 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -76.75 -15.26 59.81 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.692 1.197 . . . . 0.0 114.121 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 9.5 mptt -69.41 -44.52 71.21 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 121.304 -0.873 . . . . 0.0 110.731 174.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.4 mp -81.87 -51.67 14.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 C-N-CA 123.524 0.73 . . . . 0.0 110.151 173.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 22.7 mm -83.41 101.79 8.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 CA-C-O 122.328 1.061 . . . . 0.0 111.599 -177.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -65.7 -30.88 71.62 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 126.046 1.738 . . . . 0.0 113.473 178.063 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -148.6 111.72 3.66 Favored Pre-proline 0 CA--C 1.546 0.819 0 C-N-CA 125.996 1.719 . . . . 0.0 110.488 174.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -87.84 160.23 7.55 Favored 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 124.306 3.337 . . . . 0.0 112.016 172.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.5 tpt -159.3 155.71 27.36 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.84 1.256 . . . . 0.0 111.88 175.578 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -149.65 151.16 33.28 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.103 1.361 . . . . 0.0 113.42 -175.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 4.3 ttp -65.67 -33.24 75.42 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.244 1.017 . . . . 0.0 112.804 -174.396 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -58.53 -45.65 94.24 Favored Glycine 0 CA--C 1.528 0.875 0 C-N-CA 124.327 0.965 . . . . 0.0 112.163 176.012 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 25.4 m -70.13 -43.68 70.47 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.104 0.962 . . . . 0.0 111.885 176.308 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 83.3 mt -52.97 -52.71 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.182 0 CA-C-N 119.428 1.013 . . . . 0.0 111.413 177.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 6.5 ttpm? -56.43 -32.59 65.03 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.424 1.489 . . . . 0.0 113.201 177.548 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.1 tpmt? -72.72 -45.33 59.29 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.936 1.294 . . . . 0.0 113.275 177.394 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 3.1 ptp180 -69.04 -31.09 69.63 Favored 'General case' 0 N--CA 1.483 1.218 0 CA-C-N 119.49 1.041 . . . . 0.0 113.421 174.448 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 55.4 mt -64.94 -41.31 95.62 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 113.774 1.027 . . . . 0.0 113.774 169.255 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -62.3 -33.44 74.66 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 118.809 0.731 . . . . 0.0 112.756 176.709 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 52.5 m-80 -79.52 -176.49 5.31 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 125.624 1.569 . . . . 0.0 112.511 171.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -105.39 42.54 1.22 Allowed 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 125.555 1.542 . . . . 0.0 110.394 174.08 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 45.5 t80 -66.61 -32.99 74.67 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 114.046 1.128 . . . . 0.0 114.046 -168.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -139.04 -177.26 4.81 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.531 1.932 . . . . 0.0 112.755 -177.269 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 4.5 t-105 -107.57 -25.73 11.22 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.41 1.484 . . . . 0.0 112.848 -177.013 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 47.0 t -136.55 143.08 43.49 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.709 1.204 . . . . 0.0 112.162 -170.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -57.56 -19.3 24.5 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.625 1.17 . . . . 0.0 113.839 169.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 10.4 m -53.17 -36.57 61.04 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 119.098 0.863 . . . . 0.0 112.65 177.416 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -71.85 -40.92 68.67 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 123.75 0.82 . . . . 0.0 112.731 176.384 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 43.0 t -61.06 -36.51 79.8 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 123.912 0.885 . . . . 0.0 112.572 170.301 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 78.8 mtp -68.33 -39.8 81.81 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.335 1.054 . . . . 0.0 111.95 175.641 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -61.0 -40.82 95.01 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 123.236 0.614 . . . . 0.0 112.006 169.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -64.03 -43.11 96.55 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 121.535 -0.728 . . . . 0.0 112.245 175.53 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -61.0 -41.72 97.06 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 121.301 -0.874 . . . . 0.0 112.912 172.375 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 13.9 t30 -57.53 -50.47 72.98 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 118.398 0.544 . . . . 0.0 111.193 172.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 53.7 m -57.84 -38.59 75.92 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 176.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 19.3 ttm -59.96 -62.4 1.9 Allowed 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.515 1.052 . . . . 0.0 111.611 176.152 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -63.02 -39.82 95.91 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -176.479 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 60.8 m -66.25 -44.39 83.83 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 118.272 -0.871 . . . . 0.0 112.572 178.176 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -64.29 -32.63 74.31 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 120.921 1.691 . . . . 0.0 112.398 178.126 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 57.5 m -60.82 -43.98 97.51 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.229 0.612 . . . . 0.0 112.433 169.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -67.66 -32.99 74.05 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 176.604 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 80.0 mt -72.58 -58.01 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 123.613 0.765 . . . . 0.0 111.038 178.25 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -69.71 -19.53 63.56 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 114.381 1.252 . . . . 0.0 114.381 -170.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 36.5 m-80 -123.25 160.15 27.24 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.724 1.21 . . . . 0.0 112.144 -173.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.85 148.72 96.51 Favored Pre-proline 0 N--CA 1.472 0.642 0 C-N-CA 124.242 1.017 . . . . 0.0 110.641 176.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -65.32 -8.52 19.02 Favored 'Trans proline' 0 CA--C 1.543 0.947 0 C-N-CA 123.67 2.913 . . . . 0.0 114.723 -175.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 44.8 p -107.92 -4.08 18.28 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.745 2.018 . . . . 0.0 113.471 179.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -67.09 145.99 54.75 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 118.909 0.777 . . . . 0.0 111.11 175.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -52.68 -45.32 66.76 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.682 0.793 . . . . 0.0 112.736 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 9.1 tp -57.37 -35.19 48.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 124.387 1.075 . . . . 0.0 113.785 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 48.0 t -68.51 -44.38 83.07 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 C-N-CA 123.393 0.677 . . . . 0.0 110.534 174.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 68.9 mt -62.7 -36.43 82.92 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 118.848 0.749 . . . . 0.0 112.094 176.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 1.1 mmt -57.61 -52.27 66.12 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 118.241 0.473 . . . . 0.0 111.004 170.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -63.17 -37.37 86.95 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.582 0.753 . . . . 0.0 112.758 179.322 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 83.2 mt-30 -62.08 -40.61 96.4 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 119.607 1.094 . . . . 0.0 112.861 173.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -69.81 -45.46 67.83 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.545 -0.722 . . . . 0.0 112.107 176.502 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 83.1 mt -64.54 -43.97 92.31 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.622 0.769 . . . . 0.0 112.234 177.193 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -63.27 -40.95 98.83 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 119.81 1.186 . . . . 0.0 112.874 -175.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 36.0 mtmm -59.77 -39.62 85.49 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 121.528 -0.733 . . . . 0.0 111.954 175.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 77.0 mt -72.75 -41.11 61.91 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 C-N-CA 122.947 0.499 . . . . 0.0 111.424 176.467 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 16.7 t80 -51.06 -51.24 55.19 Favored 'General case' 0 CA--C 1.538 0.511 0 O-C-N 121.491 -0.756 . . . . 0.0 110.53 172.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 98.1 mt -65.14 -41.28 94.91 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 178.301 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -65.53 -32.16 73.61 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 120.118 1.327 . . . . 0.0 112.293 179.678 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 70.3 mmtt -75.5 -48.67 21.53 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 117.536 -1.221 . . . . 0.0 112.146 177.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 6.1 m -67.06 -26.76 37.42 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 CA-C-N 121.13 1.786 . . . . 0.0 112.3 177.12 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -61.22 -30.96 70.75 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 172.041 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 99.5 mt-30 -89.58 -7.92 53.76 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.992 1.317 . . . . 0.0 112.955 175.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 46.2 ttp -65.49 144.32 98.91 Favored Pre-proline 0 CA--C 1.547 0.84 0 CA-C-N 119.141 0.882 . . . . 0.0 111.301 173.725 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -53.69 142.94 60.0 Favored 'Trans proline' 0 CA--C 1.539 0.738 0 C-N-CA 122.548 2.165 . . . . 0.0 111.904 168.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -91.29 -24.0 19.97 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 112.581 0.586 . . . . 0.0 112.581 176.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -86.74 155.33 20.39 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.662 1.185 . . . . 0.0 111.508 172.562 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -103.09 138.56 39.77 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.196 1.398 . . . . 0.0 111.558 -174.151 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 69.2 t -137.85 124.65 28.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 125.529 1.532 . . . . 0.0 109.129 177.51 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -69.84 128.73 37.41 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.52 1.128 . . . . 0.0 111.084 169.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 49.8 mt . . . . . 0 N--CA 1.471 0.586 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -176.126 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.935 0 CA-C-O 120.832 0.129 . . . . 0.0 113.311 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -173.49 165.12 4.64 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 127.289 2.236 . . . . 0.0 110.983 175.737 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 5.5 mmtp -64.64 136.22 56.75 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.609 1.164 . . . . 0.0 111.959 173.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 71.0 p -142.0 161.84 36.97 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 126.307 1.843 . . . . 0.0 109.899 177.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 16.0 t30 -52.7 -33.61 48.38 Favored 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 114.622 1.341 . . . . 0.0 114.622 177.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -72.25 -47.15 52.45 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.084 -1.01 . . . . 0.0 112.208 174.002 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 86.1 mt -62.56 -30.88 71.63 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 121.223 -0.923 . . . . 0.0 112.33 174.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -58.98 -54.33 48.3 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.816 1.247 . . . . 0.0 109.947 169.126 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 63.3 t80 -58.49 -41.61 85.72 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.966 0.907 . . . . 0.0 112.909 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 96.2 mmm -54.78 -52.33 62.93 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 118.348 0.522 . . . . 0.0 111.834 173.333 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -71.09 -31.79 68.24 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 113.793 1.034 . . . . 0.0 113.793 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 42.9 t30 -98.89 -16.27 18.88 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 114.658 1.355 . . . . 0.0 114.658 -166.653 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 17.2 t -132.81 -50.26 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 122.8 0.44 . . . . 0.0 111.271 -179.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 17.9 t -69.86 -66.41 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 123.645 0.778 . . . . 0.0 110.423 -174.291 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 48.7 t -55.1 -47.74 76.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 125.836 1.654 . . . . 0.0 110.303 173.266 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 52.0 tttt -59.8 -37.94 80.55 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.89 0.876 . . . . 0.0 113.176 -175.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 22.2 m -83.52 -38.54 21.61 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 118.542 0.61 . . . . 0.0 112.37 177.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 67.9 mt -60.86 -35.49 76.73 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 121.585 -0.697 . . . . 0.0 112.343 172.684 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 20.2 t-105 -70.55 -29.69 66.21 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.201 1.4 . . . . 0.0 113.543 176.507 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 55.0 mttm -71.15 -17.59 62.54 Favored 'General case' 0 N--CA 1.484 1.261 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 172.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 44.5 t-80 -62.37 151.15 37.64 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.58 1.152 . . . . 0.0 113.596 -171.736 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 26.4 mp0 -59.28 -16.77 23.62 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.018 1.727 . . . . 0.0 114.167 176.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 -124.63 17.85 8.78 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.721 1.608 . . . . 0.0 113.747 -177.403 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.24 -28.57 66.46 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 176.139 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . 0.411 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 42.9 p-90 -57.42 -38.05 63.63 Favored Pre-proline 0 CA--C 1.547 0.86 0 N-CA-C 117.613 2.449 . . . . 0.0 117.613 -170.201 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.411 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 73.3 Cg_endo -70.97 -6.26 18.8 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 CA-C-N 123.115 2.148 . . . . 0.0 114.225 173.485 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 56.6 m-85 -109.61 -4.32 16.28 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.343 1.457 . . . . 0.0 112.921 178.646 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 21.0 m-30 -62.43 -18.26 61.28 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 114.343 1.238 . . . . 0.0 114.343 178.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 86.5 mt-30 -143.79 155.75 59.46 Favored Pre-proline 0 CA--C 1.544 0.727 0 C-N-CA 125.787 1.635 . . . . 0.0 110.559 -175.165 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -64.84 146.36 87.96 Favored 'Trans proline' 0 CA--C 1.539 0.773 0 C-N-CA 122.733 2.289 . . . . 0.0 111.862 173.436 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 95.9 t -62.13 120.54 8.6 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 123.932 0.893 . . . . 0.0 111.732 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 38.2 m-20 -89.02 89.45 7.99 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.505 1.122 . . . . 0.0 109.952 169.646 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.95 -28.11 48.85 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 113.603 0.964 . . . . 0.0 113.603 178.54 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 81.8 mt -64.86 -50.08 76.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 124.876 1.27 . . . . 0.0 111.039 172.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -66.86 -41.17 87.76 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.039 1.336 . . . . 0.0 112.807 -179.223 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.4 mp -80.2 -3.78 50.44 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.124 0.969 . . . . 0.0 113.21 176.359 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 61.8 t30 54.89 55.73 7.45 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 126.259 1.824 . . . . 0.0 113.448 -179.422 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 44.1 mt -115.2 80.43 7.26 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 126.587 1.955 . . . . 0.0 110.594 -176.301 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -68.88 -4.7 13.91 Favored 'Trans proline' 0 CA--C 1.544 1.023 0 C-N-CA 123.992 3.128 . . . . 0.0 114.418 -175.203 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -124.54 15.11 8.84 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.524 1.929 . . . . 0.0 111.951 179.195 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -51.12 -57.12 9.54 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 120.727 -1.233 . . . . 0.0 112.788 -176.345 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -73.54 -2.41 22.63 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.962 1.305 . . . . 0.0 114.194 178.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -84.52 -43.23 14.74 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.395 1.078 . . . . 0.0 110.611 176.807 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.3 mp -82.14 -47.57 19.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 C-N-CA 124.397 1.079 . . . . 0.0 110.423 172.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.593 HD11 ' HB2' ' A' ' 115' ' ' TYR . 34.4 mm -78.6 113.7 18.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 123.549 0.74 . . . . 0.0 111.254 -179.04 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -77.01 -31.05 56.14 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.947 1.299 . . . . 0.0 112.575 174.302 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 18.4 p30 -149.88 83.29 6.29 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 125.609 1.564 . . . . 0.0 112.215 -168.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -70.34 138.42 35.93 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 123.179 2.586 . . . . 0.0 110.932 178.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 8.5 tpt -156.32 137.58 13.81 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.863 1.265 . . . . 0.0 110.017 -174.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -146.17 148.31 32.41 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 125.316 1.446 . . . . 0.0 111.364 -175.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 9.4 ttp -57.54 -36.98 72.33 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.173 1.389 . . . . 0.0 113.181 -171.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.56 -27.05 65.45 Favored Glycine 0 CA--C 1.533 1.206 0 C-N-CA 124.989 1.28 . . . . 0.0 114.366 173.584 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 26.0 m -87.36 -37.28 17.23 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.457 1.103 . . . . 0.0 111.215 172.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 66.5 mt -56.43 -51.14 68.08 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 CA-C-N 119.61 1.096 . . . . 0.0 110.892 176.184 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 15.0 ptmm? -59.39 -37.07 77.04 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 175.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.71 -36.41 80.85 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.473 1.109 . . . . 0.0 112.842 -178.634 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 5.7 ptp180 -80.59 -30.62 36.89 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 114.114 1.153 . . . . 0.0 114.114 172.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 76.2 mt -63.74 -30.9 71.94 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-N 119.759 1.163 . . . . 0.0 113.794 168.588 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -66.16 -15.0 62.76 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 114.618 1.34 . . . . 0.0 114.618 -178.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -138.56 177.85 7.58 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 125.397 1.479 . . . . 0.0 113.592 -174.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 4.0 p30 -78.34 97.65 5.68 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 124.431 1.092 . . . . 0.0 111.78 173.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 78.7 t80 -131.24 -37.78 1.24 Allowed 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.54 1.136 . . . . 0.0 113.023 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -132.9 173.44 11.4 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.896 1.678 . . . . 0.0 111.098 169.831 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.6 t-105 -106.78 -19.07 13.76 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.306 1.042 . . . . 0.0 112.544 -177.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 78.6 p -137.63 145.71 43.05 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.487 1.115 . . . . 0.0 114.009 -170.251 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -63.53 -22.22 66.77 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 114.847 1.425 . . . . 0.0 114.847 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 15.3 p -51.54 -35.29 40.18 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.273 1.029 . . . . 0.0 113.452 174.612 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -70.01 -43.52 71.2 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.117 0.967 . . . . 0.0 112.105 176.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 51.0 t -63.32 -39.33 94.25 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.245 1.018 . . . . 0.0 112.298 173.04 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 86.7 mtp -61.75 -42.14 98.58 Favored 'General case' 0 N--CA 1.47 0.546 0 O-C-N 121.291 -0.881 . . . . 0.0 112.279 174.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 90.8 mm-40 -62.93 -38.57 91.51 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 172.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -63.77 -42.45 97.78 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 119.347 0.976 . . . . 0.0 112.421 174.503 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -59.66 -45.28 92.51 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.21 -0.931 . . . . 0.0 112.356 171.313 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -57.97 -46.03 85.8 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.82 -0.55 . . . . 0.0 112.222 174.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 84.0 m -63.75 -38.31 90.64 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.177 0.991 . . . . 0.0 112.669 176.415 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 51.0 ttp -59.13 -53.07 62.55 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 119.385 0.993 . . . . 0.0 112.03 176.214 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -68.33 -39.53 81.91 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 121.996 -0.44 . . . . 0.0 112.081 179.367 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 86.4 m -64.24 -48.26 76.5 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.65 0.78 . . . . 0.0 112.063 -179.719 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -64.06 -32.18 73.64 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 119.055 0.843 . . . . 0.0 112.067 -179.7 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 88.7 m -61.16 -44.24 97.63 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.731 0.812 . . . . 0.0 112.885 170.406 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 17.0 m-85 -67.63 -29.45 68.76 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 114.031 1.122 . . . . 0.0 114.031 178.326 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 87.5 mt -68.83 -56.91 10.43 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 123.136 0.574 . . . . 0.0 110.648 175.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . 0.593 ' HB2' HD11 ' A' ' 77' ' ' ILE . 25.8 t80 -69.61 -37.83 77.03 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 -173.028 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 52.3 m-80 -103.55 151.88 22.36 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.408 1.083 . . . . 0.0 111.164 -172.468 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.34 153.87 93.97 Favored Pre-proline 0 N--CA 1.469 0.493 0 C-N-CA 123.804 0.842 . . . . 0.0 111.135 178.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -64.02 -3.28 5.71 Favored 'Trans proline' 0 CA--C 1.547 1.133 0 C-N-CA 124.288 3.325 . . . . 0.0 114.79 -178.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 62.1 p -122.22 0.02 9.47 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 126.944 2.097 . . . . 0.0 113.256 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 65.5 m-20 -67.93 146.1 53.93 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 118.886 0.766 . . . . 0.0 110.759 170.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -56.45 -46.46 80.31 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 121.537 -0.727 . . . . 0.0 112.36 -176.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.5 tp -55.38 -29.84 24.48 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 125.008 1.323 . . . . 0.0 114.321 177.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 40.3 t -72.31 -47.22 53.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 O-C-N 121.272 -0.893 . . . . 0.0 110.431 173.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 71.0 mt -61.03 -36.97 80.94 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 118.943 0.792 . . . . 0.0 111.617 176.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 9.4 mtt -58.92 -51.88 68.13 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.957 1.303 . . . . 0.0 112.081 169.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.6 -40.08 90.51 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.349 0.659 . . . . 0.0 112.702 176.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 89.1 mt-30 -61.73 -45.92 91.85 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 119.072 0.851 . . . . 0.0 111.975 173.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -67.65 -28.72 67.96 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.55 1.14 . . . . 0.0 113.794 178.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 77.1 mt -76.72 -46.84 23.87 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.513 0.725 . . . . 0.0 111.455 169.517 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -61.4 -40.36 94.1 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.186 0.903 . . . . 0.0 113.084 -174.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -60.52 -33.72 73.05 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 113.187 0.81 . . . . 0.0 113.187 177.254 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 48.1 mt -78.75 -43.21 25.36 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 124.026 0.93 . . . . 0.0 111.415 173.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -49.33 -50.06 41.28 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 120.036 1.289 . . . . 0.0 110.907 172.168 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 99.9 mt -62.99 -42.72 99.92 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 113.126 0.788 . . . . 0.0 113.126 179.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -69.7 -28.44 65.83 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.793 1.179 . . . . 0.0 112.782 178.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 33.9 mmtm -72.8 -52.03 16.6 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 125.423 1.489 . . . . 0.0 111.639 175.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.9 m -68.89 -25.09 29.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 CA-C-N 119.88 1.218 . . . . 0.0 112.382 178.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -59.15 -29.01 67.11 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 173.071 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -92.57 -4.11 53.97 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.637 1.175 . . . . 0.0 112.866 176.371 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 40.7 ttp -65.87 139.14 96.7 Favored Pre-proline 0 CA--C 1.546 0.814 0 O-C-N 121.189 -0.945 . . . . 0.0 110.371 170.557 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -65.74 133.25 33.32 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 122.929 2.419 . . . . 0.0 110.896 176.103 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -69.1 -30.8 69.16 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 178.317 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -76.57 162.04 28.1 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.651 1.58 . . . . 0.0 111.153 169.383 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -134.81 145.19 48.11 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.678 1.191 . . . . 0.0 111.802 -176.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 54.9 t -131.55 134.17 60.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 125.311 1.444 . . . . 0.0 110.622 -174.472 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -69.19 120.61 15.29 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.599 1.559 . . . . 0.0 111.399 171.004 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 91.2 mt . . . . . 0 N--CA 1.472 0.65 0 C-N-CA 124.115 0.966 . . . . 0.0 112.986 -179.347 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.82 0 N-CA-C 115.34 0.896 . . . . 0.0 115.34 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 47.7 mtm180 -145.75 179.47 7.42 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 127.129 2.172 . . . . 0.0 111.681 -172.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 40.1 tttm -128.49 69.89 1.37 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 127.196 2.198 . . . . 0.0 109.063 172.389 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 50.3 p -82.71 170.54 14.98 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.313 1.445 . . . . 0.0 113.501 -175.64 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 27.6 p-10 -48.47 -37.43 17.31 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 125.084 1.354 . . . . 0.0 114.503 169.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -72.82 -49.58 29.51 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 121.481 -0.762 . . . . 0.0 111.539 178.761 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 93.5 mt -63.53 -30.98 72.02 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 121.552 -0.717 . . . . 0.0 112.386 175.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.465 ' HB2' HD11 ' A' ' 147' ' ' LEU . 52.3 tt0 -58.79 -53.78 54.47 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 123.635 0.774 . . . . 0.0 110.498 168.835 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -59.67 -39.76 85.56 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.794 0.838 . . . . 0.0 112.772 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 93.0 mmm -55.89 -49.19 74.08 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 121.559 -0.713 . . . . 0.0 111.668 171.257 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -85.65 -3.79 58.98 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 115.046 1.499 . . . . 0.0 115.046 -175.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 37.1 m-80 -122.08 -16.76 7.42 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.305 1.442 . . . . 0.0 114.46 -176.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 54.8 t -134.07 -50.26 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 123.77 0.828 . . . . 0.0 111.359 -179.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 22.0 t -69.65 -63.19 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 CA-C-N 119.16 0.891 . . . . 0.0 110.594 -174.36 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 85.1 t -58.65 -44.66 90.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 123.946 0.898 . . . . 0.0 110.405 172.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? -56.91 -45.01 82.92 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.949 0.9 . . . . 0.0 112.614 -177.462 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 56.4 m -72.75 -45.04 60.74 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 122.813 0.445 . . . . 0.0 111.679 177.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 69.8 mt -62.97 -33.54 75.6 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.137 0.575 . . . . 0.0 112.237 179.331 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 19.5 t-105 -71.55 -29.85 65.21 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.288 1.435 . . . . 0.0 113.339 174.073 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -80.49 -7.8 59.32 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 176.032 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 40.2 t-80 -64.02 154.28 34.71 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.691 1.196 . . . . 0.0 113.357 -179.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -61.95 -17.59 57.44 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.143 1.377 . . . . 0.0 114.179 175.721 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -122.9 17.33 10.14 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.557 1.543 . . . . 0.0 113.664 -174.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.53 -27.99 65.64 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 114.165 1.172 . . . . 0.0 114.165 177.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . 0.408 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 43.3 p-90 -57.65 -37.81 60.44 Favored Pre-proline 0 CA--C 1.548 0.882 0 N-CA-C 117.808 2.521 . . . . 0.0 117.808 -169.636 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.408 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 97.9 Cg_endo -74.09 -3.46 13.83 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 CA-C-N 123.143 2.158 . . . . 0.0 113.9 173.609 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -109.96 -4.67 15.79 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.475 1.51 . . . . 0.0 112.969 178.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 22.5 m-30 -63.11 -16.39 59.83 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 114.143 1.164 . . . . 0.0 114.143 175.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 90.3 mt-30 -145.73 157.96 50.47 Favored Pre-proline 0 CA--C 1.546 0.817 0 C-N-CA 126.175 1.79 . . . . 0.0 110.837 -175.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -66.53 155.35 70.63 Favored 'Trans proline' 0 C--N 1.35 0.63 0 C-N-CA 122.933 2.422 . . . . 0.0 111.844 171.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 37.1 t -76.61 99.72 2.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 124.202 1.001 . . . . 0.0 109.879 177.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -71.6 88.63 0.95 Allowed 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.319 1.048 . . . . 0.0 111.351 175.193 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.64 -31.16 46.29 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.576 1.15 . . . . 0.0 114.094 -179.154 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 84.3 mt -66.12 -49.33 77.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 124.702 1.201 . . . . 0.0 111.075 174.476 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -65.42 -37.01 85.67 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 125.464 1.505 . . . . 0.0 113.376 -179.026 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.8 mp -88.25 -2.97 58.91 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.431 1.493 . . . . 0.0 112.558 177.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 24.1 m120 52.55 57.97 5.86 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.015 1.726 . . . . 0.0 113.255 -178.237 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 47.0 mt -114.29 81.75 6.82 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 126.625 1.97 . . . . 0.0 109.992 -179.369 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -67.19 -8.65 22.54 Favored 'Trans proline' 0 CA--C 1.543 0.963 0 C-N-CA 123.969 3.113 . . . . 0.0 113.684 -175.183 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 18.7 p-10 -118.21 8.2 12.27 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 127.988 2.515 . . . . 0.0 113.078 179.781 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 86.3 t80 -52.25 -57.24 10.31 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 120.164 1.347 . . . . 0.0 112.124 -179.215 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 99.8 m-70 -75.89 -5.93 48.39 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.21 1.404 . . . . 0.0 114.104 178.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -78.08 -32.65 50.84 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.974 0.909 . . . . 0.0 111.419 174.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.1 mp -98.26 -44.85 12.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 125.734 1.613 . . . . 0.0 111.296 175.371 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 21.3 mm -71.48 114.65 10.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 123.552 0.741 . . . . 0.0 110.929 176.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.69 -35.9 51.73 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 124.709 1.204 . . . . 0.0 113.226 172.448 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 15.2 p30 -145.34 83.81 8.9 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 125.213 1.405 . . . . 0.0 112.119 -167.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -68.63 138.58 42.02 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 123.482 2.788 . . . . 0.0 110.927 178.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.9 tpt -159.58 145.55 16.03 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 125.352 1.461 . . . . 0.0 110.116 -175.43 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -149.77 152.42 35.2 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.869 1.267 . . . . 0.0 112.005 -177.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 6.8 ttp -59.72 -33.87 72.18 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.524 1.129 . . . . 0.0 112.564 -177.51 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.51 -23.45 60.5 Favored Glycine 0 CA--C 1.536 1.366 0 C-N-CA 125.86 1.695 . . . . 0.0 114.977 172.123 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 89.8 m -97.11 -37.04 10.28 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.393 1.077 . . . . 0.0 111.372 173.178 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 98.7 mt -53.45 -49.75 52.59 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 CA-C-N 119.877 1.217 . . . . 0.0 111.088 175.368 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.7 -30.3 65.4 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 113.828 1.048 . . . . 0.0 113.828 175.846 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.449 ' HA ' ' HE3' ' A' ' 88' ' ' LYS . 1.2 tpmt? -80.17 -35.61 36.21 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.099 0.96 . . . . 0.0 112.992 -175.811 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 9.4 ptp180 -70.27 -29.84 66.73 Favored 'General case' 0 N--CA 1.482 1.138 0 CA-C-N 119.399 0.999 . . . . 0.0 113.03 169.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 70.3 mt -63.58 -43.32 97.32 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.664 0.786 . . . . 0.0 112.341 169.213 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -71.93 -2.22 17.25 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 114.662 1.356 . . . . 0.0 114.662 175.082 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 39.4 m-80 -124.77 15.05 8.67 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.667 1.587 . . . . 0.0 113.565 -177.539 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 40.62 47.83 2.45 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 126.247 1.819 . . . . 0.0 114.287 -179.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 85.8 t80 -63.17 -20.64 65.59 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 126.243 1.817 . . . . 0.0 114.179 -170.318 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -143.18 164.82 29.14 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 128.158 2.583 . . . . 0.0 111.729 -171.009 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 23.9 t-105 -87.6 -25.38 23.61 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.804 1.242 . . . . 0.0 112.703 -179.184 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 6.4 t -145.68 152.52 39.76 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 125.418 1.487 . . . . 0.0 111.981 -169.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -67.38 -15.76 63.86 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 115.248 1.574 . . . . 0.0 115.248 -176.622 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 32.0 p -54.06 -34.93 61.37 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 177.844 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -72.36 -41.36 66.49 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.669 0.787 . . . . 0.0 111.989 176.651 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 48.0 t -62.71 -40.48 97.27 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 123.914 0.886 . . . . 0.0 111.838 172.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 88.2 mtp -60.63 -41.69 95.38 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.9 0.88 . . . . 0.0 112.075 172.657 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 43.2 mm-40 -66.82 -30.32 70.48 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 173.617 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 80.3 m-20 -69.8 -39.95 76.24 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 119.702 1.137 . . . . 0.0 112.075 172.601 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -60.98 -47.99 83.89 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 121.631 -0.668 . . . . 0.0 111.959 169.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 33.0 t30 -55.45 -44.54 76.45 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.616 0.766 . . . . 0.0 111.805 173.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 96.0 m -61.49 -46.8 88.48 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.207 1.003 . . . . 0.0 111.884 177.358 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 50.7 ttp -56.75 -52.91 63.18 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.1 0.96 . . . . 0.0 112.439 177.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -67.16 -39.48 86.5 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.744 -0.597 . . . . 0.0 112.139 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 96.8 m -64.32 -47.89 77.69 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.951 0.9 . . . . 0.0 112.013 178.769 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.3 p30 -63.72 -30.66 71.73 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 118.814 0.734 . . . . 0.0 112.382 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 67.4 m -64.25 -42.24 96.59 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.279 1.031 . . . . 0.0 112.54 172.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 15.0 m-85 -68.23 -29.75 68.64 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 177.704 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 88.1 mt -69.73 -56.34 11.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 123.331 0.652 . . . . 0.0 110.557 176.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 57.4 t80 -70.49 -38.43 74.37 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 114.595 1.332 . . . . 0.0 114.595 -172.004 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 59.9 m-80 -97.36 159.26 15.02 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.262 1.025 . . . . 0.0 111.939 -175.103 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -68.85 150.55 97.59 Favored Pre-proline 0 N--CA 1.473 0.676 0 O-C-N 121.299 -0.875 . . . . 0.0 109.721 173.282 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -65.66 -1.75 5.35 Favored 'Trans proline' 0 CA--C 1.546 1.115 0 C-N-CA 123.854 3.036 . . . . 0.0 114.722 -179.119 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 56.2 p -120.88 -0.33 10.13 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 126.947 2.099 . . . . 0.0 113.198 -179.301 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -66.75 145.77 55.17 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.601 -0.687 . . . . 0.0 110.805 170.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -56.45 -45.42 80.85 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.445 -0.784 . . . . 0.0 112.441 -176.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.6 tp -55.7 -29.93 26.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 124.955 1.302 . . . . 0.0 114.171 177.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 42.3 t -72.81 -45.97 54.65 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 O-C-N 121.314 -0.866 . . . . 0.0 110.519 173.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 68.5 mt -61.44 -36.76 81.27 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 119.137 0.88 . . . . 0.0 111.675 176.231 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 11.5 mtt -59.39 -52.48 65.42 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.581 1.152 . . . . 0.0 111.994 169.72 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -59.56 -40.26 86.73 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.589 0.755 . . . . 0.0 112.431 177.165 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -61.21 -50.39 73.3 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.977 0.911 . . . . 0.0 111.745 174.437 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -63.07 -40.0 96.38 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.434 0.693 . . . . 0.0 112.823 179.573 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 73.7 mt -65.53 -46.88 77.86 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.485 0.714 . . . . 0.0 111.72 172.167 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -62.78 -37.4 86.5 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.11 -0.994 . . . . 0.0 112.908 -177.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 23.5 mmmt -55.79 -41.82 74.66 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.234 1.014 . . . . 0.0 112.214 172.175 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 78.2 mt -78.18 -39.06 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 C-N-CA 123.921 0.888 . . . . 0.0 111.288 178.386 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 31.9 t80 -50.85 -51.99 45.82 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.53 -0.731 . . . . 0.0 110.302 172.08 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.9 mt -62.53 -41.8 99.11 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 178.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -67.64 -30.15 69.64 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 119.885 1.221 . . . . 0.0 112.664 179.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 69.8 mmtt -76.65 -50.18 14.37 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 117.646 -1.168 . . . . 0.0 112.505 175.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 6.6 m -66.71 -25.34 34.56 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 CA-C-N 121.084 1.765 . . . . 0.0 112.329 178.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -58.93 -28.25 66.05 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 171.284 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 95.0 mm-40 -95.95 -4.73 42.82 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.07 1.348 . . . . 0.0 112.925 177.129 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 41.6 ttp -64.96 137.3 97.11 Favored Pre-proline 0 CA--C 1.545 0.779 0 O-C-N 121.402 -0.811 . . . . 0.0 109.994 169.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -67.85 131.3 23.74 Favored 'Trans proline' 0 CA--C 1.535 0.538 0 C-N-CA 122.642 2.228 . . . . 0.0 110.72 178.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 83.0 mt-30 -70.35 -24.95 63.07 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -76.72 154.82 33.76 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.187 0.995 . . . . 0.0 112.469 169.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -132.4 133.22 43.65 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.363 1.065 . . . . 0.0 110.827 -172.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 7.8 p -150.47 142.73 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 124.678 1.191 . . . . 0.0 111.56 -177.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -65.11 142.3 58.42 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-O 121.554 0.692 . . . . 0.0 111.179 171.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . 0.465 HD11 ' HB2' ' A' ' 40' ' ' GLN . 98.6 mt . . . . . 0 CA--C 1.543 0.699 0 N-CA-C 113.882 1.067 . . . . 0.0 113.882 -178.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.001 0 CA-C-O 121.109 0.283 . . . . 0.0 113.705 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 12.4 ptm180 -163.34 162.05 24.85 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 126.602 1.961 . . . . 0.0 110.974 172.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 47.8 pttt -61.48 142.4 57.04 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 170.299 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 69.7 p -148.22 165.34 31.23 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 126.763 2.025 . . . . 0.0 110.895 179.661 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 19.7 p-10 -51.41 -35.37 38.8 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 114.561 1.319 . . . . 0.0 114.561 175.781 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -69.37 -50.64 44.3 Favored 'General case' 0 CA--C 1.531 0.243 0 O-C-N 121.899 -0.501 . . . . 0.0 110.531 178.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 86.9 mt -61.44 -34.88 76.16 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.983 0.913 . . . . 0.0 112.052 175.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.5 ' HB2' HD11 ' A' ' 147' ' ' LEU . 7.5 tp60 -59.41 -52.73 64.35 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.253 1.021 . . . . 0.0 111.516 171.736 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 73.3 t80 -55.04 -42.54 72.8 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.128 0.971 . . . . 0.0 112.269 177.019 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.413 ' HG3' ' HB1' ' A' ' 98' ' ' ALA . 96.0 mmm -58.27 -51.11 71.15 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.291 0.636 . . . . 0.0 112.615 174.865 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -79.33 -15.02 58.6 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 114.952 1.464 . . . . 0.0 114.952 179.455 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 35.5 m-20 -103.52 -19.5 14.36 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 119.644 1.111 . . . . 0.0 113.902 -174.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 39.3 t -133.64 -48.55 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 123.926 0.89 . . . . 0.0 111.506 -178.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.424 HG22 ' HB3' ' A' ' 136' ' ' LYS . 19.9 t -72.3 -64.42 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 CA-C-N 119.015 0.825 . . . . 0.0 110.908 -171.865 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 86.5 t -57.06 -43.3 80.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 124.098 0.959 . . . . 0.0 109.939 171.335 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 12.2 tppt? -58.89 -34.48 71.7 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.195 0.998 . . . . 0.0 113.341 -178.328 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 78.1 m -84.01 -42.97 15.64 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 118.716 0.689 . . . . 0.0 111.555 175.673 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 67.9 mt -61.85 -33.04 73.44 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.567 0.747 . . . . 0.0 112.313 177.693 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 19.8 t-105 -74.71 -28.73 60.93 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.782 1.633 . . . . 0.0 113.303 175.335 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 32.5 mtmm -74.71 -13.55 60.63 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 114.001 1.112 . . . . 0.0 114.001 171.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 36.1 t-80 -61.92 154.5 26.11 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.386 1.075 . . . . 0.0 113.507 -175.141 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 65.4 mt-30 -59.87 -18.27 43.13 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.345 1.458 . . . . 0.0 114.148 176.019 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -126.36 20.51 7.38 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.372 1.469 . . . . 0.0 113.882 -174.221 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.1 -28.08 65.11 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 113.774 1.028 . . . . 0.0 113.774 175.177 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . 0.408 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 49.7 p-90 -57.89 -37.14 52.56 Favored Pre-proline 0 CA--C 1.548 0.878 0 N-CA-C 117.689 2.477 . . . . 0.0 117.689 -170.171 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.408 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 87.4 Cg_endo -73.02 -5.32 16.99 Favored 'Trans proline' 0 CA--C 1.542 0.924 0 CA-C-N 123.048 2.124 . . . . 0.0 113.925 173.606 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 72.0 m-85 -109.01 -4.87 16.33 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.312 1.445 . . . . 0.0 113.135 178.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -61.97 -18.24 59.73 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 114.327 1.232 . . . . 0.0 114.327 179.388 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -141.44 154.41 66.87 Favored Pre-proline 0 CA--C 1.544 0.718 0 C-N-CA 125.995 1.718 . . . . 0.0 110.348 179.36 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -67.67 150.19 79.37 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 122.755 2.303 . . . . 0.0 112.626 176.732 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 89.2 t -62.59 142.24 16.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 123.892 0.877 . . . . 0.0 110.904 171.375 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -125.06 96.0 4.7 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.467 1.507 . . . . 0.0 109.767 174.214 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.8 -29.18 59.29 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -178.15 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 85.3 mt -64.88 -49.04 81.8 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 124.652 1.181 . . . . 0.0 110.831 173.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -68.19 -42.05 80.5 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.092 1.357 . . . . 0.0 112.731 -179.501 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.6 mp -78.79 -5.15 52.61 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 124.418 1.087 . . . . 0.0 113.231 176.274 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 61.5 t30 55.34 53.67 9.63 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.213 1.805 . . . . 0.0 113.647 -179.224 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 25.7 mt -113.43 86.39 10.0 Favored Pre-proline 0 CA--C 1.544 0.715 0 C-N-CA 126.285 1.834 . . . . 0.0 110.094 -177.374 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_endo -67.82 -4.1 11.66 Favored 'Trans proline' 0 CA--C 1.543 0.965 0 C-N-CA 123.548 2.832 . . . . 0.0 113.247 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 16.9 p-10 -123.7 1.25 8.8 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 127.35 2.26 . . . . 0.0 114.277 -178.436 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -54.42 -51.1 65.97 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 120.288 1.404 . . . . 0.0 112.034 178.056 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 99.7 m-70 -77.26 1.99 16.95 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.607 1.563 . . . . 0.0 114.281 177.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.6 mmtp -95.92 -42.55 8.24 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.835 1.254 . . . . 0.0 110.553 177.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.9 mp -76.59 -48.33 26.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 C-N-CA 124.05 0.94 . . . . 0.0 110.279 171.357 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 36.6 mm -96.3 128.7 47.25 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 124.318 1.047 . . . . 0.0 111.35 -177.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -95.86 -37.86 10.54 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.831 1.252 . . . . 0.0 111.588 -178.597 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 42.2 m-20 -130.13 78.73 74.17 Favored Pre-proline 0 CA--C 1.547 0.863 0 C-N-CA 125.421 1.488 . . . . 0.0 109.963 -173.063 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -71.13 143.96 45.65 Favored 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 123.948 3.099 . . . . 0.0 111.6 -179.514 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 8.5 tpt -156.88 141.09 16.47 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.316 1.046 . . . . 0.0 111.875 -171.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -148.99 150.8 33.45 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 125.765 1.626 . . . . 0.0 112.409 -175.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 7.0 ttp -59.04 -36.84 75.68 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.893 1.277 . . . . 0.0 113.77 -171.355 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -59.99 -21.27 55.62 Favored Glycine 0 CA--C 1.533 1.183 0 C-N-CA 125.591 1.567 . . . . 0.0 114.739 175.025 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 35.1 m -90.18 -42.04 11.27 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.724 0.81 . . . . 0.0 111.196 173.367 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 66.4 mt -56.15 -48.28 79.43 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 124.215 1.006 . . . . 0.0 111.407 -178.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.78 -33.59 66.78 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 178.531 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 2.5 tppp? -74.31 -41.89 60.41 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.483 1.113 . . . . 0.0 112.362 -178.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 4.6 ptp180 -71.52 -30.9 66.46 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 172.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 23.7 mt -61.31 -39.16 89.47 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.292 0.951 . . . . 0.0 113.404 169.547 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -67.58 -13.13 61.8 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 115.354 1.613 . . . . 0.0 115.354 -174.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -132.67 175.36 9.39 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.426 1.49 . . . . 0.0 113.727 -178.357 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -77.69 80.84 4.14 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 125.0 1.32 . . . . 0.0 111.999 -178.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 49.3 t80 -114.79 -36.5 4.48 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.815 1.246 . . . . 0.0 113.097 -175.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -137.92 169.95 16.9 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 127.431 2.292 . . . . 0.0 110.925 171.769 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.1 t-105 -102.19 -23.84 13.99 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.675 1.19 . . . . 0.0 112.763 -175.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 35.3 t -139.34 146.51 40.36 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.897 1.279 . . . . 0.0 111.003 177.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . 0.413 ' HB1' ' HG3' ' A' ' 42' ' ' MET . . . -59.74 -13.99 12.49 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.789 2.036 . . . . 0.0 115.133 176.14 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 53.5 p -52.23 -33.0 39.33 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 120.564 1.529 . . . . 0.0 113.353 172.503 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -74.86 -39.56 61.49 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.608 1.163 . . . . 0.0 112.479 176.412 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -71.89 -31.05 66.03 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 124.142 0.977 . . . . 0.0 112.391 178.157 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 86.2 mtp -62.18 -40.72 96.98 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 125.114 1.365 . . . . 0.0 111.875 170.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -66.31 -31.08 71.65 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 174.658 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -67.85 -42.77 80.86 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 119.42 1.009 . . . . 0.0 111.659 170.439 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -59.96 -44.7 94.27 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 121.072 -1.018 . . . . 0.0 112.646 171.818 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 19.3 t30 -57.45 -44.58 84.87 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 121.57 -0.706 . . . . 0.0 111.656 172.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 63.7 m -65.66 -35.76 81.71 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.333 1.053 . . . . 0.0 112.528 178.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 16.5 ttm -58.89 -60.27 4.13 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.982 0.913 . . . . 0.0 111.475 173.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -63.63 -38.58 91.65 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 122.612 0.365 . . . . 0.0 111.781 -177.684 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 72.9 m -64.8 -47.85 76.58 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.377 0.671 . . . . 0.0 112.133 178.036 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -64.64 -30.98 72.01 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 120.155 1.343 . . . . 0.0 112.406 178.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 85.5 m -62.35 -45.98 90.75 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.356 0.662 . . . . 0.0 112.229 170.072 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -66.12 -34.45 78.08 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 177.126 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 77.4 mt -69.78 -57.6 7.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 C-N-CA 123.407 0.683 . . . . 0.0 110.782 177.583 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 48.7 t80 -69.45 -26.71 64.73 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -171.069 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 46.0 m-80 -114.76 161.04 18.7 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.091 0.956 . . . . 0.0 112.45 -171.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -66.26 146.01 99.01 Favored Pre-proline 0 N--CA 1.473 0.695 0 C-N-CA 124.228 1.011 . . . . 0.0 110.341 176.398 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -65.89 -7.84 17.99 Favored 'Trans proline' 0 CA--C 1.542 0.924 0 C-N-CA 123.659 2.906 . . . . 0.0 114.595 -175.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 56.8 p -115.26 0.96 13.67 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 126.703 2.001 . . . . 0.0 113.175 179.133 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -65.83 148.0 52.47 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 121.476 -0.765 . . . . 0.0 110.844 172.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -51.55 -49.55 61.78 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 123.417 0.687 . . . . 0.0 112.203 178.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 9.7 tp -57.28 -30.14 34.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 -179.221 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 42.7 t -73.15 -47.08 48.76 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 O-C-N 121.515 -0.74 . . . . 0.0 110.588 173.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 80.3 mt -61.29 -37.39 83.01 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 119.11 0.868 . . . . 0.0 111.649 176.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 8.8 mtt -59.12 -51.14 71.32 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.993 1.317 . . . . 0.0 111.915 169.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.09 -39.67 86.93 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 176.196 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -62.49 -45.32 93.54 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 119.502 1.046 . . . . 0.0 111.872 174.094 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -66.57 -29.61 69.72 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.304 1.042 . . . . 0.0 113.724 179.637 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 80.4 mt -78.05 -47.61 17.99 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.976 0.91 . . . . 0.0 111.65 169.91 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -62.1 -38.65 89.69 Favored 'General case' 0 N--CA 1.468 0.45 0 O-C-N 121.05 -1.032 . . . . 0.0 113.128 -174.486 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 19.7 pttp -58.26 -42.88 87.44 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 118.783 0.72 . . . . 0.0 111.874 176.179 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 77.0 mt -67.74 -46.49 82.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 C-N-CA 124.3 1.04 . . . . 0.0 110.743 176.073 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 44.8 t80 -50.94 -50.63 57.44 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.142 0.883 . . . . 0.0 111.237 173.753 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.1 mt -62.98 -41.21 99.5 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 179.151 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -61.43 -37.96 85.41 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 119.409 1.004 . . . . 0.0 112.955 173.154 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . 0.424 ' HB3' HG22 ' A' ' 46' ' ' VAL . 71.6 mmtt -72.47 -49.5 32.79 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.175 0.99 . . . . 0.0 112.616 179.709 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 7.1 m -69.21 -25.79 30.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 CA-C-N 119.955 1.252 . . . . 0.0 112.126 177.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -59.37 -31.02 68.83 Favored 'General case' 0 CA--C 1.541 0.596 0 O-C-N 121.607 -0.683 . . . . 0.0 112.208 171.377 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 29.1 mm100 -97.0 3.84 51.79 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.239 1.415 . . . . 0.0 113.106 177.729 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 9.6 ttm -54.26 140.89 53.32 Favored Pre-proline 0 CA--C 1.546 0.826 0 C-N-CA 124.642 1.177 . . . . 0.0 112.164 174.392 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -68.82 112.62 2.95 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 122.901 2.401 . . . . 0.0 109.008 168.184 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -68.81 -20.13 64.31 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 -173.654 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -82.41 157.7 23.59 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.547 1.539 . . . . 0.0 112.269 176.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -117.65 128.22 54.71 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.608 1.563 . . . . 0.0 110.865 -174.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 63.4 t -141.88 135.07 29.1 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 126.472 1.909 . . . . 0.0 109.901 -171.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -70.55 131.29 43.76 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.534 1.534 . . . . 0.0 112.404 175.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . 0.5 HD11 ' HB2' ' A' ' 40' ' ' GLN . 93.9 mt . . . . . 0 N--CA 1.474 0.767 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 177.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.164 0 N-CA-C 112.165 -0.374 . . . . 0.0 112.165 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 7.2 ptp180 -160.1 165.46 31.7 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 126.072 1.749 . . . . 0.0 110.44 178.881 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.0 ttpt -75.4 132.52 40.94 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 166.352 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 66.6 p -124.85 170.14 11.35 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 126.115 1.766 . . . . 0.0 108.829 177.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 23.8 p-10 -52.03 -32.09 32.71 Favored 'General case' 0 N--CA 1.475 0.819 0 O-C-N 121.161 -0.962 . . . . 0.0 113.349 173.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.9 mm-40 -70.7 -53.44 15.63 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 123.846 0.859 . . . . 0.0 111.745 177.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.8 mt -64.25 -32.75 74.46 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.067 0.848 . . . . 0.0 112.551 176.657 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 22.8 tt0 -59.65 -50.22 74.71 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.144 0.977 . . . . 0.0 111.146 170.126 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 62.5 t80 -57.83 -40.9 81.13 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.625 0.77 . . . . 0.0 112.376 176.63 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 82.0 mmm -56.64 -52.44 64.86 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 122.765 0.426 . . . . 0.0 112.007 174.106 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -78.24 -18.1 55.82 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 -178.837 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 42.3 m-20 -99.47 -21.56 15.9 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.594 0.961 . . . . 0.0 113.594 -173.241 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 29.3 t -135.89 -48.45 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 CA-C-O 118.511 -0.757 . . . . 0.0 111.915 -177.898 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 18.4 t -68.23 -63.67 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 CA-C-N 119.151 0.887 . . . . 0.0 110.669 -173.811 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 81.7 t -57.83 -47.13 86.83 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 C-N-CA 124.454 1.101 . . . . 0.0 110.13 173.348 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -57.41 -44.09 84.32 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 118.682 0.674 . . . . 0.0 112.703 -176.341 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 48.1 m -69.87 -46.72 64.9 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 121.977 -0.452 . . . . 0.0 111.654 176.856 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 66.7 mt -61.63 -33.46 73.97 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.236 0.614 . . . . 0.0 112.157 178.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 24.0 t-105 -71.29 -29.36 64.96 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.88 1.672 . . . . 0.0 113.413 176.013 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 54.2 mtmt -83.83 -8.34 59.24 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.066 0.947 . . . . 0.0 113.503 177.442 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 43.2 t-80 -62.69 154.67 28.64 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.719 1.208 . . . . 0.0 113.152 -178.249 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -60.29 -17.14 40.45 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.307 1.443 . . . . 0.0 114.176 174.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -124.14 15.24 9.13 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.735 1.614 . . . . 0.0 113.984 -174.562 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.82 -30.2 67.66 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.802 1.241 . . . . 0.0 114.14 178.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . 0.428 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 38.6 p-90 -56.26 -37.85 61.95 Favored Pre-proline 0 CA--C 1.548 0.9 0 N-CA-C 117.466 2.395 . . . . 0.0 117.466 -170.471 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.428 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 72.1 Cg_endo -72.05 -5.71 17.65 Favored 'Trans proline' 0 CA--C 1.544 0.976 0 CA-C-N 123.164 2.166 . . . . 0.0 114.179 173.434 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -108.91 -4.83 16.46 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.352 1.461 . . . . 0.0 113.057 178.323 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 21.3 m-30 -64.29 -16.17 61.63 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 113.927 1.084 . . . . 0.0 113.927 176.107 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -143.37 158.61 57.42 Favored Pre-proline 0 CA--C 1.546 0.826 0 C-N-CA 126.437 1.895 . . . . 0.0 110.726 -177.123 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -64.81 157.67 55.05 Favored 'Trans proline' 0 CA--C 1.536 0.6 0 C-N-CA 123.052 2.501 . . . . 0.0 112.75 175.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 36.0 t -75.71 87.3 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 C-N-CA 124.679 1.192 . . . . 0.0 109.434 174.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 58.4 m-20 -69.87 85.81 0.5 Allowed 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.837 1.255 . . . . 0.0 111.78 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.3 -28.24 27.19 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.913 1.285 . . . . 0.0 114.128 178.621 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 82.7 mt -66.44 -49.89 71.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 125.177 1.391 . . . . 0.0 111.152 173.265 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -66.69 -38.63 87.18 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.93 1.292 . . . . 0.0 112.543 178.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 84.7 mt -85.24 -5.29 59.33 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 126.439 1.896 . . . . 0.0 113.205 -178.118 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 51.37 54.88 10.32 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.907 1.683 . . . . 0.0 113.174 -176.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 45.0 mt -114.41 81.5 6.79 Favored Pre-proline 0 N--CA 1.474 0.742 0 C-N-CA 125.803 1.641 . . . . 0.0 110.676 -179.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -66.57 -14.14 42.79 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 123.423 2.748 . . . . 0.0 113.583 -175.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 34.4 m-20 -106.95 5.07 27.89 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.615 1.566 . . . . 0.0 113.269 177.005 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -53.54 -51.65 62.22 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 120.321 1.419 . . . . 0.0 112.788 -175.244 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -76.8 -16.05 59.56 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.857 1.263 . . . . 0.0 113.839 -179.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 9.4 mptt -68.37 -42.22 79.48 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.875 0.87 . . . . 0.0 110.363 174.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.9 mp -81.1 -55.34 8.37 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 C-N-CA 124.534 1.133 . . . . 0.0 110.431 173.637 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 50.5 mm -85.44 100.69 8.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 CA-C-O 122.322 1.058 . . . . 0.0 111.295 -176.386 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -66.93 -29.38 69.23 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 126.121 1.769 . . . . 0.0 114.091 179.328 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -145.51 78.34 12.06 Favored Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 125.689 1.596 . . . . 0.0 110.909 -171.349 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -68.66 149.67 73.85 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 124.157 3.238 . . . . 0.0 112.087 -178.441 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 8.7 tpt -158.22 148.83 20.46 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.771 1.228 . . . . 0.0 111.1 -171.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -152.75 152.08 31.24 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.069 1.348 . . . . 0.0 112.278 178.774 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 6.6 ttp -60.24 -33.73 72.69 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.632 1.173 . . . . 0.0 112.477 -176.541 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -61.52 -23.52 62.82 Favored Glycine 0 CA--C 1.536 1.397 0 C-N-CA 125.734 1.635 . . . . 0.0 114.769 172.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 93.3 m -93.98 -38.95 10.91 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 118.363 1.081 . . . . 0.0 111.387 172.079 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 89.9 mt -53.07 -50.03 47.27 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 CA-C-N 119.69 1.132 . . . . 0.0 111.108 176.462 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -57.89 -35.78 71.49 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 176.414 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 22.5 ttmm -70.86 -38.51 73.13 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.229 1.012 . . . . 0.0 113.208 -177.842 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -72.78 -30.48 64.14 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-N 119.122 0.874 . . . . 0.0 113.189 171.062 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 48.8 mt -63.7 -39.09 93.45 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-N 119.744 1.156 . . . . 0.0 113.243 168.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -77.52 14.42 1.0 Allowed 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.88 1.272 . . . . 0.0 113.732 176.685 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 32.6 m-80 -137.08 167.51 21.39 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 127.006 2.122 . . . . 0.0 111.317 177.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -75.94 37.0 0.15 Allowed 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 125.514 1.526 . . . . 0.0 111.952 173.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 30.0 t80 -70.82 -31.03 67.64 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 120.438 -1.413 . . . . 0.0 113.324 -169.254 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -144.12 -178.31 5.88 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 127.127 2.171 . . . . 0.0 110.389 175.196 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 6.6 t-105 -113.99 -25.17 8.68 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.565 1.146 . . . . 0.0 111.485 177.002 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.1 m -130.27 136.45 49.19 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.165 1.386 . . . . 0.0 111.775 -168.493 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -66.24 -16.48 64.04 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 115.669 1.729 . . . . 0.0 115.669 -173.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 16.5 m -53.76 -32.31 51.81 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.381 0.991 . . . . 0.0 112.909 175.089 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -69.87 -44.13 70.44 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.822 0.849 . . . . 0.0 112.442 175.632 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 43.4 t -61.72 -37.55 84.62 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.165 0.986 . . . . 0.0 112.466 171.277 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 83.2 mtp -65.96 -40.04 90.95 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.037 0.935 . . . . 0.0 112.155 176.395 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -63.44 -36.31 83.32 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 112.716 0.635 . . . . 0.0 112.716 170.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 91.8 m-20 -65.47 -43.67 89.57 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 119.445 1.02 . . . . 0.0 112.12 173.29 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -57.72 -45.78 85.29 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 121.374 -0.829 . . . . 0.0 112.445 171.482 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 13.6 t30 -55.92 -52.43 64.15 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.385 0.674 . . . . 0.0 111.779 174.293 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 53.5 m -57.86 -43.43 85.96 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.831 0.852 . . . . 0.0 112.476 178.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 53.2 ttp -56.72 -53.42 57.92 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 118.996 0.817 . . . . 0.0 112.9 177.407 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -69.25 -35.54 76.22 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 179.689 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.7 m -58.75 -49.96 75.68 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.372 1.069 . . . . 0.0 111.983 172.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -57.86 -38.72 76.22 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.316 0.646 . . . . 0.0 112.108 -178.335 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 24.0 m -56.1 -42.22 76.46 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.027 0.931 . . . . 0.0 112.707 172.612 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 7.0 m-85 -71.18 -29.34 65.06 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 176.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 79.3 mt -75.26 -57.75 5.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 123.617 0.767 . . . . 0.0 110.654 179.546 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -71.44 -27.06 63.02 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 114.362 1.245 . . . . 0.0 114.362 -171.739 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 36.6 m-80 -113.1 161.68 16.82 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.591 1.156 . . . . 0.0 111.729 -173.1 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -71.82 151.45 93.19 Favored Pre-proline 0 N--CA 1.471 0.621 0 C-N-CA 123.998 0.919 . . . . 0.0 109.79 176.557 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -65.38 -1.03 4.07 Favored 'Trans proline' 0 CA--C 1.547 1.134 0 C-N-CA 123.763 2.976 . . . . 0.0 114.691 -179.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 53.8 p -118.8 -2.28 10.92 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 127.176 2.191 . . . . 0.0 113.167 -179.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 58.4 m-20 -68.56 145.87 53.59 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 118.929 0.786 . . . . 0.0 110.804 170.598 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -56.74 -45.1 82.2 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.413 -0.805 . . . . 0.0 112.589 -176.318 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.6 tp -55.88 -29.37 25.96 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 124.946 1.298 . . . . 0.0 114.214 178.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 37.3 t -71.07 -48.3 56.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 O-C-N 121.364 -0.835 . . . . 0.0 110.416 172.779 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 66.4 mt -61.41 -36.59 80.72 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 118.829 0.74 . . . . 0.0 111.697 177.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 10.8 mtt -58.93 -51.73 68.8 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 124.854 1.261 . . . . 0.0 112.048 170.153 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.82 -39.35 91.46 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.358 0.663 . . . . 0.0 112.681 176.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 90.1 mt-30 -61.51 -47.06 87.3 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 119.107 0.867 . . . . 0.0 111.817 174.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -63.16 -45.2 92.97 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 123.802 0.841 . . . . 0.0 112.512 178.112 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 81.7 mt -64.96 -45.02 87.43 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.742 0.817 . . . . 0.0 112.084 175.525 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -63.71 -37.46 87.43 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 121.093 -1.004 . . . . 0.0 112.751 -177.071 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -58.53 -40.03 81.81 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 121.399 -0.813 . . . . 0.0 112.272 172.377 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 78.5 mt -74.3 -40.92 50.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 C-N-CA 123.243 0.617 . . . . 0.0 111.349 177.086 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -51.16 -51.36 54.46 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.456 -0.778 . . . . 0.0 110.364 171.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 96.1 mt -62.92 -41.31 99.43 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 112.904 0.705 . . . . 0.0 112.904 177.581 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -67.16 -29.98 69.82 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 120.199 1.363 . . . . 0.0 112.845 -179.737 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 71.5 mmtt -74.86 -52.43 11.35 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.953 0.901 . . . . 0.0 112.285 174.34 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.8 m -65.96 -24.81 34.66 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 120.316 1.416 . . . . 0.0 112.151 179.126 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -61.84 -28.54 69.56 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 121.475 -0.765 . . . . 0.0 112.933 171.207 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -96.51 -3.34 43.39 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.462 1.505 . . . . 0.0 112.599 177.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 5.9 ttm -57.24 142.01 76.21 Favored Pre-proline 0 CA--C 1.548 0.898 0 C-N-CA 124.298 1.039 . . . . 0.0 110.727 169.686 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_endo -63.16 145.96 93.89 Favored 'Trans proline' 0 CA--C 1.537 0.675 0 C-N-CA 122.563 2.175 . . . . 0.0 110.252 169.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -77.75 -17.66 57.32 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 120.827 -1.171 . . . . 0.0 113.344 177.468 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -94.45 154.11 17.6 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.32 1.448 . . . . 0.0 112.605 -177.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -128.91 133.28 47.83 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.247 1.419 . . . . 0.0 111.335 -172.168 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 9.1 p -147.87 145.13 18.98 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 124.184 0.994 . . . . 0.0 112.914 -174.289 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -64.15 132.93 51.88 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.304 1.841 . . . . 0.0 111.684 171.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 92.8 mt . . . . . 0 CA--C 1.545 0.786 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 178.722 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.974 0 CA-C-O 121.081 0.267 . . . . 0.0 113.314 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.5 ptt180 -157.53 164.84 36.94 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.39 1.876 . . . . 0.0 110.601 174.019 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 8.3 mmmt -71.48 121.02 17.9 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.878 1.271 . . . . 0.0 111.419 170.259 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 34.3 p -135.02 160.01 39.67 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 125.027 1.331 . . . . 0.0 112.376 -179.254 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 36.1 t30 -53.69 -33.21 54.69 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.808 1.643 . . . . 0.0 114.53 174.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 70.1 mm-40 -62.93 -56.94 12.81 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.041 0.936 . . . . 0.0 111.148 170.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 89.8 mt -65.42 -31.37 72.43 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 179.306 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.47 ' HB2' HD11 ' A' ' 147' ' ' LEU . 21.9 tt0 -58.44 -55.25 37.4 Favored 'General case' 0 C--O 1.223 -0.298 0 C-N-CA 123.332 0.653 . . . . 0.0 110.082 169.693 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -57.29 -40.61 78.17 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 118.819 0.736 . . . . 0.0 112.305 -178.74 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 95.3 mmm -56.8 -52.36 65.35 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 121.856 -0.527 . . . . 0.0 112.373 172.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -83.64 -10.31 58.3 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 114.904 1.446 . . . . 0.0 114.904 -174.323 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -116.75 -18.6 10.21 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.477 1.511 . . . . 0.0 112.744 -170.069 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 10.9 t -133.03 -53.08 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 C-N-CA 123.574 0.75 . . . . 0.0 111.628 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.7 t -66.0 -63.99 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 CA-C-N 118.856 0.753 . . . . 0.0 110.599 -175.41 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 82.8 t -57.15 -47.59 83.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 124.022 0.929 . . . . 0.0 109.757 172.021 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.0 tptp -57.34 -43.12 83.16 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 113.442 0.904 . . . . 0.0 113.442 -171.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 91.2 m -77.67 -42.95 32.83 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 118.915 0.78 . . . . 0.0 112.556 174.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 79.7 mt -58.31 -30.85 66.99 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.397 0.998 . . . . 0.0 112.258 175.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 40.9 t-105 -75.77 -35.51 60.1 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 126.521 1.929 . . . . 0.0 114.129 179.171 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 21.6 pttp -88.93 -3.64 58.68 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 114.244 1.202 . . . . 0.0 114.244 178.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 60.1 t-80 -54.31 152.67 6.1 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.99 2.116 . . . . 0.0 113.318 173.088 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 22.8 tp60 -56.8 -21.39 28.44 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 126.158 1.783 . . . . 0.0 114.738 177.308 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -123.19 15.2 9.81 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.43 1.492 . . . . 0.0 114.077 -173.507 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.06 -27.39 62.65 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 114.444 1.276 . . . . 0.0 114.444 179.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . 0.401 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 38.0 p-90 -55.64 -37.14 53.72 Favored Pre-proline 0 CA--C 1.55 0.958 0 N-CA-C 117.725 2.491 . . . . 0.0 117.725 -170.853 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.401 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 85.5 Cg_endo -73.28 -5.49 17.24 Favored 'Trans proline' 0 CA--C 1.543 0.949 0 CA-C-N 123.249 2.196 . . . . 0.0 114.022 174.219 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 62.0 m-85 -107.47 -5.53 17.59 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.479 1.512 . . . . 0.0 112.918 179.086 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -64.29 -14.79 58.04 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.673 1.36 . . . . 0.0 114.673 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -138.87 153.98 72.4 Favored Pre-proline 0 CA--C 1.543 0.688 0 C-N-CA 125.597 1.559 . . . . 0.0 110.146 -179.377 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -65.41 149.11 88.4 Favored 'Trans proline' 0 CA--C 1.537 0.632 0 C-N-CA 122.595 2.197 . . . . 0.0 111.898 174.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 74.0 t -58.58 138.04 20.14 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 123.505 0.722 . . . . 0.0 110.991 171.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -128.7 106.62 9.06 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 125.547 1.539 . . . . 0.0 108.841 171.593 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.08 -28.0 64.16 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.276 1.03 . . . . 0.0 113.576 -178.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 79.7 mt -66.94 -50.91 60.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 124.751 1.22 . . . . 0.0 110.913 172.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 56.6 mttm -66.09 -39.33 89.9 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.771 1.228 . . . . 0.0 112.854 -177.587 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 55.3 mt -91.29 1.0 57.43 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.851 1.26 . . . . 0.0 113.745 179.624 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 65.0 t30 51.42 53.54 12.65 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 126.237 1.815 . . . . 0.0 113.768 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 36.0 mt -107.47 98.26 22.94 Favored Pre-proline 0 CA--C 1.544 0.718 0 C-N-CA 125.802 1.641 . . . . 0.0 109.769 -177.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -69.11 -10.55 29.4 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 122.984 2.456 . . . . 0.0 114.744 -171.318 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -139.95 17.54 2.47 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.261 1.424 . . . . 0.0 113.384 -173.337 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -47.99 -52.01 21.57 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-N 120.025 1.284 . . . . 0.0 113.729 -172.248 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -75.37 -9.62 58.72 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.166 1.387 . . . . 0.0 114.38 -178.7 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 29.4 mmmt -78.7 -44.85 22.63 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 121.229 -0.92 . . . . 0.0 110.59 174.337 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.3 mp -74.14 -45.35 48.13 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 124.111 0.964 . . . . 0.0 110.426 173.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 35.3 mm -101.24 109.97 26.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 CA-C-O 122.252 1.025 . . . . 0.0 111.896 -175.6 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.5 mptp? -79.49 -29.77 41.74 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.754 1.622 . . . . 0.0 113.0 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -138.06 85.1 19.65 Favored Pre-proline 0 CA--C 1.544 0.737 0 C-N-CA 125.207 1.403 . . . . 0.0 110.463 -178.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -73.15 144.89 38.28 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 123.529 2.82 . . . . 0.0 111.058 176.369 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.8 tpt -155.0 142.18 19.38 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.969 1.307 . . . . 0.0 110.508 -178.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 20.4 m-20 -146.36 150.44 35.69 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.639 1.576 . . . . 0.0 111.422 -175.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.9 ttp -61.13 -35.73 77.86 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.331 1.052 . . . . 0.0 112.743 -173.169 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -59.93 -21.86 56.5 Favored Glycine 0 CA--C 1.537 1.428 0 C-N-CA 125.625 1.583 . . . . 0.0 114.433 171.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 19.2 m -98.27 -34.08 10.84 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.208 1.403 . . . . 0.0 111.81 174.134 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 90.0 mt -55.36 -50.38 65.75 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 CA-C-N 119.538 1.063 . . . . 0.0 110.655 172.467 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -60.16 -37.04 78.94 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 113.218 0.822 . . . . 0.0 113.218 176.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.435 ' HE2' ' HA ' ' A' ' 88' ' ' LYS . 0.5 OUTLIER -62.09 -36.32 81.35 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.319 1.048 . . . . 0.0 113.008 -177.761 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 6.2 ptp180 -80.53 -32.35 36.8 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 173.83 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 65.0 mt -62.01 -32.1 72.55 Favored 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 114.447 1.277 . . . . 0.0 114.447 169.225 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -64.38 -12.23 40.64 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 114.745 1.387 . . . . 0.0 114.745 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 6.9 p30 -134.89 176.27 8.81 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.781 1.632 . . . . 0.0 112.851 177.033 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -78.03 44.94 0.5 Allowed 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 125.286 1.435 . . . . 0.0 113.126 -177.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 50.9 t80 -65.18 -30.69 71.62 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 121.278 -0.889 . . . . 0.0 112.977 -174.7 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -141.01 172.16 13.06 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 127.249 2.22 . . . . 0.0 111.479 176.796 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 15.8 t-105 -95.45 -22.25 17.81 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.42 1.088 . . . . 0.0 113.23 177.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 24.2 t -145.07 153.22 41.21 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.581 1.152 . . . . 0.0 113.448 -169.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -65.18 -21.24 66.74 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 116.285 1.957 . . . . 0.0 116.285 -175.442 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 15.2 m -58.84 -32.7 69.65 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 119.485 1.039 . . . . 0.0 113.24 -175.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -63.85 -44.07 94.24 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.408 -0.808 . . . . 0.0 112.17 173.601 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 50.5 t -64.21 -38.07 89.74 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.036 0.935 . . . . 0.0 112.117 175.143 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 78.3 mtp -62.43 -41.12 98.47 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.272 -0.892 . . . . 0.0 112.393 173.581 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -61.39 -39.65 91.46 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 112.27 0.471 . . . . 0.0 112.27 170.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -65.81 -39.85 91.3 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 118.963 0.801 . . . . 0.0 112.713 177.343 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 -60.05 -45.37 93.08 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 121.51 -0.744 . . . . 0.0 112.369 170.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 18.1 t30 -57.72 -46.81 83.9 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 121.875 -0.516 . . . . 0.0 112.023 174.628 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 93.1 m -65.36 -34.45 78.36 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.888 0.875 . . . . 0.0 112.764 177.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 50.9 ttp -61.21 -55.21 34.77 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 119.608 1.095 . . . . 0.0 111.844 174.495 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 24.0 m-85 -65.18 -38.36 90.24 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 122.004 -0.435 . . . . 0.0 111.977 179.536 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 88.6 m -64.69 -47.78 77.13 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 123.601 0.761 . . . . 0.0 112.397 179.009 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.1 p30 -64.67 -31.28 72.43 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 119.774 1.17 . . . . 0.0 112.568 -179.726 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 56.1 m -60.95 -44.24 97.57 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.542 0.737 . . . . 0.0 112.547 169.522 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -67.84 -31.32 71.07 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 113.736 1.013 . . . . 0.0 113.736 177.291 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 80.9 mt -72.17 -56.65 9.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 123.343 0.657 . . . . 0.0 110.617 177.042 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 41.9 t80 -67.31 -30.54 70.41 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 114.152 1.168 . . . . 0.0 114.152 -173.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -113.47 156.35 23.69 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.03 0.932 . . . . 0.0 112.361 -171.577 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 3.0 mppt? -67.43 148.68 98.64 Favored Pre-proline 0 N--CA 1.471 0.576 0 C-N-CA 124.684 1.194 . . . . 0.0 110.666 176.213 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -65.46 -7.23 15.42 Favored 'Trans proline' 0 CA--C 1.544 0.976 0 C-N-CA 123.749 2.966 . . . . 0.0 114.674 -176.243 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 43.5 p -108.55 -4.74 16.94 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 127.123 2.169 . . . . 0.0 113.268 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -67.79 146.55 53.61 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 118.883 0.765 . . . . 0.0 110.821 174.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -53.27 -47.76 68.85 Favored 'General case' 0 N--CA 1.469 0.519 0 O-C-N 121.59 -0.694 . . . . 0.0 112.258 179.097 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.2 tp -57.39 -30.03 34.79 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 C-N-CA 124.298 1.039 . . . . 0.0 113.786 -178.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 42.5 t -71.99 -48.52 49.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 O-C-N 121.535 -0.728 . . . . 0.0 110.442 174.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 79.8 mt -61.13 -36.96 81.16 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 118.978 0.808 . . . . 0.0 111.857 177.508 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 13.5 mtt -58.55 -52.73 64.43 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.919 1.288 . . . . 0.0 111.965 169.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.61 -38.75 88.76 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.464 0.706 . . . . 0.0 112.704 177.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -59.48 -51.11 71.27 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 119.229 0.922 . . . . 0.0 111.687 173.26 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.57 -43.28 99.19 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.752 0.821 . . . . 0.0 112.844 179.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 80.0 mt -62.95 -43.75 97.94 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.718 0.807 . . . . 0.0 111.748 173.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -60.9 -39.13 88.14 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 121.018 -1.051 . . . . 0.0 112.699 -179.111 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 7.2 mmpt? -61.69 -37.99 86.15 Favored 'General case' 0 N--CA 1.476 0.871 0 O-C-N 121.191 -0.943 . . . . 0.0 111.304 178.027 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 77.7 mt -74.41 -39.95 48.79 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 C-N-CA 123.685 0.794 . . . . 0.0 111.312 176.611 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -51.53 -51.36 55.95 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 118.943 0.792 . . . . 0.0 110.411 172.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 93.1 mt -63.67 -40.79 97.71 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 118.532 -0.747 . . . . 0.0 112.819 177.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -67.18 -32.69 73.95 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 120.327 1.421 . . . . 0.0 112.426 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 65.3 mmtt -71.23 -53.4 14.49 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.952 0.901 . . . . 0.0 111.753 175.49 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.4 m -65.48 -25.15 36.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 CA-C-N 120.326 1.421 . . . . 0.0 112.222 179.662 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -64.42 -34.9 79.26 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 171.588 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -84.3 -13.28 52.9 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.475 1.11 . . . . 0.0 113.087 173.532 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 48.0 ttp -61.62 141.97 94.6 Favored Pre-proline 0 CA--C 1.543 0.704 0 CA-C-N 119.262 0.937 . . . . 0.0 110.564 172.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -60.53 152.2 69.87 Favored 'Trans proline' 0 CA--C 1.538 0.705 0 C-N-CA 122.716 2.277 . . . . 0.0 111.205 172.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -88.8 -21.17 23.9 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 121.777 -0.577 . . . . 0.0 112.388 172.23 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -84.75 167.16 16.37 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.835 1.254 . . . . 0.0 112.396 172.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -137.13 146.76 45.42 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.76 1.224 . . . . 0.0 111.175 -176.848 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 8.2 p -144.16 145.18 21.99 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 C-N-CA 124.899 1.279 . . . . 0.0 110.437 176.344 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -69.38 137.92 53.23 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.429 0.692 . . . . 0.0 111.246 173.12 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . 0.47 HD11 ' HB2' ' A' ' 40' ' ' GLN . 83.4 mt . . . . . 0 CA--C 1.544 0.734 0 N-CA-C 113.886 1.069 . . . . 0.0 113.886 -175.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.998 0 CA-C-O 121.005 0.225 . . . . 0.0 113.251 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 8.0 ptm180 -164.63 165.44 21.01 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.761 2.025 . . . . 0.0 110.87 175.232 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 30.7 tttp -61.83 132.23 52.4 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.143 1.377 . . . . 0.0 110.938 173.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 48.9 p -139.38 165.04 28.26 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.967 1.707 . . . . 0.0 110.141 178.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 24.8 t30 -52.6 -32.49 41.69 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 175.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 63.4 mm-40 -60.68 -59.92 4.62 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.535 1.134 . . . . 0.0 111.616 169.663 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 94.5 mt -67.12 -32.21 73.2 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.215 1.006 . . . . 0.0 112.911 -177.297 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 -58.8 -51.34 70.42 Favored 'General case' 0 C--O 1.225 -0.225 0 C-N-CA 124.362 1.065 . . . . 0.0 110.223 170.031 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 49.8 t80 -58.07 -39.34 78.27 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 118.909 0.777 . . . . 0.0 112.347 178.366 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 89.0 mmm -57.08 -55.04 39.89 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 121.662 -0.649 . . . . 0.0 112.266 172.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -82.32 -4.44 57.23 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 115.108 1.521 . . . . 0.0 115.108 -175.2 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -117.21 -19.64 9.56 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.247 1.419 . . . . 0.0 112.778 -174.041 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.6 t -133.47 -52.72 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 CA-C-O 118.757 -0.64 . . . . 0.0 112.266 179.202 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.8 t -69.08 -67.71 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 CA-C-N 118.794 0.724 . . . . 0.0 110.848 -172.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 99.3 t -57.07 -46.11 84.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.928 1.291 . . . . 0.0 109.743 171.587 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 40.3 tptt -58.77 -22.22 57.56 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 114.301 1.222 . . . . 0.0 114.301 -176.233 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 34.2 m -99.43 -41.09 7.56 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.196 0.998 . . . . 0.0 113.151 172.717 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 62.3 mt -60.05 -28.95 68.2 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.257 0.935 . . . . 0.0 112.682 173.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 36.0 t-105 -79.04 -33.85 44.38 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 127.123 2.169 . . . . 0.0 113.843 178.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 61.2 pttt -86.56 -5.18 59.21 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 175.682 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 57.4 t-80 -54.28 152.53 6.19 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.507 1.923 . . . . 0.0 113.473 174.526 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 22.7 tp60 -56.83 -21.13 26.66 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 126.029 1.732 . . . . 0.0 114.676 176.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -124.35 19.66 8.91 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.409 1.484 . . . . 0.0 113.916 -175.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -74.0 -24.69 59.62 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 114.106 1.151 . . . . 0.0 114.106 175.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . 0.423 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 49.4 p-90 -57.17 -36.4 46.1 Favored Pre-proline 0 CA--C 1.548 0.876 0 N-CA-C 117.206 2.299 . . . . 0.0 117.206 -173.508 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.423 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 85.0 Cg_endo -74.82 0.02 9.33 Favored 'Trans proline' 0 CA--C 1.545 1.039 0 CA-C-N 123.013 2.112 . . . . 0.0 113.934 171.514 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -117.98 6.19 12.15 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.96 1.704 . . . . 0.0 113.321 -178.83 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 23.3 m-30 -72.31 -14.22 61.69 Favored 'General case' 0 CA--C 1.545 0.758 0 O-C-N 120.28 -1.512 . . . . 0.0 114.059 176.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 89.1 mt-30 -151.57 145.99 18.41 Favored Pre-proline 0 CA--C 1.544 0.724 0 C-N-CA 125.233 1.413 . . . . 0.0 110.536 -177.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -65.36 151.65 84.49 Favored 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 123.383 2.722 . . . . 0.0 112.765 -178.218 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 41.6 t -64.17 135.79 27.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 124.737 1.215 . . . . 0.0 111.071 -178.703 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 52.8 m-20 -112.71 92.41 4.01 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.925 1.29 . . . . 0.0 110.163 175.33 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.57 -27.42 38.79 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.286 1.034 . . . . 0.0 113.682 175.651 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 81.8 mt -65.71 -49.6 76.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 C-N-CA 125.392 1.477 . . . . 0.0 111.104 173.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -65.99 -38.92 89.73 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.48 1.112 . . . . 0.0 112.589 179.21 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 90.3 mt -87.35 -3.6 59.03 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.893 1.677 . . . . 0.0 113.518 -177.268 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 51.14 56.55 7.81 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 125.584 1.554 . . . . 0.0 113.01 -176.424 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 58.0 mt -113.87 78.36 4.05 Favored Pre-proline 0 CA--C 1.543 0.7 0 C-N-CA 126.157 1.783 . . . . 0.0 110.651 -179.811 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -66.28 -17.2 53.87 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 123.323 2.682 . . . . 0.0 113.101 -177.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 -100.35 7.13 44.52 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.884 1.674 . . . . 0.0 113.184 175.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 85.8 t80 -52.28 -57.62 9.16 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 120.015 1.28 . . . . 0.0 112.117 -177.474 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -74.81 -11.65 60.2 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.888 1.275 . . . . 0.0 114.33 179.606 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 10.1 mptt -72.7 -32.54 65.83 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 121.263 -0.898 . . . . 0.0 111.296 176.349 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.2 mp -99.07 -48.71 11.86 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 125.439 1.496 . . . . 0.0 111.088 175.003 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 28.0 mm -67.18 110.95 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 C-N-CA 123.66 0.784 . . . . 0.0 110.082 178.48 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -68.25 -44.87 74.65 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.972 0.909 . . . . 0.0 112.113 -178.441 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 71.5 m-80 -150.22 117.83 3.56 Favored Pre-proline 0 CA--C 1.546 0.789 0 C-N-CA 126.5 1.92 . . . . 0.0 109.075 173.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -74.24 146.95 36.76 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 123.116 2.544 . . . . 0.0 111.478 177.346 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.0 tpt -156.25 146.68 21.63 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.984 1.314 . . . . 0.0 110.52 176.678 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -152.11 153.22 33.48 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.258 1.423 . . . . 0.0 112.099 -171.881 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 2.7 ttp -64.74 -38.3 90.53 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.197 0.599 . . . . 0.0 112.456 -175.426 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -59.26 -34.09 78.49 Favored Glycine 0 CA--C 1.53 1.02 0 C-N-CA 124.63 1.11 . . . . 0.0 113.056 173.552 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 24.2 m -76.23 -47.17 24.91 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 117.868 0.834 . . . . 0.0 111.278 172.056 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 86.7 mt -52.66 -53.14 21.98 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.197 0 C-N-CA 124.568 1.147 . . . . 0.0 111.247 178.128 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.37 -30.42 71.24 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -178.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.402 ' HA ' ' HE3' ' A' ' 88' ' ' LYS . 0.1 OUTLIER -65.02 -40.0 94.21 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 117.712 -1.137 . . . . 0.0 113.413 171.012 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . 0.275 6.4 ptp180 -72.68 -30.03 63.9 Favored 'General case' 0 N--CA 1.484 1.24 0 CA-C-N 120.544 1.52 . . . . 0.0 114.135 172.712 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 86.9 mt -66.87 -36.14 81.63 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 119.763 1.165 . . . . 0.0 112.949 167.679 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 88.5 mt-10 -78.02 9.33 3.74 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.685 1.594 . . . . 0.0 113.704 178.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 38.8 m-80 -138.42 166.79 23.35 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 127.023 2.129 . . . . 0.0 111.788 179.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 13.9 p-10 -79.96 108.41 13.51 Favored 'General case' 0 CA--C 1.544 0.719 0 O-C-N 121.4 -0.813 . . . . 0.0 109.773 168.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 49.4 t80 -140.36 -46.26 0.42 Allowed 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -178.277 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -133.15 177.0 8.01 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.836 2.054 . . . . 0.0 111.625 178.427 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.3 t-105 -112.99 -21.86 10.89 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.898 1.279 . . . . 0.0 112.787 -177.598 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 28.2 t -138.07 142.95 40.27 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.046 -1.034 . . . . 0.0 112.337 -172.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -68.89 -13.55 62.49 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 115.316 1.599 . . . . 0.0 115.316 -173.647 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 23.2 m -55.45 -29.97 59.66 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 119.412 1.006 . . . . 0.0 112.775 173.873 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 40.0 mm-40 -72.5 -41.37 66.01 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.202 -0.936 . . . . 0.0 112.258 174.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 42.2 t -62.23 -38.24 88.45 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.025 0.93 . . . . 0.0 111.998 172.209 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 82.9 mtp -65.6 -40.67 92.92 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 124.124 0.969 . . . . 0.0 112.171 174.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 62.6 mt-30 -59.96 -44.5 94.39 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 122.895 0.478 . . . . 0.0 111.606 171.072 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -64.44 -38.56 91.46 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 118.797 0.726 . . . . 0.0 112.663 178.173 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -61.21 -45.04 96.22 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 121.265 -0.897 . . . . 0.0 112.357 170.002 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 33.2 t30 -59.22 -43.05 92.32 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 121.506 -0.747 . . . . 0.0 111.963 174.722 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 85.0 m -62.69 -39.51 94.21 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.192 0.997 . . . . 0.0 112.414 174.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 12.9 ttm -58.2 -60.88 3.07 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 119.485 1.039 . . . . 0.0 111.272 174.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -61.01 -41.0 95.68 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.035 0.534 . . . . 0.0 111.966 -177.506 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 77.3 m -64.46 -47.93 77.18 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.294 0.638 . . . . 0.0 112.083 178.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -64.7 -31.93 73.38 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 119.493 1.042 . . . . 0.0 112.643 -178.687 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 40.8 m -59.91 -43.7 94.73 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.906 0.883 . . . . 0.0 112.516 169.647 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -68.9 -29.17 67.39 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 179.106 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 86.1 mt -72.25 -57.47 7.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 123.256 0.622 . . . . 0.0 110.906 178.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -71.62 -35.03 70.32 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -171.221 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 59.5 m-80 -95.99 162.65 13.47 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.456 1.103 . . . . 0.0 111.733 -178.651 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -73.45 152.07 89.74 Favored Pre-proline 0 N--CA 1.474 0.764 0 O-C-N 121.261 -0.9 . . . . 0.0 110.426 170.545 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -65.87 -1.67 5.45 Favored 'Trans proline' 0 CA--C 1.544 1.019 0 C-N-CA 123.569 2.846 . . . . 0.0 114.922 -178.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 65.0 p -118.06 -0.62 11.58 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.703 2.001 . . . . 0.0 113.063 -179.609 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 58.5 m-20 -68.48 144.98 54.45 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 118.719 0.69 . . . . 0.0 110.709 170.791 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -55.87 -45.77 78.43 Favored 'General case' 0 N--CA 1.471 0.625 0 O-C-N 121.682 -0.636 . . . . 0.0 112.504 -175.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.5 tp -55.32 -30.4 25.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 124.918 1.287 . . . . 0.0 114.058 177.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 48.3 t -73.31 -46.56 49.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 O-C-N 121.427 -0.796 . . . . 0.0 110.582 174.06 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 72.4 mt -61.39 -37.15 82.39 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 119.103 0.865 . . . . 0.0 111.523 177.008 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 8.9 mtt -59.63 -51.21 70.77 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.963 1.305 . . . . 0.0 112.04 169.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.97 -38.75 87.03 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.387 0.675 . . . . 0.0 112.701 176.425 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 90.0 mt-30 -62.5 -45.51 92.69 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 119.329 0.968 . . . . 0.0 112.094 173.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.25 -44.28 96.91 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.543 0.737 . . . . 0.0 112.473 177.045 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 85.2 mt -65.4 -45.67 83.06 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.913 0.885 . . . . 0.0 112.042 174.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.94 -37.68 88.02 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.138 -0.976 . . . . 0.0 113.075 -176.502 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 55.7 mtmt -58.85 -46.16 88.37 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 121.744 -0.598 . . . . 0.0 111.727 172.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 89.6 mt -67.6 -43.9 86.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 123.429 0.692 . . . . 0.0 110.702 178.142 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 34.0 t80 -50.57 -51.09 51.42 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.851 0.861 . . . . 0.0 111.095 174.608 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 99.6 mt -64.0 -40.26 95.96 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 178.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 82.8 mm-40 -62.64 -37.25 85.6 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 119.42 1.009 . . . . 0.0 113.004 173.576 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 33.2 mmtm -70.99 -52.66 18.35 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.111 1.364 . . . . 0.0 111.47 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.5 m -67.44 -25.16 32.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 CA-C-N 119.603 1.092 . . . . 0.0 112.366 178.395 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -62.22 -30.4 71.06 Favored 'General case' 0 CA--C 1.54 0.582 0 O-C-N 121.573 -0.705 . . . . 0.0 112.703 172.043 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -88.77 -9.16 52.86 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.478 1.111 . . . . 0.0 112.844 174.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 40.1 ttp -67.26 145.2 98.55 Favored Pre-proline 0 CA--C 1.545 0.786 0 C-N-CA 124.074 0.95 . . . . 0.0 110.347 170.033 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -60.13 156.75 38.0 Favored 'Trans proline' 0 CA--C 1.539 0.737 0 C-N-CA 123.23 2.62 . . . . 0.0 111.63 170.159 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.25 -26.74 19.91 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.503 0.721 . . . . 0.0 112.893 172.152 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -85.7 170.38 12.56 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 126.254 1.822 . . . . 0.0 111.333 171.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -132.57 171.72 13.45 Favored 'General case' 0 CA--C 1.533 0.304 0 O-C-N 120.683 -1.261 . . . . 0.0 112.294 173.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 15.0 p -152.2 142.74 15.5 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 C-N-CA 124.033 0.933 . . . . 0.0 110.656 174.05 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -64.88 136.88 57.36 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.701 1.6 . . . . 0.0 111.686 173.615 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 59.8 mt . . . . . 0 N--CA 1.47 0.539 0 C-N-CA 124.069 0.947 . . . . 0.0 113.327 -174.054 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.119 0 CA-C-O 121.097 0.276 . . . . 0.0 113.59 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 32.3 ptt180 -163.23 159.55 22.94 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 126.739 2.016 . . . . 0.0 110.721 172.717 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.2 tttm -71.11 137.25 48.72 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.192 0.997 . . . . 0.0 111.244 174.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 76.0 p -144.44 167.24 22.96 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 125.817 1.647 . . . . 0.0 110.922 -175.319 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 25.5 p-10 -51.13 -36.01 38.53 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 113.51 0.929 . . . . 0.0 113.51 169.359 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.5 mm100 -64.67 -54.09 37.24 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.269 1.028 . . . . 0.0 110.762 178.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.1 mt -66.97 -34.36 77.59 Favored 'General case' 0 CA--C 1.537 0.442 0 N-CA-C 112.524 0.564 . . . . 0.0 112.524 178.647 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.1 tp60 -57.55 -53.86 53.42 Favored 'General case' 0 C--O 1.222 -0.354 0 C-N-CA 123.036 0.534 . . . . 0.0 110.498 169.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 60.5 t80 -56.58 -41.89 77.72 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.348 0.976 . . . . 0.0 112.626 179.701 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 94.8 mmm -57.62 -51.24 70.32 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.69 -0.631 . . . . 0.0 112.184 172.421 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -85.32 -5.29 59.32 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 -173.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 60.0 t30 -124.72 -14.48 6.75 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.764 1.626 . . . . 0.0 113.294 -171.549 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 21.4 t -133.15 -52.8 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 C-N-CA 123.192 0.597 . . . . 0.0 111.058 177.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.4 t -68.95 -65.63 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 123.34 0.656 . . . . 0.0 110.696 -174.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 89.9 t -57.8 -46.7 87.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 C-N-CA 124.093 0.957 . . . . 0.0 110.322 173.24 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 69.7 tttt -58.62 -39.19 79.8 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.357 0.663 . . . . 0.0 112.552 -174.734 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 40.9 m -78.03 -43.56 29.05 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 118.461 0.573 . . . . 0.0 112.212 175.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 62.8 mt -61.6 -33.32 73.69 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 118.821 0.737 . . . . 0.0 112.411 177.67 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 30.9 t-105 -71.27 -31.44 67.51 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.701 1.6 . . . . 0.0 113.346 176.12 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.7 mtmp? -80.49 -7.42 59.17 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 175.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 53.0 t-80 -63.56 152.94 37.28 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.701 1.2 . . . . 0.0 112.981 -179.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 99.9 mm-40 -61.54 -19.63 62.35 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.072 1.349 . . . . 0.0 114.394 177.299 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -117.85 13.06 14.0 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.34 1.456 . . . . 0.0 113.706 -176.289 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.14 -25.93 64.63 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.815 1.246 . . . . 0.0 114.12 177.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 69.2 p-90 -56.5 -35.49 35.77 Favored Pre-proline 0 CA--C 1.547 0.865 0 N-CA-C 118.113 2.635 . . . . 0.0 118.113 -169.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -78.71 -6.94 15.54 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 CA-C-N 123.33 2.225 . . . . 0.0 112.985 176.565 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 57.7 m-85 -103.09 -7.67 21.15 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.307 1.443 . . . . 0.0 112.382 179.311 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 20.3 m-30 -62.42 -17.61 59.67 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 114.559 1.318 . . . . 0.0 114.559 179.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 89.5 mt-30 -139.7 150.88 64.63 Favored Pre-proline 0 CA--C 1.544 0.727 0 C-N-CA 124.947 1.299 . . . . 0.0 111.127 -179.088 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -70.67 143.89 47.66 Favored 'Trans proline' 0 CA--C 1.537 0.645 0 C-N-CA 123.151 2.567 . . . . 0.0 112.672 178.397 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 63.8 t -64.64 145.32 13.99 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 C-N-CA 124.309 1.043 . . . . 0.0 110.56 169.152 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -130.04 109.51 10.91 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.315 1.446 . . . . 0.0 110.116 173.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.32 -29.12 60.86 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.478 1.111 . . . . 0.0 113.645 179.082 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 84.4 mt -66.33 -48.87 79.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 125.227 1.411 . . . . 0.0 110.882 174.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 45.9 mmtm -68.46 -39.16 81.54 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.767 1.227 . . . . 0.0 113.126 -178.707 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.5 mp -87.89 -3.97 58.88 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.611 1.164 . . . . 0.0 112.774 179.482 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 52.29 58.15 5.7 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 126.083 1.753 . . . . 0.0 113.243 -177.007 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 44.7 mt -115.63 82.67 10.33 Favored Pre-proline 0 CA--C 1.544 0.749 0 C-N-CA 126.135 1.774 . . . . 0.0 110.512 -177.157 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -67.04 -8.31 21.37 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 123.911 3.074 . . . . 0.0 114.108 -173.419 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 24.9 p-10 -116.02 2.58 13.48 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 127.566 2.346 . . . . 0.0 113.737 179.24 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 58.7 t80 -49.65 -50.68 42.28 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 119.933 1.242 . . . . 0.0 113.199 -175.167 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 99.7 m-70 -76.39 -18.47 58.85 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.878 1.271 . . . . 0.0 114.115 -178.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 10.7 mmpt? -69.7 -45.13 68.94 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.071 0.948 . . . . 0.0 110.563 174.654 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.6 mp -72.37 -51.71 27.83 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 C-N-CA 123.44 0.696 . . . . 0.0 109.929 171.241 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 37.7 mm -99.54 103.66 15.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 CA-C-O 122.586 1.184 . . . . 0.0 112.156 -171.774 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 40.3 mmtm -65.47 -32.91 74.78 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.318 1.447 . . . . 0.0 113.146 175.689 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -137.01 76.77 44.87 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 125.217 1.407 . . . . 0.0 111.561 -170.03 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -70.78 128.51 15.19 Favored 'Trans proline' 0 CA--C 1.537 0.658 0 C-N-CA 124.102 3.202 . . . . 0.0 111.052 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 17.7 tpp -155.41 140.99 17.9 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.078 1.751 . . . . 0.0 109.455 -173.461 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -141.26 148.34 39.68 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 127.561 2.344 . . . . 0.0 109.161 172.752 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 13.0 ttp -49.45 -33.11 13.34 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 115.341 1.608 . . . . 0.0 115.341 -170.077 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -57.49 -20.07 36.49 Favored Glycine 0 CA--C 1.538 1.502 0 C-N-CA 125.382 1.468 . . . . 0.0 115.271 173.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 28.7 m -85.58 -40.13 16.6 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.51 1.124 . . . . 0.0 111.694 172.743 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 34.5 mt -56.39 -49.5 76.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 C-N-CA 124.431 1.092 . . . . 0.0 110.945 -177.472 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -58.32 -33.74 69.82 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 178.352 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -70.73 -45.6 64.56 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.415 1.086 . . . . 0.0 112.214 -178.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 3.8 ptp180 -69.47 -26.87 64.79 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 113.76 1.022 . . . . 0.0 113.76 172.121 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 45.7 mt -68.97 -42.47 76.56 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 119.339 0.972 . . . . 0.0 113.344 168.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -71.73 -36.37 70.45 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.666 0.786 . . . . 0.0 112.83 178.231 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 -74.17 167.62 21.21 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.004 0.922 . . . . 0.0 111.43 169.251 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 61.3 t-20 -89.6 96.51 10.73 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 121.064 -1.022 . . . . 0.0 109.139 168.074 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 57.8 t80 -123.6 -25.61 4.32 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.317 1.047 . . . . 0.0 113.74 -178.313 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -145.61 179.97 7.07 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.737 1.215 . . . . 0.0 113.565 175.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 2.3 t-105 -113.0 -27.5 8.04 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 126.057 1.743 . . . . 0.0 112.361 -177.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 21.0 p -135.9 137.0 40.95 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 125.164 1.386 . . . . 0.0 112.688 -168.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -58.27 -19.88 37.86 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 115.588 1.699 . . . . 0.0 115.588 -178.308 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 11.1 m -56.2 -34.43 66.26 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 119.466 1.03 . . . . 0.0 113.173 176.305 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -67.0 -44.03 81.39 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.508 0.671 . . . . 0.0 111.437 173.447 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 1.9 m -66.53 -33.39 75.57 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 126.046 1.738 . . . . 0.0 112.279 178.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 76.0 mtp -68.25 -43.58 77.53 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 125.138 1.375 . . . . 0.0 112.376 172.209 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -63.49 -30.8 71.87 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 118.02 0.373 . . . . 0.0 111.704 176.206 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 93.2 m-20 -68.36 -44.04 76.11 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.727 0.811 . . . . 0.0 112.116 173.212 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -60.54 -45.1 95.11 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 118.936 0.789 . . . . 0.0 112.528 171.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 16.8 t30 -56.33 -45.98 80.09 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.241 0.617 . . . . 0.0 111.402 172.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 71.6 m -63.33 -33.36 75.37 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.462 1.105 . . . . 0.0 112.581 176.428 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 12.1 tmm? -68.99 -55.44 10.87 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 124.59 1.156 . . . . 0.0 111.906 -177.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 29.6 m-85 -62.58 -39.13 92.74 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.392 0.677 . . . . 0.0 112.423 173.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 97.0 m -66.08 -47.19 75.07 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 121.427 -0.796 . . . . 0.0 112.287 -179.662 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -62.98 -30.71 71.8 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 119.891 1.223 . . . . 0.0 112.479 179.473 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 92.1 m -63.45 -43.5 97.21 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.059 0.944 . . . . 0.0 112.54 170.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 15.2 m-30 -65.18 -35.76 82.1 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 175.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 77.6 mt -70.27 -56.83 9.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 C-N-CA 123.214 0.606 . . . . 0.0 110.923 -178.504 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.3 t80 -69.28 -32.5 71.71 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 114.087 1.143 . . . . 0.0 114.087 -172.198 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 60.2 m-80 -101.39 164.76 11.61 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.232 1.013 . . . . 0.0 112.546 -174.235 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -67.07 140.88 96.13 Favored Pre-proline 0 N--CA 1.472 0.659 0 C-N-CA 123.816 0.846 . . . . 0.0 109.831 173.538 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -67.48 -5.32 13.78 Favored 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 123.669 2.912 . . . . 0.0 114.634 -174.637 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 51.7 p -116.6 -0.29 12.45 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.573 1.949 . . . . 0.0 113.187 179.69 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -67.08 151.7 47.13 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 121.601 -0.687 . . . . 0.0 111.222 172.59 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -50.45 -49.88 53.78 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.499 0.719 . . . . 0.0 112.257 178.472 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.5 tp -56.55 -33.18 38.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 -176.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 54.6 t -71.25 -49.3 49.14 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 CA-C-O 118.868 -0.586 . . . . 0.0 110.583 173.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 76.0 mt -61.47 -37.06 82.24 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.499 1.045 . . . . 0.0 112.115 178.659 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 32.0 mtp -61.97 -48.57 79.77 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 126.027 1.731 . . . . 0.0 111.543 172.281 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.6 -39.72 92.23 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 173.319 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -63.66 -38.7 92.11 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 119.37 0.986 . . . . 0.0 112.696 175.273 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -66.4 -46.32 76.98 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.629 0.772 . . . . 0.0 111.874 175.311 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 86.6 mt -63.73 -44.43 93.58 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.186 0.994 . . . . 0.0 112.308 175.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -65.18 -37.06 86.17 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.045 -1.035 . . . . 0.0 113.056 -175.655 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 36.1 mtmm -61.0 -41.94 97.48 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 121.341 -0.85 . . . . 0.0 111.719 172.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 81.4 mt -65.62 -45.55 91.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 CA-C-O 118.785 -0.626 . . . . 0.0 110.464 174.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 34.1 t80 -50.2 -51.08 47.0 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 119.226 0.921 . . . . 0.0 111.427 174.385 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.4 mt -63.19 -42.24 99.31 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 121.652 -0.655 . . . . 0.0 112.643 179.075 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 93.3 mm-40 -61.56 -36.12 79.73 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 119.341 0.973 . . . . 0.0 113.022 174.086 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 34.5 mmtm -70.98 -53.57 14.38 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.99 1.316 . . . . 0.0 111.409 179.435 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 4.7 m -68.92 -25.54 30.41 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 CA-C-N 119.654 1.115 . . . . 0.0 112.647 179.707 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -59.14 -28.37 66.51 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 173.06 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -93.52 -4.96 50.14 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.943 1.297 . . . . 0.0 112.569 177.603 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 38.8 ttp -67.2 139.16 94.87 Favored Pre-proline 0 CA--C 1.548 0.901 0 C-N-CA 124.028 0.931 . . . . 0.0 110.532 171.577 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -64.91 156.08 64.26 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 123.045 2.497 . . . . 0.0 112.269 175.609 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 62.2 mm-40 -85.37 -16.04 41.2 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.98 0.912 . . . . 0.0 113.172 177.489 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 13.6 mp0 -103.82 146.56 28.46 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.587 1.155 . . . . 0.0 113.097 -175.673 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.43 146.09 27.14 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.305 1.042 . . . . 0.0 111.715 174.056 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 82.4 t -141.46 125.47 16.58 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 C-N-CA 127.338 2.255 . . . . 0.0 108.71 174.071 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -65.61 125.07 24.09 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.84 1.656 . . . . 0.0 111.329 169.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 90.6 mt . . . . . 0 CA--C 1.541 0.6 0 C-N-CA 123.485 0.714 . . . . 0.0 112.75 177.719 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.367 0 N-CA-C 110.99 -0.844 . . . . 0.0 110.99 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.9 p -68.51 156.18 38.49 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.565 1.146 . . . . 0.0 113.394 176.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 50.2 m -68.08 134.41 50.56 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.323 1.049 . . . . 0.0 112.107 176.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 176.22 27.81 0.03 OUTLIER Glycine 0 CA--C 1.536 1.399 0 C-N-CA 123.976 0.798 . . . . 0.0 114.914 179.442 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 50.4 m -145.82 170.09 17.25 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.497 1.519 . . . . 0.0 111.958 -169.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.5 m -127.21 22.19 6.62 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 125.627 1.571 . . . . 0.0 112.675 178.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 83.71 -171.87 49.63 Favored Glycine 0 CA--C 1.536 1.346 0 C-N-CA 124.954 1.264 . . . . 0.0 113.401 -174.352 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -127.04 176.39 7.38 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.854 1.262 . . . . 0.0 112.062 -176.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 18.6 m -123.7 -15.52 5.27 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 C-N-CA 124.491 1.116 . . . . 0.0 113.819 -172.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 10.9 t -150.99 160.35 43.99 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 125.816 1.647 . . . . 0.0 109.171 169.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -155.52 121.42 2.6 Favored Pre-proline 0 CA--C 1.546 0.796 0 O-C-N 121.684 -0.635 . . . . 0.0 111.68 -176.817 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -81.75 -28.37 2.18 Favored 'Trans proline' 0 CA--C 1.542 0.898 0 C-N-CA 123.441 2.761 . . . . 0.0 113.419 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.8 t -77.64 -44.94 26.56 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.047 0.939 . . . . 0.0 112.281 -177.257 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 52.4 tttm -72.94 133.65 81.77 Favored Pre-proline 0 N--CA 1.473 0.702 0 C-N-CA 124.53 1.132 . . . . 0.0 110.375 174.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -70.89 147.5 55.71 Favored 'Trans proline' 0 CA--C 1.535 0.55 0 C-N-CA 122.08 1.853 . . . . 0.0 111.89 177.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 178.82 150.47 8.87 Favored Glycine 0 CA--C 1.528 0.896 0 N-CA-C 114.715 0.646 . . . . 0.0 114.715 178.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 19.7 ptt180 -161.42 166.49 27.22 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 126.901 2.08 . . . . 0.0 110.678 175.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.486 ' HG3' HD12 ' A' ' 147' ' ' LEU . 0.2 OUTLIER -71.42 117.33 12.82 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.378 1.471 . . . . 0.0 111.882 -177.014 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 69.4 p -126.99 163.21 24.21 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.667 1.187 . . . . 0.0 112.089 -179.252 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -56.54 -35.41 68.09 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.302 1.441 . . . . 0.0 113.636 174.496 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -67.38 -50.21 60.69 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 122.874 0.47 . . . . 0.0 111.255 177.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 89.3 mt -62.05 -35.77 79.64 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.443 -0.786 . . . . 0.0 112.178 173.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 19.1 tp60 -58.75 -49.17 78.62 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 119.012 -0.518 . . . . 0.0 111.201 173.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 55.4 t80 -58.28 -42.57 86.86 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 119.437 1.017 . . . . 0.0 112.402 177.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 97.0 mmm -55.82 -51.42 67.54 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.128 0.571 . . . . 0.0 112.142 173.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.418 ' HB3' HD13 ' A' ' 90' ' ' LEU . 9.5 pt20 -83.46 -12.68 56.07 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 114.971 1.471 . . . . 0.0 114.971 -175.506 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 59.0 t30 -107.4 -22.77 12.45 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.545 1.138 . . . . 0.0 112.869 -172.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 13.5 t -129.69 -49.69 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 C-N-CA 123.361 0.664 . . . . 0.0 112.081 -179.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.5 t -69.6 -64.16 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 CA-C-N 118.694 0.679 . . . . 0.0 110.586 -173.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 73.3 t -57.04 -45.08 83.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.675 0 C-N-CA 124.703 1.201 . . . . 0.0 110.259 172.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.3 tppp? -53.15 -47.34 68.84 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.179 0.991 . . . . 0.0 112.066 -179.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 32.6 m -76.68 -40.95 47.3 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -179.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 59.6 mt -63.25 -33.4 75.41 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.264 0.626 . . . . 0.0 112.329 176.328 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 22.3 t-105 -73.2 -31.06 63.96 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.56 1.544 . . . . 0.0 113.274 174.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 54.8 mtmt -77.65 -9.52 59.02 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 174.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 47.0 t-80 -63.29 149.38 45.79 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.746 1.218 . . . . 0.0 113.221 -179.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 17.1 pt20 -61.31 -12.53 14.06 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 115.265 1.58 . . . . 0.0 115.265 176.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 20.2 m-85 -124.22 17.04 9.13 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.96 1.704 . . . . 0.0 113.645 -179.341 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.51 -27.81 65.51 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 114.168 1.173 . . . . 0.0 114.168 176.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 41.5 p-90 -56.62 -37.78 61.37 Favored Pre-proline 0 CA--C 1.547 0.831 0 N-CA-C 118.096 2.628 . . . . 0.0 118.096 -169.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -75.17 -5.81 17.16 Favored 'Trans proline' 0 CA--C 1.544 0.988 0 CA-C-N 123.221 2.186 . . . . 0.0 113.623 174.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -106.49 -5.61 18.74 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.432 1.493 . . . . 0.0 112.877 178.514 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -61.24 -18.07 56.52 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 114.392 1.256 . . . . 0.0 114.392 178.214 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -143.48 155.98 60.46 Favored Pre-proline 0 CA--C 1.545 0.755 0 C-N-CA 125.868 1.667 . . . . 0.0 110.677 -175.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -65.67 151.32 84.92 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 122.752 2.302 . . . . 0.0 111.912 171.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 60.8 t -66.78 104.67 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 124.051 0.94 . . . . 0.0 110.773 176.3 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 -74.88 85.59 2.23 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.202 1.001 . . . . 0.0 110.089 169.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -51.84 -25.91 8.82 Favored 'General case' 0 CA--C 1.548 0.904 0 N-CA-C 114.053 1.131 . . . . 0.0 114.053 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 81.7 mt -64.17 -49.9 79.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 C-N-CA 125.618 1.567 . . . . 0.0 111.436 171.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -73.88 -40.52 63.15 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 125.239 1.416 . . . . 0.0 112.87 -178.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -74.29 -10.71 59.86 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.928 1.291 . . . . 0.0 113.132 174.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 68.3 m-20 56.11 56.53 5.8 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.48 1.912 . . . . 0.0 112.503 -179.283 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 46.6 mt -115.67 80.51 8.39 Favored Pre-proline 0 CA--C 1.545 0.77 0 C-N-CA 126.318 1.847 . . . . 0.0 110.35 -177.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -68.1 -6.26 16.77 Favored 'Trans proline' 0 CA--C 1.543 0.937 0 C-N-CA 123.977 3.118 . . . . 0.0 114.361 -174.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 29.4 m-20 -122.29 12.44 10.2 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.06 1.744 . . . . 0.0 112.53 178.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 80.0 t80 -48.5 -55.44 11.01 Favored 'General case' 0 N--CA 1.476 0.859 0 O-C-N 120.915 -1.116 . . . . 0.0 113.319 -175.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -73.95 -12.17 60.57 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.825 1.25 . . . . 0.0 114.353 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.61 -34.69 67.54 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 121.123 -0.986 . . . . 0.0 111.807 174.072 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.4 mp -92.28 -47.42 14.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 124.68 1.192 . . . . 0.0 110.906 174.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.556 HD11 ' HB2' ' A' ' 115' ' ' TYR . 38.6 mm -76.99 110.51 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 123.511 0.724 . . . . 0.0 111.335 -177.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -71.31 -35.87 71.41 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.805 1.242 . . . . 0.0 112.836 174.747 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 13.2 p30 -147.69 83.14 7.66 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 125.534 1.534 . . . . 0.0 111.721 -168.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -69.37 131.66 22.27 Favored 'Trans proline' 0 CA--C 1.535 0.566 0 C-N-CA 123.467 2.778 . . . . 0.0 110.919 -177.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 6.4 tpt -156.49 133.73 10.62 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.004 1.322 . . . . 0.0 110.28 -170.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -146.79 151.06 36.53 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.631 1.572 . . . . 0.0 111.22 -176.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.6 ttp -56.23 -36.78 68.86 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.462 1.505 . . . . 0.0 113.284 -170.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -58.94 -25.77 59.86 Favored Glycine 0 CA--C 1.533 1.188 0 C-N-CA 125.014 1.292 . . . . 0.0 114.77 174.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 39.8 m -92.96 -33.63 14.09 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.572 1.149 . . . . 0.0 111.634 175.133 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 44.7 mt -56.78 -50.84 73.32 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 CA-C-N 119.196 0.907 . . . . 0.0 110.497 174.553 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -62.07 -33.06 73.7 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 177.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.431 ' HA ' ' HE3' ' A' ' 88' ' ' LYS . 0.6 OUTLIER -67.45 -27.73 67.29 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -176.501 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 5.1 ptp180 -84.06 -31.93 25.1 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 113.839 1.051 . . . . 0.0 113.839 169.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.418 HD13 ' HB3' ' A' ' 43' ' ' GLN . 87.4 mt -62.04 -33.71 74.87 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 119.541 1.064 . . . . 0.0 113.311 168.075 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -67.73 1.92 2.22 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 125.603 1.561 . . . . 0.0 113.805 172.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 57.8 m-80 -137.57 -169.78 2.6 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 128.494 2.718 . . . . 0.0 110.696 -177.285 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 75.1 m-80 -113.73 44.21 1.66 Allowed 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.537 1.535 . . . . 0.0 111.051 -178.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 41.2 t80 -64.4 -35.95 82.56 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.553 0.741 . . . . 0.0 111.92 -175.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -137.6 176.43 8.71 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 127.098 2.159 . . . . 0.0 111.842 -178.303 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 2.5 t-105 -108.89 -25.29 10.84 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.882 1.673 . . . . 0.0 112.283 -178.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 51.9 p -133.05 145.73 51.06 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 125.25 1.42 . . . . 0.0 113.678 -168.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -69.9 -19.66 63.4 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 115.229 1.566 . . . . 0.0 115.229 -175.245 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 18.0 m -56.24 -28.81 59.78 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.785 0.834 . . . . 0.0 113.067 174.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -71.98 -44.12 64.03 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.554 0.742 . . . . 0.0 112.299 174.569 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 42.5 t -61.16 -38.97 88.38 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.713 0.805 . . . . 0.0 111.797 172.32 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 83.5 mtp -61.42 -43.17 99.33 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 121.44 -0.787 . . . . 0.0 112.387 172.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . 0.253 2.4 pt20 -67.43 -30.4 70.13 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 175.763 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 94.9 m-20 -68.03 -43.62 78.34 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.374 -0.829 . . . . 0.0 111.961 170.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -59.36 -45.44 91.41 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 121.202 -0.936 . . . . 0.0 112.312 172.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 18.6 t30 -56.83 -47.38 80.44 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 122.965 0.506 . . . . 0.0 111.67 172.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 74.6 m -61.05 -37.91 84.32 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.907 0.883 . . . . 0.0 112.508 178.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 51.9 ttp -59.99 -55.9 28.34 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 119.091 0.86 . . . . 0.0 111.983 173.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -64.74 -42.47 95.18 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 112.207 0.447 . . . . 0.0 112.207 -177.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 98.0 m -64.61 -46.91 80.62 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.444 -0.785 . . . . 0.0 112.355 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -63.56 -32.49 73.97 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 119.909 1.232 . . . . 0.0 112.143 179.317 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 94.8 m -61.97 -43.62 98.46 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.761 0.824 . . . . 0.0 112.927 170.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -67.37 -32.71 73.83 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 178.163 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 89.1 mt -65.12 -56.3 16.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 C-N-CA 123.388 0.675 . . . . 0.0 110.825 177.232 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . 0.556 ' HB2' HD11 ' A' ' 77' ' ' ILE . 31.9 t80 -69.13 -37.25 78.2 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 -172.483 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 64.7 m-80 -100.79 159.3 15.3 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.862 0.865 . . . . 0.0 112.724 -170.6 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 49.2 mmtm -66.82 146.11 99.03 Favored Pre-proline 0 N--CA 1.476 0.867 0 C-N-CA 123.773 0.829 . . . . 0.0 110.571 172.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -66.24 -7.61 17.9 Favored 'Trans proline' 0 CA--C 1.542 0.919 0 C-N-CA 123.604 2.87 . . . . 0.0 114.656 -175.402 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 50.8 p -113.6 -0.66 14.28 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 126.624 1.969 . . . . 0.0 113.235 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -65.89 147.25 53.67 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.568 -0.708 . . . . 0.0 111.027 173.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -51.85 -48.49 63.96 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.568 0.747 . . . . 0.0 112.405 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 9.9 tp -57.02 -30.9 35.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 N-CA-C 114.073 1.138 . . . . 0.0 114.073 -179.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 51.9 t -72.76 -47.44 49.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 O-C-N 121.55 -0.719 . . . . 0.0 110.394 174.121 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 75.0 mt -61.08 -36.74 80.46 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 118.994 0.816 . . . . 0.0 111.808 176.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 11.2 mtt -59.01 -52.64 64.9 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.892 1.277 . . . . 0.0 112.011 169.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.14 -39.78 87.5 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.254 0.621 . . . . 0.0 112.542 176.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 90.3 mt-30 -62.51 -38.36 89.61 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.909 0.884 . . . . 0.0 112.833 174.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -75.49 -34.7 60.89 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.196 0.998 . . . . 0.0 113.214 178.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 72.0 mt -68.87 -45.51 70.81 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.182 0.593 . . . . 0.0 111.383 170.356 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -62.54 -39.95 95.24 Favored 'General case' 0 N--CA 1.468 0.467 0 O-C-N 121.281 -0.887 . . . . 0.0 112.98 -175.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 5.2 ptpp? -61.0 -42.36 98.3 Favored 'General case' 0 N--CA 1.474 0.737 0 O-C-N 121.382 -0.824 . . . . 0.0 112.36 176.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 87.8 mt -66.26 -46.24 87.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 C-N-CA 123.828 0.851 . . . . 0.0 110.632 174.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -50.09 -50.22 48.95 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 119.102 0.864 . . . . 0.0 111.188 174.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.2 mt -63.01 -42.17 99.76 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 178.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -62.0 -35.43 78.52 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 119.444 1.02 . . . . 0.0 112.964 174.143 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 34.6 mmtm -72.98 -52.43 14.52 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.862 1.265 . . . . 0.0 111.635 179.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.0 m -67.92 -25.24 31.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 CA-C-N 119.736 1.153 . . . . 0.0 112.447 178.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -61.69 -30.32 70.67 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.58 -0.7 . . . . 0.0 112.604 170.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -90.24 -9.45 47.99 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.758 1.223 . . . . 0.0 112.683 175.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 40.0 ttp -64.77 141.55 98.35 Favored Pre-proline 0 CA--C 1.547 0.859 0 CA-C-N 119.004 0.82 . . . . 0.0 109.86 169.014 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -51.99 151.69 15.66 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 122.945 2.43 . . . . 0.0 113.43 170.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 18.7 mm100 -90.64 -21.05 21.87 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.385 0.674 . . . . 0.0 112.648 172.161 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -93.97 159.39 15.19 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.673 1.589 . . . . 0.0 111.053 173.514 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -125.3 139.11 53.99 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.07 1.348 . . . . 0.0 111.293 -171.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 9.9 p -146.01 150.73 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 124.315 1.046 . . . . 0.0 111.438 -175.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 24.6 tp10 -69.35 146.69 51.94 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.109 0.964 . . . . 0.0 111.715 171.593 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . 0.486 HD12 ' HG3' ' A' ' 35' ' ' LYS . 88.3 mt -75.64 156.84 34.46 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 113.608 0.966 . . . . 0.0 113.608 173.529 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 96.8 mt -69.03 155.28 93.9 Favored Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 124.315 1.046 . . . . 0.0 110.766 168.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -70.15 147.17 59.75 Favored 'Trans proline' 0 CA--C 1.547 1.166 0 C-N-CA 122.549 2.166 . . . . 0.0 111.992 -179.07 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -73.91 160.63 42.93 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 123.51 2.806 . . . . 0.0 112.465 179.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -65.79 150.04 96.78 Favored Pre-proline 0 CA--C 1.552 1.051 0 C-N-CA 123.577 0.751 . . . . 0.0 111.822 170.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -71.86 154.33 58.53 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 123.091 2.528 . . . . 0.0 112.397 178.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.43 162.64 17.38 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.381 1.072 . . . . 0.0 113.02 171.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . -147.08 6.72 1.14 Allowed Glycine 0 CA--C 1.538 1.487 0 N-CA-C 115.876 1.11 . . . . 0.0 115.876 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 25.8 ttmm . . . . . 0 C--O 1.252 1.22 0 C-N-CA 125.108 1.363 . . . . 0.0 111.741 173.856 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.43 0 N-CA-C 110.69 -0.964 . . . . 0.0 110.69 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 34.1 m -75.08 51.39 0.52 Allowed 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 125.906 1.682 . . . . 0.0 112.901 176.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.3 m -71.67 48.33 0.15 Allowed 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 127.789 2.435 . . . . 0.0 114.469 -172.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -163.46 -23.59 0.02 OUTLIER Glycine 0 CA--C 1.538 1.516 0 C-N-CA 125.646 1.593 . . . . 0.0 114.883 -178.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 64.0 p -155.42 142.46 19.17 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 118.931 1.366 . . . . 0.0 112.331 173.337 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.3 m -78.29 -14.94 59.21 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 -178.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 169.41 -168.97 41.69 Favored Glycine 0 CA--C 1.535 1.307 0 C-N-CA 125.486 1.517 . . . . 0.0 112.535 -175.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -143.71 157.72 44.19 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.013 1.325 . . . . 0.0 112.767 179.25 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 34.1 m -132.69 -15.8 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 C-N-CA 125.963 1.705 . . . . 0.0 113.273 177.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 18.6 m -145.7 140.49 27.28 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 127.221 2.208 . . . . 0.0 108.713 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -149.19 134.71 9.68 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 123.786 0.835 . . . . 0.0 111.01 -172.521 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -77.77 -7.65 16.64 Favored 'Trans proline' 0 CA--C 1.543 0.972 0 C-N-CA 123.989 3.126 . . . . 0.0 115.339 -173.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 7.5 t -133.56 -21.07 2.01 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 -172.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 60.4 tttp -65.49 128.78 94.08 Favored Pre-proline 0 N--CA 1.476 0.861 0 CA-C-N 119.451 1.023 . . . . 0.0 109.871 169.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -71.84 144.32 43.24 Favored 'Trans proline' 0 CA--C 1.534 0.489 0 C-N-CA 122.602 2.202 . . . . 0.0 112.254 -178.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 171.4 166.18 29.8 Favored Glycine 0 CA--C 1.528 0.888 0 C-N-CA 123.866 0.746 . . . . 0.0 114.33 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 8.6 ptp180 -164.66 167.83 18.71 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 127.461 2.304 . . . . 0.0 110.175 176.223 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 8.3 tppt? -76.11 114.24 14.54 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 166.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 67.2 p -105.84 169.5 8.45 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 125.18 1.392 . . . . 0.0 110.297 174.012 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 24.0 p-10 -50.52 -37.86 41.36 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 174.266 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -71.51 -48.07 51.26 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.519 0.727 . . . . 0.0 111.595 178.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 75.9 mt -65.54 -30.78 71.57 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.472 -0.767 . . . . 0.0 112.753 177.047 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 39.3 tt0 -59.56 -52.62 64.76 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 123.913 0.885 . . . . 0.0 109.681 168.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 64.9 t80 -58.73 -42.35 88.54 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.025 0.93 . . . . 0.0 112.755 179.453 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 96.7 mmm -53.95 -51.71 62.95 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 118.514 0.597 . . . . 0.0 112.008 174.258 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 4.3 tp60 -75.08 -34.06 61.72 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 121.17 -0.956 . . . . 0.0 113.496 -178.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 52.3 t30 -89.81 -22.67 21.99 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.512 1.125 . . . . 0.0 113.479 -168.035 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 6.0 t -130.64 -50.13 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 CA-C-N 118.103 0.411 . . . . 0.0 111.195 -175.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 17.0 t -68.19 -62.93 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 122.783 0.433 . . . . 0.0 110.189 -175.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 43.1 t -56.4 -48.47 79.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 C-N-CA 125.368 1.467 . . . . 0.0 110.387 173.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 24.6 ttpt -60.37 -43.01 96.98 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -173.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 53.1 m -71.42 -44.96 63.9 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 119.01 0.823 . . . . 0.0 112.22 173.13 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 70.0 mt -60.4 -35.09 74.95 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.315 0.961 . . . . 0.0 112.325 178.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 26.0 t-105 -69.77 -30.1 67.59 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.538 1.535 . . . . 0.0 113.494 176.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -84.38 -6.21 59.36 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 124.302 1.041 . . . . 0.0 113.756 177.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 45.7 t-80 -63.15 154.73 30.21 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.74 1.216 . . . . 0.0 113.154 -179.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 60.9 tt0 -56.47 -24.54 46.52 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.598 1.559 . . . . 0.0 113.931 175.084 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 -122.0 19.28 10.86 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.326 1.451 . . . . 0.0 113.841 -173.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.79 -26.74 63.47 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 176.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 61.3 p-90 -59.58 -35.45 30.05 Favored Pre-proline 0 CA--C 1.548 0.893 0 N-CA-C 117.861 2.541 . . . . 0.0 117.861 -169.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -74.93 -3.42 13.89 Favored 'Trans proline' 0 CA--C 1.544 0.986 0 CA-C-N 123.232 2.19 . . . . 0.0 113.558 174.23 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 56.5 m-85 -109.98 -6.48 15.16 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.472 1.509 . . . . 0.0 113.066 178.259 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 20.4 m-30 -62.87 -16.53 59.04 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 178.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -142.02 156.52 65.08 Favored Pre-proline 0 CA--C 1.544 0.739 0 C-N-CA 126.372 1.869 . . . . 0.0 110.239 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -64.65 152.96 79.91 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 122.673 2.249 . . . . 0.0 112.054 173.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 54.6 t -66.38 101.12 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.864 0 C-N-CA 124.088 0.955 . . . . 0.0 110.675 176.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 52.7 m-20 -75.5 84.67 2.58 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.512 1.125 . . . . 0.0 110.613 172.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.97 -28.29 36.65 Favored 'General case' 0 CA--C 1.547 0.827 0 N-CA-C 113.987 1.106 . . . . 0.0 113.987 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 81.9 mt -65.37 -50.1 74.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 124.766 1.226 . . . . 0.0 111.097 172.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -66.33 -41.83 89.05 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.217 1.407 . . . . 0.0 112.56 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.6 mp -80.13 -4.76 54.24 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.631 1.173 . . . . 0.0 113.22 177.278 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 60.3 t30 54.8 55.05 8.28 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 126.107 1.763 . . . . 0.0 113.48 -179.239 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 34.8 mt -114.62 83.13 8.57 Favored Pre-proline 0 CA--C 1.543 0.673 0 C-N-CA 126.387 1.875 . . . . 0.0 110.343 -178.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -68.07 -3.44 10.66 Favored 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 123.884 3.056 . . . . 0.0 114.337 -175.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -127.34 9.86 6.71 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 126.174 1.79 . . . . 0.0 112.821 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 65.7 t80 -51.93 -51.86 54.07 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-N 120.284 1.402 . . . . 0.0 112.89 -175.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -76.17 -10.88 59.75 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.16 1.384 . . . . 0.0 113.89 179.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -72.44 -42.95 64.45 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.82 0.848 . . . . 0.0 110.267 175.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.9 mp -79.11 -55.54 9.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 C-N-CA 124.708 1.203 . . . . 0.0 110.262 172.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 47.9 mm -85.01 104.22 12.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 CA-C-O 122.153 0.978 . . . . 0.0 111.387 -175.489 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -71.24 -29.46 65.15 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.955 1.702 . . . . 0.0 114.058 -179.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -143.75 77.42 15.0 Favored Pre-proline 0 CA--C 1.542 0.639 0 C-N-CA 125.486 1.514 . . . . 0.0 110.712 -172.582 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -67.06 142.84 63.11 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 123.983 3.122 . . . . 0.0 111.648 -179.254 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 8.0 tpt -157.46 137.87 12.86 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.555 1.542 . . . . 0.0 109.846 -176.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -146.54 150.04 34.77 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.955 1.302 . . . . 0.0 111.401 -176.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 9.7 ttp -56.78 -36.72 70.18 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.992 1.317 . . . . 0.0 113.511 -169.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -61.31 -21.59 59.98 Favored Glycine 0 CA--C 1.536 1.405 0 C-N-CA 124.888 1.233 . . . . 0.0 114.77 173.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 24.3 m -97.08 -34.1 11.28 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.807 1.243 . . . . 0.0 111.523 172.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 76.8 mt -55.42 -50.37 66.24 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 119.467 1.031 . . . . 0.0 110.653 173.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 14.1 ptmm? -61.81 -29.71 70.34 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 113.976 1.102 . . . . 0.0 113.976 176.368 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.413 ' HA ' ' HE3' ' A' ' 88' ' ' LYS . 1.5 tpmt? -70.64 -32.9 70.37 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.748 1.219 . . . . 0.0 113.301 -175.735 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 3.8 ptp180 -77.95 -31.43 50.91 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 169.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 80.8 mt -67.6 -28.47 67.78 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 114.04 1.126 . . . . 0.0 114.04 169.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -65.92 -8.48 22.63 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 125.271 1.428 . . . . 0.0 114.149 174.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 -135.17 163.64 29.49 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.702 1.601 . . . . 0.0 112.819 -171.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 -81.12 105.39 12.29 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 169.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -140.53 -40.71 0.42 Allowed 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.308 1.043 . . . . 0.0 112.675 -172.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -130.81 175.53 8.96 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 126.603 1.961 . . . . 0.0 111.25 172.67 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 3.1 t-105 -115.24 -21.2 10.04 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.602 1.161 . . . . 0.0 112.833 -174.308 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 91.7 p -127.19 149.16 50.1 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.387 1.075 . . . . 0.0 112.783 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -64.32 -20.32 66.02 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 114.212 1.19 . . . . 0.0 114.212 175.227 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 83.1 p -51.13 -38.38 51.66 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.022 0.929 . . . . 0.0 113.255 177.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -67.19 -43.16 82.84 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.357 1.063 . . . . 0.0 111.782 179.241 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 49.6 t -66.92 -36.35 82.06 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.23 1.012 . . . . 0.0 112.742 174.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 88.1 mtp -62.42 -41.66 98.87 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 121.425 -0.797 . . . . 0.0 111.964 176.615 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 61.8 mm-40 -64.68 -33.93 77.11 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 112.767 0.655 . . . . 0.0 112.767 173.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 87.5 m-20 -67.69 -41.86 82.98 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 120.967 -1.083 . . . . 0.0 111.78 174.447 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -59.38 -47.58 84.91 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.208 0.603 . . . . 0.0 112.308 169.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.75 -42.0 92.22 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 121.776 -0.577 . . . . 0.0 111.297 177.029 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 62.4 m -62.49 -45.47 92.85 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.72 0.808 . . . . 0.0 111.547 178.095 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 57.5 ttp -55.68 -52.4 63.99 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.157 0.983 . . . . 0.0 112.778 176.235 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -68.46 -37.28 80.04 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.0 m -59.28 -50.15 75.1 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.226 1.01 . . . . 0.0 111.818 173.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -57.97 -37.46 74.22 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.268 0.627 . . . . 0.0 112.18 -178.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 90.3 m -57.29 -43.16 82.94 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.122 0.969 . . . . 0.0 112.386 173.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -70.18 -29.57 66.47 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.3 1.04 . . . . 0.0 113.632 176.592 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 82.2 mt -75.67 -57.13 6.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 123.804 0.842 . . . . 0.0 110.894 179.663 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -69.74 -23.04 63.33 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 114.507 1.299 . . . . 0.0 114.507 -172.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 36.6 m-80 -120.32 165.93 14.21 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.336 1.054 . . . . 0.0 112.724 -170.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -70.19 148.47 95.85 Favored Pre-proline 0 N--CA 1.475 0.813 0 C-N-CA 124.178 0.991 . . . . 0.0 110.477 174.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -65.99 -6.38 14.25 Favored 'Trans proline' 0 CA--C 1.543 0.963 0 C-N-CA 123.634 2.889 . . . . 0.0 114.568 -178.319 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 67.9 p -116.0 1.32 13.26 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 126.641 1.977 . . . . 0.0 113.099 179.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -66.91 147.81 52.75 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 121.478 -0.764 . . . . 0.0 110.833 173.135 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -52.29 -48.55 65.28 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.441 0.696 . . . . 0.0 112.322 178.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.1 tp -58.15 -30.11 38.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 N-CA-C 113.928 1.084 . . . . 0.0 113.928 -178.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 39.2 t -71.38 -48.3 54.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 O-C-N 121.538 -0.726 . . . . 0.0 110.383 173.226 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 74.3 mt -61.35 -36.65 80.76 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 118.876 0.762 . . . . 0.0 111.701 177.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 11.7 mtt -59.23 -51.75 68.63 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 124.735 1.214 . . . . 0.0 111.984 169.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -59.97 -40.9 90.68 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 123.191 0.596 . . . . 0.0 112.474 176.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 89.5 mt-30 -61.71 -45.96 91.71 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 119.085 0.857 . . . . 0.0 111.972 174.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -69.0 -28.0 66.2 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.445 1.098 . . . . 0.0 113.862 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 78.7 mt -78.36 -45.09 23.36 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.857 0.863 . . . . 0.0 111.547 169.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -61.04 -40.31 93.12 Favored 'General case' 0 N--CA 1.47 0.569 0 O-C-N 121.124 -0.985 . . . . 0.0 112.777 -175.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 60.6 pttt -59.22 -39.76 83.71 Favored 'General case' 0 N--CA 1.474 0.741 0 O-C-N 121.535 -0.728 . . . . 0.0 112.282 176.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 69.1 mt -72.66 -42.37 62.61 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 C-N-CA 124.457 1.103 . . . . 0.0 111.272 175.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -50.85 -51.58 49.9 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.395 0.998 . . . . 0.0 110.384 171.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 99.1 mt -62.18 -45.03 95.21 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 177.027 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -62.89 -30.61 71.66 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 119.603 1.092 . . . . 0.0 113.402 179.074 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 70.3 mmtt -75.1 -54.92 6.31 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 124.658 1.183 . . . . 0.0 112.262 174.216 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 6.0 m -66.13 -25.03 34.8 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 CA-C-N 120.691 1.587 . . . . 0.0 112.535 -178.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -58.09 -28.47 64.62 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 172.209 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -97.81 -3.18 39.38 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.235 1.414 . . . . 0.0 112.423 178.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 42.9 ttp -62.64 138.27 96.71 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 123.994 0.917 . . . . 0.0 110.728 173.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.07 125.98 15.62 Favored 'Trans proline' 0 CA--C 1.534 0.516 0 C-N-CA 122.864 2.376 . . . . 0.0 110.365 177.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 80.4 mm-40 -76.2 -22.4 55.34 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 113.472 0.915 . . . . 0.0 113.472 -173.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -75.13 159.02 32.14 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.244 1.417 . . . . 0.0 111.585 169.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -122.59 129.65 52.14 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.574 1.55 . . . . 0.0 111.208 -174.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 78.8 t -141.76 131.5 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 125.545 1.538 . . . . 0.0 110.961 -169.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -69.31 125.03 25.42 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.601 1.56 . . . . 0.0 111.074 169.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 97.7 mt -76.1 152.59 36.75 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 178.418 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 4.5 pp -73.81 153.94 89.16 Favored Pre-proline 0 CA--C 1.552 1.02 0 C-N-CA 124.165 0.986 . . . . 0.0 111.217 168.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -78.21 156.52 29.67 Favored 'Trans proline' 0 CA--C 1.548 1.183 0 C-N-CA 123.179 2.586 . . . . 0.0 113.057 -175.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -70.94 170.12 18.77 Favored 'Trans proline' 0 CA--C 1.542 0.911 0 C-N-CA 123.748 2.966 . . . . 0.0 112.752 174.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -144.53 154.83 56.89 Favored Pre-proline 0 CA--C 1.551 0.985 0 C-N-CA 125.326 1.45 . . . . 0.0 111.89 -179.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.13 167.86 24.93 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 123.64 2.893 . . . . 0.0 113.116 178.188 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 64.4 pttt -146.5 168.75 20.44 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.971 1.708 . . . . 0.0 112.383 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . -165.19 37.93 0.28 Allowed Glycine 0 CA--C 1.534 1.275 0 C-N-CA 124.611 1.101 . . . . 0.0 113.785 -175.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 15.4 ptmm? . . . . . 0 C--O 1.255 1.367 0 C-N-CA 126.502 1.921 . . . . 0.0 112.919 -175.727 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.488 0 N-CA-C 112.13 -0.388 . . . . 0.0 112.13 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 49.2 m -74.29 64.26 1.09 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 126.138 1.775 . . . . 0.0 113.29 179.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 78.6 p -62.08 167.04 4.2 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.097 1.359 . . . . 0.0 113.446 172.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -140.31 82.58 0.24 Allowed Glycine 0 CA--C 1.531 1.073 0 C-N-CA 125.088 1.328 . . . . 0.0 112.438 -172.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 91.6 p -141.16 171.82 13.53 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 125.644 1.578 . . . . 0.0 112.318 -179.469 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 77.2 p -139.37 13.85 2.58 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.057 1.343 . . . . 0.0 114.366 -169.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 88.22 -138.25 14.91 Favored Glycine 0 CA--C 1.533 1.179 0 C-N-CA 124.292 0.948 . . . . 0.0 111.885 -173.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -130.79 166.53 20.61 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.895 1.278 . . . . 0.0 112.576 175.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 27.2 m -136.92 -11.31 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.259 0 C-N-CA 125.986 1.714 . . . . 0.0 113.417 -175.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 40.3 p -150.18 143.7 25.18 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 126.691 1.997 . . . . 0.0 110.87 -177.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -154.55 134.62 8.05 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 124.473 1.109 . . . . 0.0 110.092 -173.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -70.17 -16.73 35.91 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 123.562 2.842 . . . . 0.0 115.309 -173.299 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 44.2 m -159.09 91.12 1.01 Allowed 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 119.859 1.209 . . . . 0.0 111.794 176.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.426 ' HE2' ' HA ' ' A' ' 94' ' ' TYR . 0.0 OUTLIER -139.73 159.68 64.11 Favored Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 126.581 1.952 . . . . 0.0 112.604 -176.376 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -70.94 157.72 57.34 Favored 'Trans proline' 0 CA--C 1.539 0.767 0 C-N-CA 122.906 2.404 . . . . 0.0 112.257 176.077 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 129.1 164.03 11.38 Favored Glycine 0 CA--C 1.529 0.96 0 C-N-CA 124.481 1.039 . . . . 0.0 113.299 176.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 34.8 ptt180 -163.79 157.87 19.46 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 126.235 1.814 . . . . 0.0 110.425 175.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 26.0 ttpt -71.45 135.96 47.42 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.451 0.7 . . . . 0.0 110.315 170.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 70.9 p -140.22 166.79 23.71 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 125.951 1.701 . . . . 0.0 110.181 -175.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 25.1 p-10 -46.63 -37.69 8.59 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 170.429 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 -70.31 -55.57 8.87 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.573 0.749 . . . . 0.0 111.683 179.205 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 86.2 mt -62.67 -34.55 77.34 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 121.534 -0.729 . . . . 0.0 112.597 178.284 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -56.24 -54.3 47.01 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.904 0.882 . . . . 0.0 110.842 170.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 75.1 t80 -59.29 -40.54 86.45 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 119.098 0.863 . . . . 0.0 112.925 179.175 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 92.3 mmm -55.48 -50.98 68.47 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 118.754 0.706 . . . . 0.0 111.795 172.453 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -85.56 -3.39 58.86 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 114.874 1.435 . . . . 0.0 114.874 -175.147 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 38.5 m-80 -118.33 -17.48 9.46 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.027 1.331 . . . . 0.0 114.265 -178.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 37.9 t -136.99 -50.18 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-N 119.211 0.914 . . . . 0.0 111.866 -178.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.4 t -67.75 -62.71 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 CA-C-N 119.378 0.99 . . . . 0.0 110.634 -174.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 84.5 t -60.71 -44.46 97.24 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 C-N-CA 123.736 0.814 . . . . 0.0 110.481 174.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt -56.68 -44.23 81.23 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 118.688 0.676 . . . . 0.0 112.401 -178.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 56.4 m -70.56 -47.14 61.75 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 122.672 0.389 . . . . 0.0 111.815 176.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 63.2 mt -61.48 -33.24 73.44 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 123.323 0.649 . . . . 0.0 112.199 179.09 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . 0.454 ' CZ3' ' HE3' ' A' ' 87' ' ' LYS . 21.3 t-105 -72.48 -29.18 63.42 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 125.655 1.582 . . . . 0.0 113.475 175.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt -82.04 -8.96 59.69 Favored 'General case' 0 N--CA 1.479 0.984 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 176.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 44.2 t-80 -62.17 152.76 32.21 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.638 1.175 . . . . 0.0 113.096 -178.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 22.6 tp60 -57.87 -19.84 32.24 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.487 1.515 . . . . 0.0 114.017 174.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 15.4 m-85 -122.9 16.09 10.08 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.709 1.604 . . . . 0.0 113.995 -173.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.34 -29.64 66.39 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 114.149 1.166 . . . . 0.0 114.149 178.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.428 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 39.8 p-90 -56.4 -37.31 56.12 Favored Pre-proline 0 CA--C 1.547 0.841 0 N-CA-C 117.079 2.252 . . . . 0.0 117.079 -171.329 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.428 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 55.8 Cg_endo -67.95 -6.53 17.27 Favored 'Trans proline' 0 C--N 1.356 0.924 0 CA-C-N 122.997 2.106 . . . . 0.0 114.985 172.267 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -113.69 -3.08 13.6 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.424 1.489 . . . . 0.0 113.129 179.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.8 m-30 -63.76 -20.61 65.9 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 113.666 0.987 . . . . 0.0 113.666 176.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -140.65 157.32 68.2 Favored Pre-proline 0 CA--C 1.545 0.772 0 C-N-CA 126.683 1.993 . . . . 0.0 110.048 -177.541 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -65.08 153.46 78.18 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 122.608 2.205 . . . . 0.0 112.144 174.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 63.7 t -65.77 102.51 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 C-N-CA 124.179 0.992 . . . . 0.0 110.963 176.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 42.9 m-20 -74.58 86.76 2.11 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.627 1.171 . . . . 0.0 109.855 169.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -52.47 -25.75 11.02 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.408 1.262 . . . . 0.0 114.408 -177.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 80.7 mt -64.5 -50.58 75.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 125.207 1.403 . . . . 0.0 111.323 171.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 55.2 mttm -73.48 -40.64 63.95 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 125.277 1.431 . . . . 0.0 112.937 -178.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -74.36 -10.65 59.79 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.19 0.996 . . . . 0.0 113.406 173.552 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 60.3 t30 58.87 54.58 5.05 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 126.7 2.0 . . . . 0.0 112.865 177.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 48.4 mt -115.21 81.59 8.29 Favored Pre-proline 0 CA--C 1.545 0.788 0 C-N-CA 126.681 1.993 . . . . 0.0 110.147 -175.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -67.68 -5.78 15.11 Favored 'Trans proline' 0 CA--C 1.543 0.956 0 C-N-CA 124.154 3.236 . . . . 0.0 114.925 -171.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -128.92 15.47 6.33 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.895 1.678 . . . . 0.0 112.51 179.357 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 63.4 t80 -47.25 -55.14 9.2 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 113.987 1.106 . . . . 0.0 113.987 -172.311 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -74.28 -13.23 60.74 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.783 1.233 . . . . 0.0 114.207 -178.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.418 ' HA ' ' HE2' ' A' ' 75' ' ' LYS . 8.9 mmpt? -76.41 -33.12 58.83 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.622 1.169 . . . . 0.0 111.981 175.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.3 mp -91.84 -46.42 14.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 124.687 1.195 . . . . 0.0 110.67 172.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 35.7 mm -84.34 99.01 6.25 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 CA-C-O 122.148 0.975 . . . . 0.0 111.276 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.55 -38.44 87.45 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 126.172 1.789 . . . . 0.0 113.85 177.09 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 -142.52 87.25 9.36 Favored Pre-proline 0 CA--C 1.543 0.706 0 C-N-CA 125.055 1.342 . . . . 0.0 110.616 -176.03 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -68.4 141.98 53.05 Favored 'Trans proline' 0 CA--C 1.538 0.691 0 C-N-CA 123.668 2.912 . . . . 0.0 111.666 -176.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.8 tpt -156.25 134.89 11.68 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.498 1.119 . . . . 0.0 110.773 -171.084 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -147.68 152.87 38.55 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.518 1.527 . . . . 0.0 111.237 -176.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 6.6 ttp -58.01 -36.89 73.33 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.434 1.094 . . . . 0.0 113.62 -170.404 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -59.49 -29.66 66.94 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 124.497 1.046 . . . . 0.0 114.296 174.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 27.9 m -85.88 -31.31 22.28 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.282 1.033 . . . . 0.0 111.786 176.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 62.4 mt -60.57 -52.48 61.04 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 CA-C-N 118.887 0.767 . . . . 0.0 110.661 174.465 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.454 ' HE3' ' CZ3' ' A' ' 51' ' ' TRP . 17.0 ptpt -57.89 -32.84 68.12 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 178.523 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 2.8 tppp? -59.29 -38.55 80.45 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 178.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 5.6 ptp180 -86.46 -19.06 30.15 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 114.213 1.19 . . . . 0.0 114.213 175.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 52.9 mt -70.68 -48.15 56.28 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 119.061 0.846 . . . . 0.0 111.964 167.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -62.86 -14.27 44.01 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 115.076 1.51 . . . . 0.0 115.076 -171.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 46.2 p30 -124.25 14.04 8.98 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 126.141 1.776 . . . . 0.0 113.133 177.181 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . 0.269 6.3 p30 37.24 65.75 0.49 Allowed 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 127.149 2.18 . . . . 0.0 114.403 -174.043 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . 0.426 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 74.1 t80 -59.29 -24.2 63.07 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.013 1.325 . . . . 0.0 114.097 179.73 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -132.42 -174.31 3.41 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 129.101 2.96 . . . . 0.0 111.863 -169.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 2.3 t-105 -112.67 -27.47 8.17 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.761 1.224 . . . . 0.0 113.382 -174.353 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 39.9 t -134.15 145.29 49.12 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.627 1.171 . . . . 0.0 111.773 -177.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -57.24 -18.86 18.01 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.837 1.655 . . . . 0.0 114.769 172.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 10.8 m -53.82 -32.89 54.42 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.206 1.002 . . . . 0.0 113.132 177.191 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -73.91 -42.61 60.4 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.214 1.006 . . . . 0.0 112.757 175.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 49.5 t -60.4 -40.75 92.06 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.271 1.028 . . . . 0.0 112.091 171.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 81.7 mtp -61.5 -41.59 97.52 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.099 0.96 . . . . 0.0 112.553 174.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -65.5 -34.04 77.34 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 174.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -67.26 -42.79 83.32 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 121.25 -0.907 . . . . 0.0 111.762 173.019 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -60.75 -45.86 92.67 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.254 -0.904 . . . . 0.0 112.599 172.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 35.5 t30 -55.62 -45.06 77.57 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.218 0.607 . . . . 0.0 111.678 173.072 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 88.7 m -62.69 -45.18 93.95 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.389 1.076 . . . . 0.0 112.149 179.104 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 12.7 ttm -55.69 -59.56 4.69 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.537 1.135 . . . . 0.0 112.453 177.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 -65.18 -34.98 79.66 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 121.98 -0.45 . . . . 0.0 112.136 -178.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 16.5 m -58.92 -51.77 68.62 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.322 1.049 . . . . 0.0 111.92 173.27 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -56.43 -40.08 74.16 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.773 0.829 . . . . 0.0 111.763 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 96.6 m -55.8 -50.72 69.73 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.3 0.64 . . . . 0.0 111.955 171.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -62.25 -26.59 68.47 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 114.07 1.137 . . . . 0.0 114.07 178.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 74.4 mt -73.63 -59.17 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 C-N-CA 123.75 0.82 . . . . 0.0 110.615 173.45 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -74.29 -46.42 41.28 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 -172.2 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -97.58 152.01 19.48 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.769 1.228 . . . . 0.0 111.305 -179.296 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 49.5 mmtm -81.9 155.87 70.17 Favored Pre-proline 0 N--CA 1.475 0.815 0 C-N-CA 125.343 1.457 . . . . 0.0 111.558 -175.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . 0.428 ' HA ' HG11 ' A' ' 123' ' ' VAL . 49.9 Cg_endo -62.95 -0.7 2.25 Favored 'Trans proline' 0 CA--C 1.543 0.973 0 C-N-CA 124.181 3.254 . . . . 0.0 115.759 -178.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 64.0 p -114.13 -4.23 13.15 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 126.878 2.071 . . . . 0.0 113.097 178.239 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 74.9 m-20 -76.24 142.74 41.33 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.038 0.836 . . . . 0.0 110.814 172.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -57.62 -46.27 84.31 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 121.49 -0.756 . . . . 0.0 112.299 -176.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.1 tp -53.63 -28.58 16.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 125.823 1.649 . . . . 0.0 114.629 175.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.428 HG11 ' HA ' ' A' ' 118' ' ' PRO . 55.8 t -75.66 -44.54 40.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 O-C-N 121.021 -1.049 . . . . 0.0 110.758 173.434 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 67.1 mt -61.11 -36.15 78.94 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 119.058 0.844 . . . . 0.0 111.579 174.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 10.4 mtt -58.9 -51.64 69.15 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.582 1.153 . . . . 0.0 111.972 169.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.27 -40.55 94.5 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.432 0.693 . . . . 0.0 112.536 177.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -61.36 -49.17 78.04 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.793 0.837 . . . . 0.0 111.664 174.405 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.87 -43.43 98.42 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.735 0.814 . . . . 0.0 112.495 179.419 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 87.2 mt -64.66 -45.79 85.22 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.593 0.757 . . . . 0.0 111.893 173.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -64.38 -36.42 84.08 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.056 -1.027 . . . . 0.0 113.352 -176.213 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 69.5 mttt -57.65 -49.23 77.16 Favored 'General case' 0 N--CA 1.478 0.937 0 O-C-N 121.453 -0.779 . . . . 0.0 111.179 173.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 89.9 mt -66.08 -43.37 92.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 123.918 0.887 . . . . 0.0 111.17 178.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -51.4 -53.3 38.1 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.741 0.816 . . . . 0.0 110.783 173.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 95.6 mt -61.69 -42.61 99.16 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.01 0.524 . . . . 0.0 112.392 177.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.61 -34.59 75.92 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-N 119.084 0.857 . . . . 0.0 113.072 178.506 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -74.69 -54.36 7.55 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.507 1.123 . . . . 0.0 112.401 175.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.9 m -64.94 -23.94 34.48 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 CA-C-N 120.306 1.412 . . . . 0.0 112.509 -178.655 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -59.29 -31.26 68.96 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 170.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 91.5 mt-30 -90.36 -11.75 39.68 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.016 1.326 . . . . 0.0 112.742 176.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 45.3 ttp -64.91 137.32 97.11 Favored Pre-proline 0 CA--C 1.546 0.792 0 CA-C-N 119.066 0.848 . . . . 0.0 110.571 174.3 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -66.65 130.9 24.52 Favored 'Trans proline' 0 CA--C 1.537 0.636 0 C-N-CA 122.911 2.407 . . . . 0.0 111.665 -179.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -68.52 -30.52 69.34 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.069 1.347 . . . . 0.0 112.45 178.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -76.35 158.83 31.08 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.655 1.582 . . . . 0.0 113.21 173.566 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -112.68 139.58 48.16 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 124.939 1.296 . . . . 0.0 110.499 177.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 10.2 p -143.97 134.62 21.36 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-O 122.245 1.021 . . . . 0.0 110.76 169.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 45.9 tt0 -64.28 128.85 37.6 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.412 1.885 . . . . 0.0 111.219 174.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 88.5 mt -75.06 145.37 42.39 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 113.208 0.818 . . . . 0.0 113.208 -177.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 4.4 pp -70.13 154.0 94.89 Favored Pre-proline 0 CA--C 1.551 0.998 0 C-N-CA 124.296 1.038 . . . . 0.0 111.718 169.43 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_endo -77.2 150.0 28.73 Favored 'Trans proline' 0 CA--C 1.546 1.111 0 C-N-CA 123.086 2.524 . . . . 0.0 112.346 -178.008 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -71.7 160.94 46.72 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 123.517 2.811 . . . . 0.0 112.561 177.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -64.9 145.84 98.89 Favored Pre-proline 0 CA--C 1.552 1.056 0 C-N-CA 123.712 0.805 . . . . 0.0 112.243 174.648 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -74.17 142.88 31.28 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.229 2.62 . . . . 0.0 112.475 -178.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -145.39 166.56 25.25 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 126.787 2.035 . . . . 0.0 110.803 175.106 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . -177.71 -7.16 0.02 OUTLIER Glycine 0 CA--C 1.541 1.663 0 N-CA-C 116.998 1.559 . . . . 0.0 116.998 179.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 86.4 tttt . . . . . 0 C--O 1.252 1.235 0 C-N-CA 126.006 1.722 . . . . 0.0 111.139 178.657 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.49 0 N-CA-C 111.78 -0.528 . . . . 0.0 111.78 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 19.7 m -74.51 39.24 0.12 Allowed 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 126.763 2.025 . . . . 0.0 114.885 -174.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.5 t 52.57 30.42 8.51 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 126.284 1.834 . . . . 0.0 114.7 -179.418 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 70.79 28.89 70.04 Favored Glycine 0 CA--C 1.537 1.437 0 O-C-N 121.025 -1.047 . . . . 0.0 114.887 179.562 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 65.4 p -52.65 138.15 29.22 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 125.339 1.456 . . . . 0.0 113.803 178.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 73.7 m -143.75 156.1 44.4 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.62 1.568 . . . . 0.0 111.744 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -176.36 34.7 0.09 OUTLIER Glycine 0 CA--C 1.534 1.25 0 C-N-CA 124.453 1.025 . . . . 0.0 113.885 -178.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -63.64 156.31 27.17 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 114.388 1.255 . . . . 0.0 114.388 -176.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 34.4 m -137.73 -17.8 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 C-N-CA 125.373 1.469 . . . . 0.0 113.988 -174.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.7 t -150.56 124.83 9.45 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 125.378 1.471 . . . . 0.0 109.875 177.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -155.81 122.12 2.63 Favored Pre-proline 0 CA--C 1.546 0.789 0 C-N-CA 124.511 1.124 . . . . 0.0 110.12 -172.269 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -77.04 -175.48 2.68 Favored 'Trans proline' 0 N--CA 1.454 -0.848 0 C-N-CA 123.938 3.092 . . . . 0.0 110.373 174.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 34.3 m 51.18 24.23 1.91 Allowed 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 126.14 1.776 . . . . 0.0 114.582 -170.059 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -130.03 134.43 26.13 Favored Pre-proline 0 N--CA 1.475 0.812 0 C-N-CA 127.374 2.269 . . . . 0.0 109.782 -178.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -70.47 143.26 46.92 Favored 'Trans proline' 0 CA--C 1.535 0.54 0 C-N-CA 122.596 2.198 . . . . 0.0 112.493 177.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 154.18 157.88 8.37 Favored Glycine 0 CA--C 1.529 0.962 0 C-N-CA 125.636 1.589 . . . . 0.0 112.279 177.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -172.22 165.55 6.01 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.965 1.706 . . . . 0.0 111.384 -174.128 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 26.1 pttm -67.11 139.44 57.52 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.013 0.925 . . . . 0.0 112.822 172.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 45.7 p -148.78 164.75 33.48 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 126.257 1.823 . . . . 0.0 110.582 178.152 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 23.7 p-10 -50.89 -39.24 53.68 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 178.571 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 66.8 mt-30 -72.62 -44.07 62.44 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 121.561 -0.712 . . . . 0.0 111.634 179.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 89.3 mt -64.22 -32.21 73.71 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 118.707 0.685 . . . . 0.0 111.99 174.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -61.18 -52.7 63.72 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-N 118.443 0.565 . . . . 0.0 109.924 168.521 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -55.09 -41.03 71.07 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.27 -0.894 . . . . 0.0 112.635 179.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 88.7 mmm -57.64 -56.43 22.04 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.878 -0.513 . . . . 0.0 112.042 170.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -77.19 -9.14 58.58 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 114.984 1.476 . . . . 0.0 114.984 -173.445 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -117.75 -23.63 7.51 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.353 1.461 . . . . 0.0 112.598 -169.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 18.7 t -127.53 -54.65 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 C-N-CA 123.429 0.692 . . . . 0.0 111.295 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.6 t -64.23 -59.95 3.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 CA-C-N 118.446 0.567 . . . . 0.0 110.652 -174.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 72.1 t -59.36 -46.38 92.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 124.457 1.103 . . . . 0.0 110.664 174.319 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 36.0 ttmt -57.39 -49.77 75.13 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.278 0.631 . . . . 0.0 112.357 -174.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 61.5 m -67.1 -43.85 81.45 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 118.599 0.636 . . . . 0.0 112.089 176.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 82.9 mt -62.28 -35.18 78.21 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 119.021 0.828 . . . . 0.0 112.481 178.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 20.7 t-105 -72.17 -27.09 62.36 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.76 1.624 . . . . 0.0 113.385 175.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.1 mtmp? -85.94 -4.47 59.17 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 177.328 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 39.7 t-80 -63.93 156.44 27.76 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.98 1.312 . . . . 0.0 113.185 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -57.77 -23.28 51.43 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.503 1.521 . . . . 0.0 113.638 173.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 -123.0 18.93 10.08 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.345 1.458 . . . . 0.0 114.137 -171.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.11 -26.34 63.92 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 176.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 58.9 p-90 -59.22 -35.92 36.41 Favored Pre-proline 0 CA--C 1.547 0.836 0 N-CA-C 117.978 2.585 . . . . 0.0 117.978 -169.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -74.52 -3.5 13.96 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 CA-C-N 123.277 2.206 . . . . 0.0 113.691 173.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 55.9 m-85 -110.3 -5.27 15.3 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.428 1.491 . . . . 0.0 113.14 178.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -62.84 -16.16 57.38 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 179.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -142.18 155.59 64.91 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 125.969 1.708 . . . . 0.0 110.389 -177.206 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -64.48 144.0 83.81 Favored 'Trans proline' 0 CA--C 1.538 0.677 0 C-N-CA 122.641 2.227 . . . . 0.0 111.713 173.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 76.5 t -60.6 115.58 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 123.546 0.738 . . . . 0.0 111.261 175.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 57.9 m-20 -92.44 103.89 16.27 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.249 1.02 . . . . 0.0 109.019 169.146 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.55 -30.08 60.12 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 113.418 0.896 . . . . 0.0 113.418 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 81.9 mt -65.03 -49.88 77.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 124.85 1.26 . . . . 0.0 111.155 174.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -63.84 -37.3 86.89 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.819 1.248 . . . . 0.0 113.403 -177.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.4 mp -89.68 -1.76 58.1 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.231 1.413 . . . . 0.0 112.36 178.216 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 23.0 m120 52.78 52.64 13.57 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 126.162 1.785 . . . . 0.0 113.264 -177.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 29.1 mt -107.71 94.28 11.91 Favored Pre-proline 0 CA--C 1.544 0.713 0 C-N-CA 126.26 1.824 . . . . 0.0 109.767 -179.35 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -68.72 -13.81 37.85 Favored 'Trans proline' 0 CA--C 1.542 0.877 0 C-N-CA 123.084 2.523 . . . . 0.0 114.55 -170.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 -136.65 21.05 3.1 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.573 1.549 . . . . 0.0 112.921 -173.437 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 64.7 t80 -46.14 -50.49 15.45 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.338 1.055 . . . . 0.0 113.827 -175.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 98.8 m-70 -73.48 -17.81 61.19 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 114.454 1.279 . . . . 0.0 114.454 -177.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 43.7 mttp -68.15 -39.53 82.63 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 119.343 0.974 . . . . 0.0 111.855 174.339 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.2 mp -81.37 -46.11 20.46 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 C-N-CA 124.8 1.24 . . . . 0.0 110.288 175.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 49.4 mm -98.57 98.48 7.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 CA-C-O 122.224 1.011 . . . . 0.0 111.353 -176.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.94 -32.5 74.06 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 126.397 1.879 . . . . 0.0 113.868 177.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -141.2 75.78 22.82 Favored Pre-proline 0 CA--C 1.542 0.664 0 C-N-CA 125.259 1.423 . . . . 0.0 110.559 -171.317 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -67.08 142.35 61.17 Favored 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 124.174 3.249 . . . . 0.0 111.289 -178.208 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 8.1 tpt -158.09 136.21 10.8 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.61 1.164 . . . . 0.0 110.221 -170.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -145.98 149.94 35.11 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.929 1.292 . . . . 0.0 111.563 -176.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.4 ttp -57.99 -37.01 73.45 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.667 1.187 . . . . 0.0 113.079 -171.052 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -61.7 -26.1 66.4 Favored Glycine 0 CA--C 1.533 1.178 0 C-N-CA 125.02 1.295 . . . . 0.0 114.597 174.196 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 20.2 m -82.74 -41.73 18.88 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.178 0.991 . . . . 0.0 110.708 170.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 68.4 mt -56.02 -51.9 56.23 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 124.114 0.966 . . . . 0.0 111.39 179.148 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.9 -35.68 71.38 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 113.291 0.848 . . . . 0.0 113.291 176.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -69.39 -34.34 74.37 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.089 0.956 . . . . 0.0 113.409 -177.301 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 4.9 ptp180 -76.89 -30.59 56.25 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 170.196 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 74.5 mt -63.9 -37.4 87.27 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 119.643 1.111 . . . . 0.0 113.011 168.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -75.87 8.55 2.99 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.495 1.518 . . . . 0.0 114.087 177.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 37.0 m-80 -137.3 167.07 22.31 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.652 1.981 . . . . 0.0 111.952 -179.564 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 5.4 p30 -80.62 111.49 17.1 Favored 'General case' 0 CA--C 1.545 0.75 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 168.025 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 56.2 t80 -148.25 -38.12 0.18 Allowed 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.864 0.691 . . . . 0.0 112.864 -171.447 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -138.56 173.12 11.92 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.35 1.86 . . . . 0.0 111.365 169.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.4 t-105 -108.86 -20.33 13.09 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 125.293 1.437 . . . . 0.0 112.162 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 40.5 t -130.34 138.48 50.45 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 126.087 1.755 . . . . 0.0 111.623 -171.132 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -65.92 -17.08 64.42 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 114.968 1.47 . . . . 0.0 114.968 178.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 35.6 p -53.18 -26.92 19.02 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.073 1.349 . . . . 0.0 114.019 172.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 53.7 mm-40 -80.54 -41.89 23.37 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.213 1.005 . . . . 0.0 111.999 177.032 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 52.0 t -60.37 -41.8 94.51 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.417 -0.802 . . . . 0.0 111.994 169.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 88.8 mtp -60.07 -43.88 95.13 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 121.305 -0.872 . . . . 0.0 112.827 175.489 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -72.06 -28.3 63.25 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 179.13 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 -66.32 -44.33 83.68 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.217 -0.927 . . . . 0.0 111.071 169.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -58.5 -47.53 83.78 Favored 'General case' 0 CA--C 1.539 0.519 0 O-C-N 121.273 -0.892 . . . . 0.0 112.422 172.225 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -61.55 -39.3 90.61 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 118.635 0.652 . . . . 0.0 111.724 177.225 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 89.2 m -63.61 -44.71 93.18 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.88 0.872 . . . . 0.0 111.972 176.292 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 52.0 ttp -56.67 -52.7 63.9 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.011 0.924 . . . . 0.0 112.675 176.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -68.48 -34.42 75.9 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 17.5 m -59.34 -52.05 67.31 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.295 1.038 . . . . 0.0 111.807 173.197 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 -57.48 -37.43 72.91 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.89 0.876 . . . . 0.0 112.193 -178.366 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 94.6 m -57.11 -44.12 82.97 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.18 0.992 . . . . 0.0 112.188 173.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -69.65 -30.05 67.66 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.393 1.077 . . . . 0.0 113.68 176.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 82.3 mt -74.26 -57.57 6.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 123.476 0.711 . . . . 0.0 110.747 178.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 37.4 t80 -68.11 -30.25 69.36 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 114.068 1.136 . . . . 0.0 114.068 -173.132 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 37.9 m-80 -113.74 162.92 15.69 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.981 0.912 . . . . 0.0 112.803 -169.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -68.6 148.12 98.06 Favored Pre-proline 0 N--CA 1.472 0.633 0 C-N-CA 124.635 1.174 . . . . 0.0 110.321 175.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -65.85 -6.89 15.18 Favored 'Trans proline' 0 CA--C 1.544 1.016 0 C-N-CA 123.718 2.945 . . . . 0.0 114.654 -176.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 53.9 p -114.3 -0.48 13.85 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 126.686 1.994 . . . . 0.0 113.199 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -66.3 147.2 53.66 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 121.528 -0.732 . . . . 0.0 110.967 173.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -52.56 -47.79 66.58 Favored 'General case' 0 CA--C 1.536 0.432 0 O-C-N 121.562 -0.711 . . . . 0.0 112.422 179.154 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.2 tp -58.37 -30.31 40.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -179.224 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 41.0 t -71.56 -47.43 58.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 O-C-N 121.499 -0.751 . . . . 0.0 110.332 173.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 76.1 mt -61.86 -36.73 82.09 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.124 0.875 . . . . 0.0 111.844 177.409 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 13.5 mtt -59.15 -51.53 69.63 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 124.638 1.175 . . . . 0.0 111.936 170.025 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.94 -39.07 90.82 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.265 0.626 . . . . 0.0 112.675 177.257 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 88.4 mt-30 -61.33 -47.76 84.42 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 119.121 0.873 . . . . 0.0 111.826 173.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -61.61 -45.59 93.44 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.73 0.812 . . . . 0.0 112.48 178.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 83.5 mt -65.91 -44.72 84.38 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.761 0.824 . . . . 0.0 112.268 175.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -65.08 -36.19 83.54 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 120.972 -1.08 . . . . 0.0 112.755 -177.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 55.0 mtmt -58.68 -45.5 89.3 Favored 'General case' 0 N--CA 1.474 0.746 0 O-C-N 121.5 -0.75 . . . . 0.0 111.701 172.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 93.2 mt -66.86 -43.51 89.54 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 123.507 0.723 . . . . 0.0 110.927 176.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -51.69 -51.42 56.12 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.757 0.823 . . . . 0.0 111.136 173.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 91.9 mt -61.98 -41.77 98.39 Favored 'General case' 0 CA--C 1.541 0.603 0 O-C-N 121.738 -0.601 . . . . 0.0 112.573 178.015 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 91.2 mm-40 -61.44 -36.47 80.49 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 119.392 0.997 . . . . 0.0 113.173 174.269 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 66.9 mmtt -72.62 -51.57 19.09 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.973 0.909 . . . . 0.0 112.435 177.311 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 6.0 m -67.98 -24.85 30.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 CA-C-N 120.333 1.424 . . . . 0.0 112.352 179.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -59.14 -27.19 65.39 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.535 -0.728 . . . . 0.0 112.833 171.18 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -99.84 2.22 43.7 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.539 1.536 . . . . 0.0 112.427 178.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 11.2 ttm -55.7 141.05 66.21 Favored Pre-proline 0 CA--C 1.548 0.869 0 C-N-CA 124.671 1.188 . . . . 0.0 111.824 172.553 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -67.24 122.15 9.38 Favored 'Trans proline' 0 CA--C 1.538 0.68 0 C-N-CA 122.996 2.464 . . . . 0.0 109.566 169.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -70.63 -17.99 62.87 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -171.453 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 9.8 mp0 -94.39 159.58 15.05 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.551 1.54 . . . . 0.0 111.941 179.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -120.96 129.81 53.59 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.113 1.365 . . . . 0.0 110.856 -175.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 9.5 p -152.63 151.41 11.87 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 124.624 1.17 . . . . 0.0 112.338 -179.329 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -57.24 137.91 55.38 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.55 1.54 . . . . 0.0 112.619 169.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 52.0 mt -78.32 139.27 38.84 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.486 0.714 . . . . 0.0 112.444 169.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 4.5 pp -75.52 153.99 85.68 Favored Pre-proline 0 CA--C 1.552 1.032 0 C-N-CA 123.885 0.874 . . . . 0.0 111.237 168.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 80.9 Cg_endo -76.79 151.16 31.45 Favored 'Trans proline' 0 CA--C 1.546 1.078 0 C-N-CA 123.177 2.585 . . . . 0.0 112.132 -178.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -71.99 157.64 54.16 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 123.258 2.639 . . . . 0.0 112.648 -179.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -71.81 154.14 92.92 Favored Pre-proline 0 CA--C 1.552 1.041 0 C-N-CA 124.371 1.069 . . . . 0.0 112.742 175.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -71.88 170.97 17.52 Favored 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 123.587 2.858 . . . . 0.0 112.403 171.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 49.1 mmtm -60.2 152.59 24.25 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.585 1.154 . . . . 0.0 112.609 174.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . -93.03 -173.63 40.76 Favored Glycine 0 CA--C 1.536 1.381 0 C-N-CA 125.101 1.334 . . . . 0.0 114.116 179.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . 0.406 ' HA ' ' HE2' ' A' ' 155' ' ' LYS . 0.4 OUTLIER . . . . . 0 C--O 1.252 1.194 0 C-N-CA 125.707 1.603 . . . . 0.0 112.961 176.039 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.491 0 N-CA-C 111.222 -0.751 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 24.5 t -151.19 68.48 0.93 Allowed 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.023 1.329 . . . . 0.0 111.203 -177.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.2 t -142.53 166.71 23.91 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 125.195 1.398 . . . . 0.0 111.845 -178.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 78.52 -32.66 1.85 Allowed Glycine 0 CA--C 1.538 1.507 0 C-N-CA 125.917 1.722 . . . . 0.0 115.471 177.211 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 66.9 m -74.41 -35.97 63.46 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 118.407 1.104 . . . . 0.0 112.512 174.325 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.4 m -74.43 152.23 39.51 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.638 1.175 . . . . 0.0 111.335 170.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 76.63 38.03 33.35 Favored Glycine 0 CA--C 1.534 1.26 0 O-C-N 121.843 -0.535 . . . . 0.0 112.377 -173.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.7 pm0 -53.67 157.94 2.07 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.919 1.688 . . . . 0.0 114.033 178.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 20.8 m -94.37 -14.27 8.14 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 C-N-CA 124.429 1.092 . . . . 0.0 113.763 -170.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.7 t -133.95 155.37 50.05 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.363 1.465 . . . . 0.0 111.536 -176.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 17.6 p-10 -121.99 102.2 41.1 Favored Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 125.617 1.567 . . . . 0.0 112.617 -168.425 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -73.75 -25.61 14.43 Favored 'Trans proline' 0 CA--C 1.543 0.948 0 C-N-CA 122.651 2.234 . . . . 0.0 113.155 173.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 42.2 m -141.82 -24.92 0.69 Allowed 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 115.165 1.543 . . . . 0.0 115.165 -174.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 25.1 ttmm -63.66 131.71 94.96 Favored Pre-proline 0 N--CA 1.478 0.964 0 CA-C-N 119.507 1.049 . . . . 0.0 110.907 177.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -74.14 155.11 47.22 Favored 'Trans proline' 0 CA--C 1.54 0.778 0 C-N-CA 123.011 2.474 . . . . 0.0 112.849 -178.251 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 171.2 173.41 38.21 Favored Glycine 0 CA--C 1.534 1.232 0 C-N-CA 125.5 1.524 . . . . 0.0 112.056 178.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 37.7 ptt180 -155.11 156.8 36.45 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.569 1.548 . . . . 0.0 110.74 172.074 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 36.3 mtpt -76.02 143.16 41.61 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 121.285 0.564 . . . . 0.0 110.053 168.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 67.0 p -139.45 165.41 27.31 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 125.134 1.373 . . . . 0.0 109.953 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 27.1 p-10 -52.49 -31.33 34.58 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 171.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.5 mm100 -67.91 -50.43 56.25 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.775 0.83 . . . . 0.0 111.377 176.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.0 mt -65.51 -32.65 74.37 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.736 -0.603 . . . . 0.0 112.519 175.255 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -61.6 -50.63 71.82 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 118.341 0.518 . . . . 0.0 110.77 169.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 65.4 t80 -57.61 -41.26 80.91 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.624 0.77 . . . . 0.0 112.313 178.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 91.0 mmm -56.91 -50.41 72.65 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 121.886 -0.509 . . . . 0.0 112.115 171.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -83.2 -10.07 58.8 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.704 1.372 . . . . 0.0 114.704 -174.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 61.9 t30 -119.79 -15.87 8.82 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.196 1.399 . . . . 0.0 113.297 -169.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 42.0 t -130.28 -53.56 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 C-N-CA 123.281 0.632 . . . . 0.0 110.96 176.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.6 t -69.83 -65.72 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 123.119 0.568 . . . . 0.0 110.77 -172.033 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 79.4 t -57.19 -46.0 84.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 124.398 1.079 . . . . 0.0 110.368 173.02 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.8 tttt -59.84 -40.05 87.19 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.386 0.674 . . . . 0.0 112.734 -175.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 62.7 m -73.85 -45.45 50.99 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 118.343 0.52 . . . . 0.0 111.801 174.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 67.9 mt -62.03 -33.46 74.41 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.295 0.638 . . . . 0.0 112.388 179.134 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 25.0 t-105 -69.46 -31.26 69.44 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.428 1.491 . . . . 0.0 113.188 175.085 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 56.4 mtmt -82.49 -5.34 58.65 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 113.692 0.997 . . . . 0.0 113.692 176.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 39.4 t-80 -64.22 156.38 28.92 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.6 1.16 . . . . 0.0 113.401 -179.023 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 19.2 mm100 -59.69 -23.27 62.98 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.241 1.416 . . . . 0.0 114.104 175.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -124.65 20.22 8.6 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.214 1.406 . . . . 0.0 113.48 -172.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.64 -26.59 64.49 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.102 1.361 . . . . 0.0 113.958 176.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 64.1 p-90 -58.87 -34.16 22.22 Favored Pre-proline 0 CA--C 1.547 0.84 0 N-CA-C 117.875 2.546 . . . . 0.0 117.875 -169.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -77.75 -0.18 10.4 Favored 'Trans proline' 0 CA--C 1.544 0.994 0 CA-C-N 123.213 2.183 . . . . 0.0 113.387 175.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -114.63 -3.67 12.88 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.759 1.624 . . . . 0.0 113.158 178.182 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 18.4 m-30 -62.68 -7.52 5.0 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 115.276 1.584 . . . . 0.0 115.276 179.443 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 25.1 pt20 -159.66 157.98 26.89 Favored Pre-proline 0 CA--C 1.545 0.773 0 C-N-CA 126.188 1.795 . . . . 0.0 110.009 -169.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -66.08 142.25 67.14 Favored 'Trans proline' 0 CA--C 1.538 0.676 0 C-N-CA 122.702 2.268 . . . . 0.0 111.731 177.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 68.1 t -60.3 139.0 20.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 123.859 0.864 . . . . 0.0 111.322 173.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 50.6 m-20 -114.4 107.09 15.09 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.079 1.352 . . . . 0.0 109.497 169.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.32 -26.89 63.59 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.148 0.979 . . . . 0.0 113.419 177.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 80.3 mt -66.56 -50.17 68.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 124.979 1.311 . . . . 0.0 110.864 173.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -64.56 -40.66 95.98 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.547 1.139 . . . . 0.0 112.695 -178.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 47.7 mt -88.78 -0.76 57.63 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.555 1.142 . . . . 0.0 114.007 179.621 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 61.0 t30 52.28 58.07 5.8 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.019 1.728 . . . . 0.0 113.68 -179.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 54.2 mt -114.42 83.21 8.32 Favored Pre-proline 0 CA--C 1.547 0.842 0 C-N-CA 126.331 1.852 . . . . 0.0 110.089 -176.074 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -67.79 -7.44 19.53 Favored 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 124.207 3.271 . . . . 0.0 115.456 -169.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -130.38 19.04 5.31 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.774 1.63 . . . . 0.0 112.257 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 70.4 t80 -46.96 -56.44 6.39 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.496 1.118 . . . . 0.0 113.526 -173.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -76.23 -3.07 34.44 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 114.608 1.336 . . . . 0.0 114.608 -179.128 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -84.1 -42.0 16.53 Favored 'General case' 0 N--CA 1.477 0.879 0 O-C-N 121.127 -0.983 . . . . 0.0 110.855 173.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.2 mp -81.67 -51.04 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 124.103 0.961 . . . . 0.0 110.408 173.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.418 HD11 ' HB2' ' A' ' 115' ' ' TYR . 44.2 mm -71.92 114.47 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 CA-C-O 121.556 0.693 . . . . 0.0 110.142 178.864 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 70.6 mmtt -83.85 -27.93 28.37 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.619 1.168 . . . . 0.0 113.045 179.595 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 21.4 p30 -153.16 81.63 5.05 Favored Pre-proline 0 CA--C 1.548 0.866 0 C-N-CA 126.09 1.756 . . . . 0.0 111.326 -170.025 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -69.17 138.11 38.86 Favored 'Trans proline' 0 CA--C 1.54 0.791 0 C-N-CA 123.498 2.799 . . . . 0.0 111.097 -179.126 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.8 tpt -154.59 141.19 18.91 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.236 1.414 . . . . 0.0 110.03 -178.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -144.68 148.14 33.87 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.397 1.479 . . . . 0.0 111.139 -177.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.6 ttp -57.19 -36.2 70.55 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.903 1.281 . . . . 0.0 113.3 -172.216 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.89 -22.82 60.54 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 125.127 1.346 . . . . 0.0 114.603 173.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 24.5 m -97.12 -34.59 11.09 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.846 1.258 . . . . 0.0 111.425 174.229 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 81.4 mt -53.94 -50.93 50.08 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 CA-C-N 119.31 0.959 . . . . 0.0 110.569 173.145 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -61.88 -32.5 72.87 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 178.096 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.432 ' HA ' ' HE3' ' A' ' 88' ' ' LYS . 1.1 tpmt? -68.78 -31.9 71.26 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -175.238 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 3.8 ptp180 -78.08 -26.45 48.17 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 113.941 1.089 . . . . 0.0 113.941 170.041 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 82.2 mt -70.66 -31.45 68.38 Favored 'General case' 0 N--CA 1.481 1.092 0 CA-C-N 119.648 1.113 . . . . 0.0 113.037 168.414 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -68.18 3.61 1.58 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.401 1.48 . . . . 0.0 113.476 171.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -130.74 163.18 27.85 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 127.685 2.394 . . . . 0.0 110.484 175.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -83.31 37.5 0.56 Allowed 'General case' 0 CA--C 1.55 0.966 0 O-C-N 120.834 -1.166 . . . . 0.0 111.581 169.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -60.76 -32.14 71.46 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.088 1.355 . . . . 0.0 114.32 -168.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -132.99 175.88 8.98 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 127.602 2.361 . . . . 0.0 111.057 178.199 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 9.7 t-105 -100.95 -25.91 13.92 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.893 1.277 . . . . 0.0 112.886 -178.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 34.7 t -143.77 148.64 35.91 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.287 1.035 . . . . 0.0 112.82 -170.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -65.36 -18.8 65.6 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 115.991 1.848 . . . . 0.0 115.991 -174.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 32.6 t -56.08 -32.48 64.16 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.398 0.999 . . . . 0.0 112.603 178.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -63.53 -45.97 88.13 Favored 'General case' 0 CA--C 1.544 0.727 0 O-C-N 121.272 -0.892 . . . . 0.0 112.264 173.499 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 48.8 t -65.28 -37.1 86.13 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.869 0.868 . . . . 0.0 112.602 174.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 82.5 mtp -65.65 -40.47 92.51 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.724 0.81 . . . . 0.0 111.881 175.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -62.1 -39.8 93.72 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.369 0.668 . . . . 0.0 112.076 170.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 85.2 m-20 -64.28 -39.58 94.23 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.366 0.985 . . . . 0.0 112.73 175.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -61.01 -46.98 88.54 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.5 -0.75 . . . . 0.0 112.315 170.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 17.5 t30 -56.63 -45.25 81.66 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.084 0.553 . . . . 0.0 111.893 174.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 52.3 m -62.51 -40.36 96.47 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.381 1.072 . . . . 0.0 112.687 175.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 53.1 ttp -59.52 -52.32 66.09 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 119.708 1.14 . . . . 0.0 112.061 177.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -68.45 -39.81 81.32 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 179.619 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 85.6 m -64.72 -47.55 77.89 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.588 0.755 . . . . 0.0 112.037 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -64.69 -31.94 73.39 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 119.024 0.829 . . . . 0.0 112.121 -179.551 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 81.3 m -61.66 -43.44 98.86 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.816 0.846 . . . . 0.0 112.794 170.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -68.02 -32.2 72.41 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.929 1.085 . . . . 0.0 113.929 178.66 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 92.3 mt -64.38 -57.63 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 C-N-CA 123.471 0.708 . . . . 0.0 110.994 177.21 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . 0.418 ' HB2' HD11 ' A' ' 77' ' ' ILE . 31.0 t80 -68.79 -35.94 77.65 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 114.375 1.25 . . . . 0.0 114.375 -172.301 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 64.1 m-80 -103.98 159.84 15.33 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.804 0.841 . . . . 0.0 113.164 -169.22 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 3.4 mppt? -66.0 148.44 98.34 Favored Pre-proline 0 N--CA 1.472 0.667 0 C-N-CA 124.187 0.995 . . . . 0.0 110.523 172.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -65.37 -7.8 16.96 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 123.563 2.842 . . . . 0.0 114.567 -177.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 69.5 p -115.53 1.79 13.69 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 126.473 1.909 . . . . 0.0 113.108 179.518 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -65.89 143.73 57.26 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 121.491 -0.756 . . . . 0.0 110.509 173.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -52.59 -45.62 66.59 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.633 -0.667 . . . . 0.0 112.526 -178.422 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 9.5 tp -56.55 -34.7 42.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 124.637 1.175 . . . . 0.0 113.885 177.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 55.7 t -71.49 -42.52 72.71 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 C-N-CA 123.403 0.681 . . . . 0.0 110.65 175.124 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 66.5 mt -62.37 -36.24 81.65 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.099 0.863 . . . . 0.0 111.917 175.196 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -58.11 -53.45 58.11 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 118.298 0.499 . . . . 0.0 110.919 170.597 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -59.39 -41.43 89.35 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 123.745 0.818 . . . . 0.0 112.399 179.314 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -61.16 -39.9 91.84 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.999 0.92 . . . . 0.0 113.12 175.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -79.13 -31.57 44.17 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 85.1 mt -71.02 -46.4 62.2 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.351 0.66 . . . . 0.0 111.297 170.053 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -63.31 -38.04 89.6 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 121.102 -0.999 . . . . 0.0 113.244 -173.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 4.9 ptpp? -60.14 -39.36 86.06 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 121.456 -0.778 . . . . 0.0 112.543 175.136 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 78.4 mt -73.18 -41.2 58.53 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 C-N-CA 124.193 0.997 . . . . 0.0 111.518 175.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -50.96 -52.14 45.51 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 119.162 0.892 . . . . 0.0 110.438 172.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.3 mt -63.63 -40.1 96.03 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 118.558 -0.734 . . . . 0.0 112.909 177.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -68.43 -30.56 69.48 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 120.373 1.442 . . . . 0.0 112.657 179.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 69.0 mmtt -75.94 -48.19 22.19 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 117.89 -1.052 . . . . 0.0 112.301 176.122 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.9 m -67.84 -25.79 33.33 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 CA-C-N 120.765 1.62 . . . . 0.0 112.04 176.398 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -62.19 -30.53 71.13 Favored 'General case' 0 CA--C 1.541 0.609 0 O-C-N 121.492 -0.755 . . . . 0.0 112.477 171.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -91.29 -3.26 57.02 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.062 1.345 . . . . 0.0 112.913 176.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 5.9 ttm -57.0 141.2 76.5 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 124.152 0.981 . . . . 0.0 111.271 171.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -63.05 144.23 92.31 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 C-N-CA 122.494 2.129 . . . . 0.0 109.911 168.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -74.87 -23.46 58.4 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 114.239 1.199 . . . . 0.0 114.239 -179.115 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -100.04 155.25 17.82 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.636 1.574 . . . . 0.0 113.024 -169.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -112.79 137.1 51.62 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.962 1.705 . . . . 0.0 111.229 -174.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 12.7 p -146.62 141.18 20.69 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 C-N-CA 124.657 1.183 . . . . 0.0 110.735 172.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -68.52 134.71 50.47 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.509 1.124 . . . . 0.0 111.074 175.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 96.0 mt -69.74 138.81 53.13 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 -175.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 4.5 pp -64.04 153.46 84.93 Favored Pre-proline 0 CA--C 1.55 0.965 0 C-N-CA 124.72 1.208 . . . . 0.0 112.059 169.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -75.08 149.68 36.74 Favored 'Trans proline' 0 CA--C 1.543 0.968 0 C-N-CA 123.064 2.51 . . . . 0.0 111.824 -178.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -70.63 157.84 57.53 Favored 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 123.116 2.544 . . . . 0.0 112.091 179.408 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -66.72 149.88 97.96 Favored Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 123.283 0.633 . . . . 0.0 111.496 171.226 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -68.21 155.19 70.31 Favored 'Trans proline' 0 CA--C 1.54 0.809 0 C-N-CA 122.651 2.234 . . . . 0.0 111.608 176.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -116.24 34.3 5.08 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 125.632 1.573 . . . . 0.0 111.974 -175.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . -65.05 173.43 18.73 Favored Glycine 0 CA--C 1.538 1.472 0 C-N-CA 125.597 1.57 . . . . 0.0 114.275 176.196 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.252 1.22 0 C-N-CA 126.252 1.821 . . . . 0.0 111.325 -174.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.421 0 N-CA-C 111.851 -0.5 . . . . 0.0 111.851 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 83.7 p -153.53 171.69 18.34 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.075 1.35 . . . . 0.0 112.32 -178.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 45.9 m -157.76 146.81 19.6 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.795 1.638 . . . . 0.0 110.495 171.416 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 158.04 -161.47 31.56 Favored Glycine 0 CA--C 1.53 1.0 0 C-N-CA 124.889 1.233 . . . . 0.0 112.378 -174.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 34.4 m -154.22 147.72 25.11 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.635 1.174 . . . . 0.0 111.359 170.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 68.2 m -139.84 19.84 2.49 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 126.101 1.761 . . . . 0.0 112.183 177.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -168.93 57.92 0.2 Allowed Glycine 0 CA--C 1.529 0.916 0 C-N-CA 125.7 1.619 . . . . 0.0 111.341 -171.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.7 pm0 -53.33 162.41 0.76 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.393 1.877 . . . . 0.0 114.926 177.14 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 32.2 m -128.16 -16.84 2.47 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.238 0 C-N-CA 124.494 1.117 . . . . 0.0 113.705 -179.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 62.5 p -139.48 167.05 22.96 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 126.61 1.964 . . . . 0.0 111.204 -175.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 14.5 p30 -139.66 154.3 71.03 Favored Pre-proline 0 CA--C 1.545 0.759 0 C-N-CA 124.483 1.113 . . . . 0.0 112.543 -171.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -77.09 -42.3 0.31 Allowed 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 123.339 2.692 . . . . 0.0 112.177 169.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.1 m -153.18 90.93 1.47 Allowed 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.678 1.591 . . . . 0.0 111.792 -173.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 62.3 tttp -152.11 134.58 8.78 Favored Pre-proline 0 N--CA 1.477 0.887 0 C-N-CA 126.09 1.756 . . . . 0.0 109.847 173.259 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -71.07 148.52 56.78 Favored 'Trans proline' 0 CA--C 1.536 0.607 0 C-N-CA 122.519 2.146 . . . . 0.0 112.531 -178.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 168.81 158.12 12.36 Favored Glycine 0 CA--C 1.531 1.038 0 C-N-CA 123.991 0.805 . . . . 0.0 114.474 177.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 -162.9 163.55 26.3 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 127.65 2.38 . . . . 0.0 109.586 170.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.8 ttmm -73.0 142.57 47.74 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 122.907 0.483 . . . . 0.0 111.634 177.462 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 82.6 p -138.7 165.16 27.68 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.935 1.694 . . . . 0.0 109.51 -179.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 22.2 t30 -51.36 -31.43 22.11 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 114.168 1.173 . . . . 0.0 114.168 174.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 69.3 mt-30 -74.84 -48.79 23.23 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.166 -0.959 . . . . 0.0 112.791 174.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 89.1 mt -61.95 -31.43 71.77 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 120.331 1.423 . . . . 0.0 112.479 173.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.5 tp60 -60.8 -52.67 64.09 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.107 0.963 . . . . 0.0 110.906 170.462 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 83.5 t80 -55.83 -41.95 75.02 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.088 0.955 . . . . 0.0 112.446 176.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 87.9 mmm -55.21 -53.99 49.0 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 122.685 0.394 . . . . 0.0 111.267 172.066 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -70.67 -22.93 62.43 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 114.833 1.42 . . . . 0.0 114.833 -178.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 18.8 m-80 -108.04 -17.23 14.09 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 115.074 1.509 . . . . 0.0 115.074 -168.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.6 t -138.83 -41.08 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 CA-C-N 119.078 0.854 . . . . 0.0 112.036 -176.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 11.9 t -71.62 -69.96 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 176.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 69.5 t -58.36 -48.63 84.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 126.138 1.775 . . . . 0.0 111.495 177.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 70.2 tttt -56.54 -43.43 79.86 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.491 0.716 . . . . 0.0 112.884 -171.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 60.4 m -85.28 -34.93 21.81 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.327 0.651 . . . . 0.0 112.455 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 68.6 mt -59.65 -32.85 70.83 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 119.629 1.104 . . . . 0.0 111.712 169.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 29.3 t-105 -73.14 -34.41 66.07 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 126.048 1.739 . . . . 0.0 113.162 175.068 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp -76.03 -11.17 59.9 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.554 1.142 . . . . 0.0 113.982 174.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 55.7 t-80 -61.23 150.83 33.36 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.168 1.387 . . . . 0.0 113.181 -178.188 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -60.37 -20.94 61.41 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.014 1.326 . . . . 0.0 113.727 178.357 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -116.06 16.81 16.01 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.535 1.534 . . . . 0.0 113.643 -178.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.67 -29.85 65.06 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 113.979 1.103 . . . . 0.0 113.979 177.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 68.1 p-90 -57.67 -34.05 22.65 Favored Pre-proline 0 CA--C 1.548 0.9 0 N-CA-C 118.019 2.6 . . . . 0.0 118.019 -170.334 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -75.51 -4.78 15.75 Favored 'Trans proline' 0 CA--C 1.543 0.966 0 CA-C-N 123.598 2.321 . . . . 0.0 113.408 174.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -108.16 -4.52 17.59 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.38 1.472 . . . . 0.0 112.968 178.195 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.7 m-30 -64.47 -17.89 64.27 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 114.011 1.115 . . . . 0.0 114.011 179.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 7.7 mp0 -139.36 155.06 72.31 Favored Pre-proline 0 CA--C 1.544 0.747 0 C-N-CA 125.726 1.611 . . . . 0.0 110.203 -176.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -65.68 141.56 66.77 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 122.252 1.968 . . . . 0.0 111.888 174.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 50.7 t -56.93 145.54 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 124.561 1.144 . . . . 0.0 111.627 172.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -121.64 120.57 35.13 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 124.55 1.14 . . . . 0.0 110.049 169.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.55 -31.28 70.39 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 123.2 0.6 . . . . 0.0 112.59 178.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 81.8 mt -67.37 -49.69 69.38 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 C-N-CA 124.525 1.13 . . . . 0.0 110.923 173.552 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm -64.34 -39.35 93.72 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.219 1.408 . . . . 0.0 113.445 -176.296 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.4 mp -90.93 0.57 57.48 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.249 1.02 . . . . 0.0 113.058 177.233 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 65.9 t30 54.18 53.91 10.33 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 126.001 1.721 . . . . 0.0 113.636 -179.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 52.6 mt -111.51 95.31 26.39 Favored Pre-proline 0 CA--C 1.546 0.797 0 C-N-CA 126.415 1.886 . . . . 0.0 110.212 -174.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -68.92 -8.37 23.33 Favored 'Trans proline' 0 CA--C 1.544 1.022 0 C-N-CA 123.455 2.77 . . . . 0.0 114.632 -174.001 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -138.41 21.39 2.75 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 125.569 1.548 . . . . 0.0 112.881 -174.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 47.5 t80 -50.61 -55.13 17.73 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 120.44 -1.413 . . . . 0.0 113.484 -174.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -76.7 -10.56 59.47 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.692 1.197 . . . . 0.0 114.208 -179.154 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.3 mmmm -72.93 -44.33 61.32 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.404 1.082 . . . . 0.0 110.117 176.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.4 mp -81.41 -52.4 13.97 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 123.963 0.905 . . . . 0.0 110.075 172.542 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 20.5 mm -81.43 104.89 10.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 CA-C-O 122.183 0.992 . . . . 0.0 111.629 -176.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 69.8 mmtt -69.7 -35.09 74.78 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.856 1.662 . . . . 0.0 113.603 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 70.5 m-80 -143.1 94.34 6.35 Favored Pre-proline 0 CA--C 1.545 0.776 0 C-N-CA 125.79 1.636 . . . . 0.0 110.013 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -70.67 149.21 60.71 Favored 'Trans proline' 0 CA--C 1.538 0.721 0 C-N-CA 123.141 2.561 . . . . 0.0 111.103 178.161 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -153.93 136.06 14.77 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.434 1.094 . . . . 0.0 110.182 -174.596 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -143.82 148.98 36.32 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.56 1.944 . . . . 0.0 110.815 177.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.6 ttp -57.94 -34.31 69.76 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.797 1.239 . . . . 0.0 113.043 -171.469 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -56.87 -27.6 56.53 Favored Glycine 0 CA--C 1.532 1.145 0 C-N-CA 125.375 1.464 . . . . 0.0 114.394 173.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 43.7 m -78.38 -45.92 21.23 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 118.032 0.916 . . . . 0.0 110.878 169.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.9 mt -55.82 -53.76 34.01 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 C-N-CA 125.076 1.35 . . . . 0.0 111.754 -175.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 4.8 ptpt -54.15 -38.2 65.26 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 174.069 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.548 ' HE2' ' HA ' ' A' ' 88' ' ' LYS . 0.2 OUTLIER -71.03 -39.31 72.41 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.156 0.982 . . . . 0.0 113.179 -176.996 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 12.4 ptp180 -72.43 -32.34 66.23 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 113.683 0.994 . . . . 0.0 113.683 172.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 53.2 mt -61.19 -43.54 98.71 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.416 0.686 . . . . 0.0 112.821 169.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -59.63 -39.37 84.1 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 -176.138 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -108.55 17.21 22.26 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 -171.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 27.1 m-20 54.79 59.72 3.92 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.467 1.907 . . . . 0.0 114.159 174.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 76.6 t80 -63.55 -20.5 65.69 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.401 1.08 . . . . 0.0 113.588 178.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -145.06 177.48 8.74 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 129.483 3.113 . . . . 0.0 110.768 -173.62 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.7 t-105 -104.47 -27.5 11.88 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.264 1.026 . . . . 0.0 112.843 174.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 20.2 m -126.15 138.62 53.68 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.078 0.951 . . . . 0.0 113.273 -168.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -65.52 -19.74 66.05 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 115.939 1.829 . . . . 0.0 115.939 -175.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 16.8 m -56.55 -28.0 59.05 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.179 0.9 . . . . 0.0 112.826 173.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 56.5 mm-40 -70.35 -43.72 69.61 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.629 0.771 . . . . 0.0 112.03 173.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 42.8 t -62.51 -36.41 82.46 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 121.437 -0.789 . . . . 0.0 112.46 172.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 79.0 mtp -63.64 -40.04 95.87 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 121.392 -0.818 . . . . 0.0 112.36 175.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.06 -32.01 73.28 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.262 0.625 . . . . 0.0 112.144 174.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -72.85 -42.45 63.71 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.505 0.722 . . . . 0.0 111.554 178.087 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 -59.49 -46.28 89.26 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 118.546 0.612 . . . . 0.0 112.148 169.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 24.5 t30 -56.84 -44.51 82.17 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.02 0.528 . . . . 0.0 112.054 174.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 36.8 m -66.54 -36.41 82.6 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.852 0.861 . . . . 0.0 112.265 178.174 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 48.5 ttp -61.62 -55.47 30.25 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.27 -0.894 . . . . 0.0 112.083 174.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -65.72 -38.66 89.79 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 122.039 -0.413 . . . . 0.0 111.845 -179.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 91.8 m -66.0 -46.3 78.47 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 121.572 -0.705 . . . . 0.0 112.46 178.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.1 p30 -63.79 -31.64 72.88 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 120.117 1.326 . . . . 0.0 112.315 178.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 33.4 m -59.78 -47.51 85.39 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 118.917 -0.563 . . . . 0.0 112.047 169.089 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -68.51 -31.06 70.04 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 114.048 1.129 . . . . 0.0 114.048 179.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 88.2 mt -67.78 -59.3 3.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 123.304 0.642 . . . . 0.0 110.607 175.195 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 32.2 t80 -71.79 -35.15 69.9 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 114.023 1.119 . . . . 0.0 114.023 -171.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -105.8 155.09 19.64 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.334 1.053 . . . . 0.0 111.64 -172.308 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -72.91 154.04 91.0 Favored Pre-proline 0 N--CA 1.471 0.609 0 C-N-CA 124.304 1.041 . . . . 0.0 110.429 178.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -64.78 -0.82 3.45 Favored 'Trans proline' 0 CA--C 1.545 1.05 0 C-N-CA 123.748 2.965 . . . . 0.0 114.883 -179.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 64.5 p -116.31 -2.58 12.08 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 126.999 2.12 . . . . 0.0 113.134 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 62.4 m-20 -71.51 143.21 50.06 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 119.08 0.854 . . . . 0.0 110.449 171.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -56.05 -47.34 78.09 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 121.538 -0.726 . . . . 0.0 112.373 -175.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.5 tp -52.34 -30.91 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 125.201 1.4 . . . . 0.0 114.332 177.029 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 52.4 t -74.05 -47.19 43.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 O-C-N 121.569 -0.707 . . . . 0.0 110.809 174.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 76.1 mt -61.48 -37.35 83.32 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 119.237 0.926 . . . . 0.0 111.66 177.105 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 7.8 mtp -60.13 -50.77 72.36 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.506 1.523 . . . . 0.0 111.999 170.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.91 -39.68 90.27 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.55 0.74 . . . . 0.0 112.824 175.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 88.9 mt-30 -60.83 -48.53 81.4 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 119.413 1.006 . . . . 0.0 111.823 173.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -61.19 -42.64 98.94 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.512 0.725 . . . . 0.0 112.671 178.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 86.7 mt -66.02 -45.84 80.04 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.607 0.763 . . . . 0.0 112.067 173.381 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -64.43 -39.65 94.24 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 121.054 -1.028 . . . . 0.0 112.621 -176.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 5.2 mtpm? -56.3 -36.98 69.27 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 121.529 -0.732 . . . . 0.0 112.041 175.038 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 68.4 mt -75.24 -46.65 38.15 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 123.627 0.771 . . . . 0.0 111.073 173.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 43.9 t80 -49.25 -48.22 45.92 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 119.933 1.242 . . . . 0.0 111.771 174.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.3 mt -65.43 -38.89 91.25 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.32 -0.862 . . . . 0.0 113.046 178.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -67.6 -29.37 68.69 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 119.97 1.259 . . . . 0.0 112.376 176.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 28.7 mmtp -75.53 -49.98 17.05 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.25 1.42 . . . . 0.0 112.577 178.624 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 7.1 m -69.84 -25.41 28.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 119.289 0.949 . . . . 0.0 111.736 178.163 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -61.65 -29.81 70.31 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.665 -0.647 . . . . 0.0 112.453 170.157 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -96.96 1.26 50.14 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.595 1.558 . . . . 0.0 112.626 177.268 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 8.4 ttm -54.13 139.67 54.51 Favored Pre-proline 0 CA--C 1.544 0.725 0 C-N-CA 124.271 1.028 . . . . 0.0 111.306 172.226 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -66.51 117.95 5.14 Favored 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 122.463 2.109 . . . . 0.0 108.568 169.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 -65.64 -28.49 69.15 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 -173.044 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -83.75 164.4 19.61 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.135 1.774 . . . . 0.0 111.953 172.138 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -132.24 143.22 49.77 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.111 0.964 . . . . 0.0 111.731 -175.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 55.0 t -130.69 133.29 63.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 C-N-CA 125.504 1.521 . . . . 0.0 110.371 -176.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -68.07 117.05 9.41 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.68 1.592 . . . . 0.0 111.221 170.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 80.6 mt -71.23 144.87 49.93 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 113.245 0.831 . . . . 0.0 113.245 -178.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 93.3 mt -76.99 155.17 82.84 Favored Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 124.596 1.158 . . . . 0.0 111.191 169.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -73.9 155.68 48.27 Favored 'Trans proline' 0 CA--C 1.547 1.144 0 C-N-CA 122.991 2.46 . . . . 0.0 112.503 178.616 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -73.53 163.26 38.0 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 123.712 2.941 . . . . 0.0 112.589 176.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -65.33 152.56 91.71 Favored Pre-proline 0 CA--C 1.553 1.066 0 C-N-CA 124.0 0.92 . . . . 0.0 112.485 172.081 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -70.82 161.56 45.66 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 123.341 2.694 . . . . 0.0 112.628 176.006 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 3.1 mptp? -70.73 164.04 25.92 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.861 1.264 . . . . 0.0 111.905 176.014 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . -143.33 22.67 2.23 Favored Glycine 0 CA--C 1.536 1.404 0 C-N-CA 125.027 1.299 . . . . 0.0 114.913 -176.31 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 62.4 tttp . . . . . 0 C--O 1.254 1.304 0 C-N-CA 126.367 1.867 . . . . 0.0 111.311 178.967 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.395 0 N-CA-C 111.617 -0.593 . . . . 0.0 111.617 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 58.7 p -60.51 -15.86 31.34 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 115.395 1.628 . . . . 0.0 115.395 -176.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 17.8 m -60.27 -24.17 64.7 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 125.436 1.494 . . . . 0.0 114.026 173.483 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 66.93 18.87 69.18 Favored Glycine 0 CA--C 1.538 1.529 0 C-N-CA 124.382 0.992 . . . . 0.0 114.762 -178.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 16.8 m -60.55 152.97 24.69 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.676 1.59 . . . . 0.0 113.153 -177.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.5 t -63.12 151.68 39.42 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.529 0.732 . . . . 0.0 112.172 174.075 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -169.83 35.58 0.18 Allowed Glycine 0 CA--C 1.534 1.238 0 C-N-CA 124.635 1.112 . . . . 0.0 113.556 -175.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -62.34 166.56 4.92 Favored 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 114.387 1.254 . . . . 0.0 114.387 178.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 30.8 m -138.26 -23.37 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.243 0 C-N-CA 125.198 1.399 . . . . 0.0 113.996 172.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.9 m -148.75 149.83 32.08 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 126.497 1.919 . . . . 0.0 111.411 171.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 22.2 m120 -148.62 135.67 10.57 Favored Pre-proline 0 CA--C 1.545 0.784 0 C-N-CA 126.092 1.757 . . . . 0.0 109.412 174.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -75.16 -19.93 17.04 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 123.367 2.711 . . . . 0.0 113.906 -178.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.8 t -72.45 -38.67 68.22 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.018 0.927 . . . . 0.0 113.212 -177.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt -75.27 143.28 76.42 Favored Pre-proline 0 N--CA 1.476 0.874 0 C-N-CA 123.611 0.765 . . . . 0.0 111.574 175.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -73.32 155.07 51.44 Favored 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 122.666 2.244 . . . . 0.0 111.281 169.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -178.09 158.71 23.79 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 123.893 0.759 . . . . 0.0 113.24 175.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 37.8 ptt180 -159.17 160.47 35.53 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.91 1.684 . . . . 0.0 110.982 175.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 22.5 ptmt -70.87 132.85 45.89 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.584 0.753 . . . . 0.0 110.837 169.408 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 77.4 p -140.62 161.59 37.39 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 125.076 1.35 . . . . 0.0 111.38 -177.087 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 26.5 p-10 -48.99 -38.94 24.71 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 114.066 1.135 . . . . 0.0 114.066 170.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -69.7 -51.22 36.39 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.65 0.78 . . . . 0.0 111.557 178.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.5 mt -65.73 -30.18 70.81 Favored 'General case' 0 CA--C 1.54 0.582 0 O-C-N 121.652 -0.655 . . . . 0.0 112.36 177.423 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 44.7 tt0 -60.8 -52.54 64.66 Favored 'General case' 0 C--O 1.224 -0.268 0 C-N-CA 123.427 0.691 . . . . 0.0 110.237 169.056 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -56.25 -42.18 76.96 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 118.836 0.744 . . . . 0.0 112.15 179.14 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 96.5 mmm -55.98 -50.71 70.06 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 172.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -84.44 -11.5 56.09 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -174.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 66.6 t30 -117.19 -18.86 9.88 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.55 1.54 . . . . 0.0 112.872 -170.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 6.0 t -133.6 -49.67 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 C-N-CA 123.606 0.762 . . . . 0.0 111.869 -177.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 22.3 t -69.28 -64.22 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 CA-C-N 119.095 0.861 . . . . 0.0 110.794 -176.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 45.0 t -53.83 -50.07 54.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 124.864 1.265 . . . . 0.0 109.841 171.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.3 tppt? -60.74 -26.35 67.13 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 -174.095 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 21.0 m -98.66 -39.65 8.57 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-N 118.948 0.795 . . . . 0.0 112.429 177.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 80.7 mt -59.0 -30.14 67.77 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.485 -0.759 . . . . 0.0 112.121 171.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . 0.429 ' CE3' ' HD3' ' A' ' 87' ' ' LYS . 27.5 t-105 -75.56 -39.22 58.47 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 114.826 1.417 . . . . 0.0 114.826 179.061 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 8.9 ptpp? -76.62 -10.42 59.38 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 177.116 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 60.3 t-80 -54.74 152.5 7.03 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.073 1.749 . . . . 0.0 113.456 -178.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 58.9 mt-30 -54.37 -25.57 25.11 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.813 1.645 . . . . 0.0 114.437 177.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -125.19 18.62 8.33 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.041 1.337 . . . . 0.0 113.705 -172.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.13 -24.85 63.25 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.391 1.476 . . . . 0.0 114.177 176.17 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 64.6 p-90 -58.14 -33.42 17.74 Favored Pre-proline 0 CA--C 1.547 0.851 0 N-CA-C 117.592 2.441 . . . . 0.0 117.592 -170.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -81.27 2.29 8.68 Favored 'Trans proline' 0 CA--C 1.547 1.133 0 CA-C-N 123.041 2.122 . . . . 0.0 113.237 175.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -113.38 -5.29 13.55 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.493 1.517 . . . . 0.0 113.572 178.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 23.4 m-30 -64.19 -17.99 64.06 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 119.848 1.204 . . . . 0.0 113.952 177.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -144.03 158.31 55.8 Favored Pre-proline 0 CA--C 1.546 0.819 0 C-N-CA 126.55 1.94 . . . . 0.0 110.625 -176.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -67.48 159.5 52.18 Favored 'Trans proline' 0 CA--C 1.537 0.635 0 C-N-CA 123.061 2.507 . . . . 0.0 112.476 172.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 60.1 t -70.86 107.08 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 123.85 0.86 . . . . 0.0 109.458 170.066 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 -72.39 79.95 1.03 Allowed 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.282 1.033 . . . . 0.0 110.517 169.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -51.16 -27.72 9.35 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.917 1.287 . . . . 0.0 114.348 -177.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 85.2 mt -64.0 -48.38 86.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 125.592 1.557 . . . . 0.0 111.566 172.136 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -75.96 -39.83 55.23 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.57 1.548 . . . . 0.0 112.899 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -74.74 -9.65 58.77 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.874 1.67 . . . . 0.0 113.094 176.085 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 57.75 55.0 5.77 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.426 1.891 . . . . 0.0 112.527 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 55.8 mt -116.1 78.96 8.07 Favored Pre-proline 0 CA--C 1.543 0.706 0 C-N-CA 126.241 1.816 . . . . 0.0 110.703 -178.444 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -66.87 -16.67 50.56 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 123.302 2.668 . . . . 0.0 112.999 -179.166 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 -100.96 7.54 43.5 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.903 1.681 . . . . 0.0 113.103 175.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 79.0 t80 -52.75 -56.48 15.34 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 120.462 -1.399 . . . . 0.0 112.398 -176.506 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -74.07 -15.08 61.08 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.776 1.23 . . . . 0.0 114.128 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 9.9 mptt -69.92 -31.88 69.88 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.042 0.937 . . . . 0.0 111.592 177.251 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.4 mp -102.05 -45.2 10.81 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 125.688 1.595 . . . . 0.0 111.27 176.077 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.599 HD11 ' HB2' ' A' ' 115' ' ' TYR . 34.4 mm -76.42 101.68 2.86 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 121.929 0.871 . . . . 0.0 111.151 179.006 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.68 -40.72 95.89 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.747 1.619 . . . . 0.0 112.983 172.026 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -144.22 98.77 5.05 Favored Pre-proline 0 CA--C 1.545 0.766 0 C-N-CA 125.347 1.459 . . . . 0.0 110.575 -176.362 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -74.49 147.31 36.16 Favored 'Trans proline' 0 CA--C 1.539 0.773 0 C-N-CA 123.206 2.604 . . . . 0.0 111.083 175.361 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.3 tpt -155.68 148.26 23.98 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.832 1.253 . . . . 0.0 110.557 178.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -147.46 154.45 40.81 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 125.686 1.595 . . . . 0.0 111.368 179.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.5 ttp -62.03 -36.96 83.14 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 123.856 0.862 . . . . 0.0 112.563 -171.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -56.11 -49.11 69.5 Favored Glycine 0 CA--C 1.532 1.142 0 C-N-CA 124.242 0.925 . . . . 0.0 112.615 177.198 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 85.2 m -69.67 -33.71 72.96 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 117.661 -1.161 . . . . 0.0 112.648 174.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 97.7 mt -56.56 -49.54 77.2 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 CA-C-N 120.663 1.574 . . . . 0.0 110.826 172.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.429 ' HD3' ' CE3' ' A' ' 51' ' ' TRP . 0.4 OUTLIER -60.35 -35.36 75.5 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 118.698 0.681 . . . . 0.0 112.511 174.941 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.452 ' HA ' ' HE3' ' A' ' 88' ' ' LYS . 1.4 tpmt? -65.73 -41.9 91.69 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 -179.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 13.3 ptp180 -67.68 -24.08 65.38 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 173.265 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 74.8 mt -75.66 -39.06 58.24 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 167.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -63.05 -27.26 69.28 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 114.845 1.424 . . . . 0.0 114.845 -176.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -137.04 136.28 38.27 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.907 1.683 . . . . 0.0 110.642 -179.312 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 -51.99 134.4 32.0 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.227 1.411 . . . . 0.0 113.81 -169.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 44.1 t80 -155.54 -34.48 0.09 Allowed 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.588 1.555 . . . . 0.0 112.981 179.109 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -134.86 176.79 8.33 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.234 1.414 . . . . 0.0 112.045 179.127 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 12.0 t-105 -115.16 -21.1 10.13 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.114 1.365 . . . . 0.0 113.31 -169.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 44.3 t -144.63 151.53 39.14 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 125.489 1.516 . . . . 0.0 111.207 -178.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -58.56 -22.55 56.13 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 115.572 1.693 . . . . 0.0 115.572 -177.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 39.5 m -54.8 -31.52 59.11 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 -179.044 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -68.87 -46.07 69.37 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 121.374 -0.829 . . . . 0.0 112.17 173.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 46.4 t -63.75 -36.34 83.54 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.515 1.126 . . . . 0.0 112.354 177.433 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 81.6 mtp -58.67 -40.56 83.89 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 123.93 0.892 . . . . 0.0 112.535 174.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -66.68 -32.57 73.98 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 174.314 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 -69.36 -39.29 78.17 Favored 'General case' 0 CA--C 1.541 0.634 0 O-C-N 120.98 -1.075 . . . . 0.0 111.759 173.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -60.35 -47.13 87.36 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.446 -0.784 . . . . 0.0 112.145 169.442 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -60.19 -41.08 92.16 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 121.665 -0.647 . . . . 0.0 111.429 175.4 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 86.0 m -62.31 -40.14 95.35 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.764 0.826 . . . . 0.0 111.756 177.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 48.0 ttp -59.64 -50.75 72.67 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.481 0.713 . . . . 0.0 112.305 175.431 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -71.08 -41.67 70.38 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -179.532 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 41.7 m -64.97 -46.75 80.17 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 121.358 -0.839 . . . . 0.0 112.09 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -63.23 -32.83 74.33 Favored 'General case' 0 CA--C 1.547 0.854 0 CA-C-N 119.585 1.084 . . . . 0.0 112.004 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 67.4 m -61.06 -43.23 99.2 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.904 0.882 . . . . 0.0 113.136 170.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 17.9 m-85 -67.52 -31.91 72.35 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 177.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 87.3 mt -68.18 -56.06 14.11 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.825 0 C-N-CA 123.266 0.626 . . . . 0.0 110.785 177.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . 0.599 ' HB2' HD11 ' A' ' 77' ' ' ILE . 34.5 t80 -69.41 -36.79 77.06 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 114.389 1.255 . . . . 0.0 114.389 -172.296 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 60.1 m-80 -101.01 158.71 15.8 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.245 1.018 . . . . 0.0 111.872 -172.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 3.7 mptp? -70.35 151.07 95.81 Favored Pre-proline 0 N--CA 1.47 0.568 0 C-N-CA 123.822 0.849 . . . . 0.0 109.671 174.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -65.45 -1.03 4.14 Favored 'Trans proline' 0 CA--C 1.546 1.076 0 C-N-CA 123.714 2.943 . . . . 0.0 114.725 -179.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 52.6 p -119.96 -2.19 10.32 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 127.266 2.226 . . . . 0.0 113.207 -179.431 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -67.44 145.54 54.91 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 118.837 0.744 . . . . 0.0 110.545 169.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -58.01 -40.89 81.93 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 121.561 -0.712 . . . . 0.0 112.386 -173.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 9.9 tp -55.59 -35.73 39.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 125.517 1.527 . . . . 0.0 113.877 178.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 46.4 t -67.35 -44.79 86.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 123.216 0.606 . . . . 0.0 110.456 174.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 53.0 mt -62.66 -36.17 82.0 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 118.588 0.631 . . . . 0.0 111.774 177.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 1.1 mmt -58.93 -52.16 66.94 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 122.765 0.426 . . . . 0.0 111.27 170.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -62.06 -38.82 90.21 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.459 0.703 . . . . 0.0 112.307 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -60.17 -47.48 85.75 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 119.227 0.921 . . . . 0.0 112.2 173.639 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -63.83 -44.56 92.84 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.437 0.695 . . . . 0.0 112.617 178.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 92.5 mt -65.91 -44.86 83.96 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.927 0.891 . . . . 0.0 112.135 176.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -63.26 -39.17 93.84 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 119.374 0.988 . . . . 0.0 112.615 -176.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -58.82 -40.86 85.39 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 121.381 -0.824 . . . . 0.0 112.107 175.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 85.0 mt -72.7 -41.78 62.29 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 123.624 0.77 . . . . 0.0 111.209 175.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -51.96 -51.39 57.42 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.891 0.768 . . . . 0.0 110.68 173.354 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 99.0 mt -62.58 -40.89 98.3 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.327 0.651 . . . . 0.0 112.665 177.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.73 -35.38 80.87 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 119.634 1.106 . . . . 0.0 112.729 176.498 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 71.0 mmtt -70.47 -52.87 19.0 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.748 1.219 . . . . 0.0 111.885 177.209 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 6.4 m -66.53 -24.12 32.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 CA-C-N 120.09 1.314 . . . . 0.0 112.313 179.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -64.79 -35.11 80.05 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.769 -0.582 . . . . 0.0 112.364 170.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -81.8 -16.72 50.01 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.372 1.069 . . . . 0.0 112.904 173.027 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 49.3 ttp -63.68 137.73 97.18 Favored Pre-proline 0 CA--C 1.546 0.818 0 CA-C-N 119.266 0.939 . . . . 0.0 110.937 174.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -68.48 136.23 35.98 Favored 'Trans proline' 0 CA--C 1.536 0.605 0 C-N-CA 122.786 2.324 . . . . 0.0 111.73 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -74.6 -22.95 58.68 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.216 1.006 . . . . 0.0 112.797 175.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -77.16 156.37 31.65 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.251 1.42 . . . . 0.0 111.783 173.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -126.58 135.78 51.69 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.377 1.471 . . . . 0.0 110.795 -174.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 12.7 p -148.22 140.32 18.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 C-N-CA 124.668 1.187 . . . . 0.0 110.946 174.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -70.15 132.32 45.62 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.5 1.12 . . . . 0.0 111.045 174.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 77.6 mt -72.57 158.15 36.23 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 -175.765 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 4.5 pp -61.79 153.93 69.46 Favored Pre-proline 0 CA--C 1.552 1.025 0 C-N-CA 124.882 1.273 . . . . 0.0 112.331 169.465 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -76.15 149.97 32.81 Favored 'Trans proline' 0 CA--C 1.545 1.04 0 C-N-CA 123.202 2.601 . . . . 0.0 112.252 -177.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -72.61 160.67 45.98 Favored 'Trans proline' 0 CA--C 1.539 0.765 0 C-N-CA 123.354 2.702 . . . . 0.0 112.497 178.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -64.62 150.31 94.17 Favored Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 123.657 0.783 . . . . 0.0 111.785 170.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -69.97 115.02 3.93 Favored 'Trans proline' 0 CA--C 1.54 0.777 0 C-N-CA 123.248 2.632 . . . . 0.0 111.62 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 8.3 mtpm? -81.61 -2.98 52.15 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 125.081 1.352 . . . . 0.0 113.756 177.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . -167.92 -112.19 0.26 Allowed Glycine 0 CA--C 1.533 1.181 0 C-N-CA 125.751 1.643 . . . . 0.0 111.353 -179.525 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 22.9 ptmt . . . . . 0 C--O 1.252 1.228 0 C-N-CA 124.949 1.3 . . . . 0.0 113.851 172.562 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.416 0 N-CA-C 111.11 -0.796 . . . . 0.0 111.11 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 75.5 p -68.58 166.25 17.5 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.801 1.24 . . . . 0.0 113.282 174.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 79.4 p -139.55 -4.67 1.42 Allowed 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 115.378 1.621 . . . . 0.0 115.378 -177.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 178.46 34.13 0.06 OUTLIER Glycine 0 CA--C 1.535 1.327 0 O-C-N 121.255 -0.903 . . . . 0.0 114.845 -178.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 20.1 t -69.99 -31.67 69.48 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.233 1.013 . . . . 0.0 113.504 -175.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 66.0 p -74.46 159.95 31.6 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.923 1.289 . . . . 0.0 113.577 -179.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -94.64 88.36 1.14 Allowed Glycine 0 CA--C 1.531 1.072 0 C-N-CA 125.523 1.535 . . . . 0.0 111.891 178.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -58.14 154.25 13.33 Favored 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 113.803 1.038 . . . . 0.0 113.803 174.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 32.6 m -134.97 -9.96 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.466 0 C-N-CA 124.971 1.309 . . . . 0.0 114.414 -169.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 55.4 p -152.18 117.05 5.13 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 125.852 1.661 . . . . 0.0 110.036 -178.338 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 60.5 t-20 -149.35 114.68 3.58 Favored Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 124.193 0.997 . . . . 0.0 110.636 -174.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -72.7 -12.21 26.51 Favored 'Trans proline' 0 CA--C 1.542 0.896 0 C-N-CA 123.813 3.009 . . . . 0.0 113.973 -177.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.1 m -81.11 -5.5 57.73 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.147 0.979 . . . . 0.0 113.639 177.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -110.7 140.38 22.56 Favored Pre-proline 0 N--CA 1.472 0.669 0 C-N-CA 125.297 1.439 . . . . 0.0 111.395 -178.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -73.01 150.54 48.74 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.592 2.195 . . . . 0.0 111.487 173.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 163.71 168.49 25.8 Favored Glycine 0 CA--C 1.528 0.85 0 CA-C-O 122.252 0.918 . . . . 0.0 115.094 177.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 8.8 ptp180 -164.33 162.87 22.56 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 128.403 2.681 . . . . 0.0 108.724 173.566 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 50.5 tttt -73.51 124.38 25.75 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 168.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 62.6 p -122.26 165.76 15.7 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 125.043 1.337 . . . . 0.0 110.743 -176.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -50.33 -35.19 26.6 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.424 1.09 . . . . 0.0 113.589 171.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -70.76 -49.38 47.4 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 121.512 -0.743 . . . . 0.0 112.11 176.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.5 mt -64.2 -32.58 74.22 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 121.676 -0.64 . . . . 0.0 112.275 175.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 8.6 tp60 -60.51 -50.83 72.0 Favored 'General case' 0 C--O 1.223 -0.335 0 CA-C-O 118.47 -0.776 . . . . 0.0 110.434 170.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 60.9 t80 -56.83 -43.87 81.49 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.809 1.186 . . . . 0.0 112.269 177.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 93.3 mmm -55.08 -52.2 63.96 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 122.946 0.498 . . . . 0.0 112.083 172.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 -72.48 -30.95 64.99 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 114.294 1.22 . . . . 0.0 114.294 -177.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -91.56 -25.87 19.01 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.429 1.492 . . . . 0.0 113.271 -168.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 34.3 t -128.4 -52.18 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 C-N-CA 123.224 0.61 . . . . 0.0 111.443 -176.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 16.3 t -69.85 -65.87 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 C-N-CA 123.624 0.769 . . . . 0.0 110.468 -171.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 48.8 t -54.21 -49.74 60.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 C-N-CA 125.624 1.57 . . . . 0.0 110.13 173.067 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -53.33 -52.65 58.5 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 118.824 -0.608 . . . . 0.0 111.63 -177.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 25.4 m -70.91 -40.16 72.32 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 118.576 0.625 . . . . 0.0 112.407 -178.429 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 62.7 mt -59.67 -29.59 68.16 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 118.682 0.674 . . . . 0.0 112.141 172.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . 0.465 ' CZ3' ' HE3' ' A' ' 87' ' ' LYS . 26.8 t-105 -79.83 -33.88 39.89 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.902 1.681 . . . . 0.0 114.234 179.209 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 15.4 ptmt -80.05 -9.51 59.7 Favored 'General case' 0 N--CA 1.483 1.193 0 CA-C-N 119.968 1.258 . . . . 0.0 114.166 174.587 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 50.1 t-80 -55.42 151.57 9.96 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.771 1.628 . . . . 0.0 113.519 177.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.62 -17.38 21.63 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.765 1.626 . . . . 0.0 114.442 176.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -125.85 17.04 8.01 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.48 1.512 . . . . 0.0 114.043 -173.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.32 -29.97 65.65 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 177.263 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.409 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 41.5 p-90 -54.84 -36.98 50.77 Favored Pre-proline 0 CA--C 1.549 0.919 0 N-CA-C 117.543 2.423 . . . . 0.0 117.543 -171.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.409 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 73.1 Cg_endo -70.53 -3.03 11.69 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 CA-C-N 123.187 2.174 . . . . 0.0 114.7 173.136 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 -115.78 -3.25 12.24 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.345 1.458 . . . . 0.0 113.363 178.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -63.64 -27.45 69.24 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 119.511 1.051 . . . . 0.0 113.435 178.577 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -138.16 153.83 73.54 Favored Pre-proline 0 CA--C 1.542 0.652 0 C-N-CA 126.138 1.775 . . . . 0.0 110.003 -173.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -66.3 141.21 61.5 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 C-N-CA 122.416 2.077 . . . . 0.0 113.308 -175.316 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 54.5 t -57.08 136.23 20.28 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 124.716 1.206 . . . . 0.0 110.432 169.42 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -127.95 101.48 6.34 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 125.304 1.442 . . . . 0.0 109.983 178.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.0 -30.06 61.26 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.499 1.12 . . . . 0.0 113.924 -179.387 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 83.6 mt -67.77 -48.84 74.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 125.02 1.328 . . . . 0.0 111.109 175.085 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -66.21 -37.54 85.82 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.945 1.298 . . . . 0.0 112.96 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 72.3 mt -95.24 0.55 54.03 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.335 1.854 . . . . 0.0 113.103 -174.302 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 51.6 57.5 6.5 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.914 1.686 . . . . 0.0 113.036 -179.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 36.8 mt -113.92 78.24 4.06 Favored Pre-proline 0 CA--C 1.546 0.815 0 C-N-CA 126.042 1.737 . . . . 0.0 110.021 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -66.56 -7.34 17.62 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 124.387 3.392 . . . . 0.0 115.292 -169.421 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -130.71 17.79 5.22 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.942 1.697 . . . . 0.0 112.204 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 69.8 t80 -46.55 -54.61 9.03 Favored 'General case' 0 N--CA 1.476 0.849 0 O-C-N 120.997 -1.064 . . . . 0.0 113.486 -174.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -76.24 -8.88 58.03 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.013 1.325 . . . . 0.0 114.477 -179.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.1 mmmp? -77.86 -39.13 44.36 Favored 'General case' 0 N--CA 1.476 0.857 0 O-C-N 121.214 -0.929 . . . . 0.0 110.866 173.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.3 mp -82.61 -50.38 15.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 124.219 1.007 . . . . 0.0 110.565 174.026 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.593 HD11 ' HB2' ' A' ' 115' ' ' TYR . 34.4 mm -76.87 109.08 10.88 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.625 0 C-N-CA 123.642 0.777 . . . . 0.0 111.319 -178.257 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.22 -40.24 93.24 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.506 1.123 . . . . 0.0 112.464 171.364 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -154.44 106.18 2.39 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 125.98 1.712 . . . . 0.0 110.905 -172.677 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -76.71 163.26 31.81 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 123.6 2.867 . . . . 0.0 111.934 178.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.406 ' HE2' ' H ' ' A' ' 82' ' ' ASP . 0.0 OUTLIER -158.19 153.14 25.24 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.954 0.901 . . . . 0.0 111.981 175.025 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.406 ' H ' ' HE2' ' A' ' 81' ' ' MET . 10.8 m-20 -153.19 132.32 12.65 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 126.906 2.082 . . . . 0.0 110.566 -171.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 7.2 ttp -59.82 -36.2 76.29 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.254 1.022 . . . . 0.0 113.37 -172.032 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -58.15 -24.85 56.0 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 124.662 1.125 . . . . 0.0 114.503 175.06 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 91.2 m -94.25 -17.44 22.66 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.267 1.427 . . . . 0.0 112.524 178.158 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 50.5 mt -72.43 -52.86 21.51 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 O-C-N 120.803 -1.185 . . . . 0.0 110.302 170.577 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.465 ' HE3' ' CZ3' ' A' ' 51' ' ' TRP . 16.6 ptpt -57.8 -29.0 64.54 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -178.56 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 3.0 tppp? -66.8 -45.35 78.65 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.98 1.312 . . . . 0.0 112.697 -177.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 1.4 ptt180 -77.55 -27.7 51.62 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.169 0.987 . . . . 0.0 113.009 178.25 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 64.6 mt -60.98 -34.15 74.33 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 168.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -73.12 -38.85 66.17 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 118.864 0.756 . . . . 0.0 112.362 173.809 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -69.8 178.13 2.76 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 125.261 1.425 . . . . 0.0 112.896 171.071 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 41.5 p-10 -99.12 34.2 2.19 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.832 2.053 . . . . 0.0 111.936 174.284 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 65.5 t80 -63.87 -36.32 83.54 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.409 1.084 . . . . 0.0 113.696 -169.232 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -136.63 -177.99 4.98 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 128.184 2.594 . . . . 0.0 110.78 177.551 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 7.4 t-105 -115.0 -29.91 6.54 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.984 1.314 . . . . 0.0 112.464 -178.13 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 54.3 m -132.17 141.24 49.02 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.062 0.945 . . . . 0.0 112.665 -168.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -63.45 -16.63 61.15 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 115.943 1.831 . . . . 0.0 115.943 -173.52 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 14.7 m -55.32 -30.85 61.01 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.969 0.907 . . . . 0.0 112.989 175.012 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -65.49 -50.52 65.01 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 121.544 -0.723 . . . . 0.0 111.332 173.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 53.2 t -59.96 -37.74 80.44 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.25 1.02 . . . . 0.0 112.567 175.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 85.5 mtp -62.01 -42.68 99.42 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 121.184 -0.947 . . . . 0.0 112.393 173.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -64.95 -35.93 82.76 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 112.702 0.63 . . . . 0.0 112.702 173.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 55.8 m-20 -61.37 -48.02 83.17 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.487 1.039 . . . . 0.0 112.084 172.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -60.79 -43.71 97.76 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.622 -0.674 . . . . 0.0 112.767 174.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 18.1 t30 -55.2 -52.11 64.4 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.113 0.565 . . . . 0.0 111.526 173.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 96.5 m -61.01 -35.99 78.31 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.748 0.819 . . . . 0.0 112.737 177.546 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 27.7 ttp -61.3 -49.9 75.17 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 119.421 1.009 . . . . 0.0 112.554 176.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -70.9 -42.29 70.17 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 179.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 62.5 m -63.86 -46.76 83.54 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.764 0.825 . . . . 0.0 112.664 179.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -64.38 -33.78 76.65 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 119.852 1.206 . . . . 0.0 112.108 -179.296 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 19.2 m -59.15 -41.72 89.01 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.76 0.824 . . . . 0.0 112.989 169.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -68.73 -29.39 67.8 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 177.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 87.5 mt -69.12 -56.69 11.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 123.383 0.673 . . . . 0.0 110.986 176.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . 0.593 ' HB2' HD11 ' A' ' 77' ' ' ILE . 33.7 t80 -67.9 -31.51 71.34 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 114.577 1.325 . . . . 0.0 114.577 -173.167 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 60.8 m-80 -110.18 160.43 16.5 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.474 1.11 . . . . 0.0 112.053 -170.332 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 49.0 mmtm -72.18 152.14 92.46 Favored Pre-proline 0 N--CA 1.474 0.752 0 O-C-N 121.499 -0.75 . . . . 0.0 110.343 172.363 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -65.74 -1.24 4.68 Favored 'Trans proline' 0 CA--C 1.545 1.042 0 C-N-CA 123.676 2.917 . . . . 0.0 115.043 -177.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 67.7 p -119.01 -0.59 11.11 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.663 1.985 . . . . 0.0 113.126 -179.429 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -68.45 146.5 53.12 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 118.794 0.724 . . . . 0.0 110.68 170.344 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -55.39 -49.53 72.09 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 121.681 -0.637 . . . . 0.0 112.209 -175.562 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.5 tp -51.99 -31.12 13.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 125.232 1.413 . . . . 0.0 114.54 177.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 55.2 t -73.84 -48.96 37.23 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 O-C-N 121.541 -0.725 . . . . 0.0 110.719 174.174 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 77.2 mt -61.33 -37.4 83.14 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 119.124 0.875 . . . . 0.0 111.848 177.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 10.6 mtp -57.91 -52.62 64.72 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.869 1.668 . . . . 0.0 111.918 169.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.43 -39.23 90.02 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 113.04 0.755 . . . . 0.0 113.04 176.164 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . 0.428 ' O ' ' HE2' ' A' ' 131' ' ' LYS . 89.4 mt-30 -61.55 -47.79 83.96 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 119.312 0.96 . . . . 0.0 112.012 174.342 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.34 -40.44 96.38 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.698 -0.626 . . . . 0.0 112.514 177.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 82.6 mt -65.37 -44.73 86.7 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.436 0.694 . . . . 0.0 111.904 172.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -59.34 -48.09 82.95 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.343 0.974 . . . . 0.0 113.173 -175.093 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.428 ' HE2' ' O ' ' A' ' 127' ' ' GLN . 1.1 mppt? -60.45 -32.83 71.76 Favored 'General case' 0 CA--C 1.533 0.31 0 O-C-N 120.947 -1.096 . . . . 0.0 113.693 176.646 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 73.8 mt -76.18 -40.79 36.93 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 CA-C-N 118.803 0.729 . . . . 0.0 111.362 174.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -51.45 -51.61 53.47 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.383 -0.823 . . . . 0.0 109.965 170.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.3 mt -61.3 -43.18 99.3 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.507 0.723 . . . . 0.0 112.939 177.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -64.92 -31.58 72.88 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 120.056 1.298 . . . . 0.0 112.76 -178.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -76.14 -52.0 11.02 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.774 0.83 . . . . 0.0 112.191 175.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.3 m -65.61 -24.79 35.22 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 CA-C-N 120.338 1.426 . . . . 0.0 112.586 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -60.25 -30.69 69.59 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 112.889 0.699 . . . . 0.0 112.889 171.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 80.0 mt-30 -91.71 -9.17 44.75 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.752 1.221 . . . . 0.0 112.925 175.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 46.2 ttp -64.64 142.07 98.42 Favored Pre-proline 0 CA--C 1.549 0.918 0 O-C-N 121.282 -0.886 . . . . 0.0 110.807 173.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_exo -50.25 162.37 0.86 Allowed 'Trans proline' 0 CA--C 1.542 0.908 0 C-N-CA 123.787 2.991 . . . . 0.0 114.728 169.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 -93.65 -11.55 31.38 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.414 1.086 . . . . 0.0 113.53 172.321 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -124.18 163.2 22.05 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 127.097 2.159 . . . . 0.0 111.07 -175.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -124.93 162.42 24.48 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 114.973 1.471 . . . . 0.0 114.973 -177.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 65.3 t -138.48 135.28 43.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 125.999 1.72 . . . . 0.0 109.889 -176.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -65.38 121.38 14.72 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.338 1.455 . . . . 0.0 111.142 170.206 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 84.4 mt -74.71 150.3 39.53 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.615 0.722 . . . . 0.0 112.4 177.324 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -74.49 160.13 81.88 Favored Pre-proline 0 CA--C 1.546 0.813 0 C-N-CA 124.404 1.082 . . . . 0.0 112.638 173.07 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -69.95 157.34 60.36 Favored 'Trans proline' 0 CA--C 1.546 1.115 0 C-N-CA 123.281 2.654 . . . . 0.0 111.472 171.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -71.35 155.32 60.41 Favored 'Trans proline' 0 CA--C 1.54 0.776 0 C-N-CA 123.018 2.478 . . . . 0.0 111.999 177.387 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -76.11 151.01 83.67 Favored Pre-proline 0 CA--C 1.55 0.964 0 C-N-CA 123.995 0.918 . . . . 0.0 112.039 175.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -72.15 147.88 49.09 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 123.115 2.544 . . . . 0.0 111.826 174.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 54.9 tttp -72.95 158.16 36.01 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.38 1.072 . . . . 0.0 111.668 173.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . -154.93 179.23 31.13 Favored Glycine 0 CA--C 1.535 1.328 0 C-N-CA 125.289 1.424 . . . . 0.0 113.152 177.118 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 9.8 ptpp? . . . . . 0 C--O 1.252 1.223 0 C-N-CA 126.075 1.75 . . . . 0.0 112.906 -177.464 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.475 0 N-CA-C 111.214 -0.755 . . . . 0.0 111.214 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 51.7 p 63.99 -3.74 0.43 Allowed 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 127.998 2.519 . . . . 0.0 117.576 -179.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.8 t -66.47 110.6 3.19 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.333 1.053 . . . . 0.0 110.942 173.495 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 176.1 -169.26 41.82 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 124.74 1.162 . . . . 0.0 113.335 -174.338 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 59.3 p -61.8 152.68 30.81 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.434 1.094 . . . . 0.0 113.405 176.341 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 12.6 t -72.14 -29.03 63.64 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.186 0.994 . . . . 0.0 113.606 -178.055 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 178.03 -169.52 41.4 Favored Glycine 0 CA--C 1.534 1.234 0 C-N-CA 124.675 1.131 . . . . 0.0 113.459 -176.039 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -141.58 163.26 33.4 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.638 1.575 . . . . 0.0 112.56 -176.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 25.2 m -131.93 -13.51 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.336 0 C-N-CA 125.228 1.411 . . . . 0.0 114.14 -169.272 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 14.2 t -151.03 135.6 17.09 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 125.714 1.605 . . . . 0.0 110.09 178.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 38.2 t-20 -155.21 122.96 2.84 Favored Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 124.54 1.136 . . . . 0.0 110.182 -175.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -77.35 -9.88 17.54 Favored 'Trans proline' 0 CA--C 1.544 1.005 0 C-N-CA 123.776 2.984 . . . . 0.0 114.775 -176.07 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 62.1 m -113.19 -25.1 9.05 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.757 1.223 . . . . 0.0 113.713 -176.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -64.67 131.27 95.08 Favored Pre-proline 0 CA--C 1.545 0.766 0 C-N-CA 124.863 1.265 . . . . 0.0 110.759 172.425 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -73.06 148.2 44.42 Favored 'Trans proline' 0 CA--C 1.536 0.622 0 C-N-CA 122.696 2.264 . . . . 0.0 112.368 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 162.14 161.48 12.09 Favored Glycine 0 CA--C 1.532 1.12 0 C-N-CA 124.793 1.187 . . . . 0.0 112.855 179.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 33.1 ptt180 -154.91 156.84 36.83 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 126.026 1.73 . . . . 0.0 111.038 177.375 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.8 tttt -73.38 140.04 46.35 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.444 0.698 . . . . 0.0 110.758 170.107 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 70.0 p -142.13 168.3 20.08 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 126.373 1.869 . . . . 0.0 109.695 -177.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 24.9 p-10 -49.87 -32.87 15.42 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 169.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.3 mm-40 -67.59 -57.04 7.15 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.01 0.924 . . . . 0.0 111.351 178.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 89.6 mt -65.37 -33.32 75.67 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.527 -0.733 . . . . 0.0 112.689 178.167 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -58.45 -50.24 74.44 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.98 0.912 . . . . 0.0 111.318 170.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -59.6 -40.09 86.31 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.543 0.737 . . . . 0.0 112.603 177.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 90.4 mmm -56.38 -49.14 75.29 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 121.86 -0.525 . . . . 0.0 112.331 173.459 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -77.9 -18.38 56.22 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 114.772 1.397 . . . . 0.0 114.772 178.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 56.7 m-20 -102.96 -21.3 13.97 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 113.896 1.073 . . . . 0.0 113.896 -171.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 59.0 t -131.84 -48.61 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 123.989 0.916 . . . . 0.0 111.645 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.4 t -72.31 -66.57 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 CA-C-N 118.863 0.756 . . . . 0.0 110.86 -170.423 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 89.8 t -58.76 -40.8 80.73 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 124.157 0.983 . . . . 0.0 110.362 172.338 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.5 tppp? -54.63 -47.64 73.21 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.892 0.877 . . . . 0.0 112.427 178.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 62.4 m -73.06 -44.33 60.78 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 122.923 0.489 . . . . 0.0 111.624 178.34 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 55.3 mt -62.86 -32.54 73.79 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.471 0.708 . . . . 0.0 112.426 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 18.0 t-105 -75.26 -30.09 60.36 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.319 1.447 . . . . 0.0 113.192 174.164 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 54.2 mtmt -79.03 -9.14 59.45 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.514 0.931 . . . . 0.0 113.514 175.105 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 35.6 t-80 -62.89 154.53 29.88 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.754 1.222 . . . . 0.0 113.494 -178.106 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 55.5 tt0 -58.11 -24.48 58.86 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.475 1.51 . . . . 0.0 113.815 174.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -123.36 22.23 9.34 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.158 1.383 . . . . 0.0 113.657 -172.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.57 -26.08 63.38 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.725 1.21 . . . . 0.0 113.843 173.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 64.6 p-90 -59.14 -33.9 20.02 Favored Pre-proline 0 CA--C 1.546 0.804 0 N-CA-C 117.735 2.494 . . . . 0.0 117.735 -170.155 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -73.84 -2.61 12.48 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 CA-C-N 123.216 2.184 . . . . 0.0 113.781 173.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -115.75 -2.11 12.49 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.547 1.539 . . . . 0.0 113.474 179.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -63.06 -24.99 68.17 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 120.913 -1.117 . . . . 0.0 113.565 177.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -139.69 153.94 70.62 Favored Pre-proline 0 CA--C 1.543 0.681 0 C-N-CA 126.134 1.774 . . . . 0.0 110.377 -174.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -66.28 142.02 64.94 Favored 'Trans proline' 0 CA--C 1.537 0.652 0 C-N-CA 122.774 2.316 . . . . 0.0 112.569 179.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 49.5 t -59.13 142.31 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 124.452 1.101 . . . . 0.0 111.491 171.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -120.52 95.65 4.81 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.482 1.513 . . . . 0.0 109.536 171.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.25 -27.31 45.55 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.653 1.181 . . . . 0.0 113.877 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 77.9 mt -63.44 -53.46 45.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 124.437 1.095 . . . . 0.0 110.59 173.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 4.3 mptp? -66.16 -35.76 81.33 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.401 1.48 . . . . 0.0 112.707 -179.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 47.1 mt -81.08 -3.3 51.5 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 114.039 1.125 . . . . 0.0 114.039 174.318 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 62.7 t30 54.56 52.93 11.44 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.937 1.695 . . . . 0.0 113.677 -178.318 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 45.9 mt -115.47 80.61 8.02 Favored Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 126.644 1.978 . . . . 0.0 110.431 -177.06 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -67.47 -10.42 28.66 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 123.806 3.004 . . . . 0.0 113.917 -175.372 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -126.05 22.41 7.31 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.153 1.781 . . . . 0.0 112.397 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 71.6 t80 -51.04 -57.81 7.69 Favored 'General case' 0 N--CA 1.474 0.741 0 O-C-N 120.844 -1.16 . . . . 0.0 112.476 177.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -74.02 -12.7 60.7 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.973 1.309 . . . . 0.0 114.499 -178.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -71.61 -32.97 68.57 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.053 0.941 . . . . 0.0 111.645 177.725 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.9 mp -103.01 -43.51 9.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 125.82 1.648 . . . . 0.0 111.667 -178.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 22.6 mm -61.17 114.82 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 124.231 1.013 . . . . 0.0 110.244 173.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -63.41 -46.1 87.96 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.452 1.101 . . . . 0.0 111.756 179.011 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -156.19 127.94 3.85 Favored Pre-proline 0 CA--C 1.545 0.757 0 C-N-CA 125.606 1.562 . . . . 0.0 110.847 169.389 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -76.45 155.48 36.33 Favored 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 123.564 2.842 . . . . 0.0 112.232 -177.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 33.5 tpp -163.12 140.94 7.9 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.629 1.571 . . . . 0.0 110.115 174.479 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 25.8 m-20 -139.12 134.97 33.59 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 126.574 1.949 . . . . 0.0 108.42 169.375 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 8.5 ttp -46.96 -30.86 2.8 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 127.348 2.259 . . . . 0.0 116.24 -168.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -53.3 -30.41 40.13 Favored Glycine 0 CA--C 1.54 1.631 0 CA-C-N 119.08 0.854 . . . . 0.0 114.141 172.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 2.2 m -70.89 -35.63 72.41 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 125.259 1.424 . . . . 0.0 112.363 175.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 46.6 mt -67.94 -52.25 41.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.552 1.141 . . . . 0.0 110.008 -176.106 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.49 -40.12 77.94 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 174.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 3.2 tppp? -59.83 -39.85 86.48 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.014 0.926 . . . . 0.0 112.797 179.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 1.5 ptm180 -87.24 -28.35 22.4 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 39.6 mt -61.85 -34.88 76.77 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.127 0.971 . . . . 0.0 112.833 167.052 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -74.31 9.59 1.61 Allowed 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 124.962 1.305 . . . . 0.0 113.758 174.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 46.0 m-80 -129.29 161.02 31.19 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 127.36 2.264 . . . . 0.0 110.015 173.34 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 10.3 p-10 -78.34 36.89 0.25 Allowed 'General case' 0 CA--C 1.551 1.006 0 O-C-N 120.767 -1.208 . . . . 0.0 112.177 169.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -62.6 -34.18 76.47 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.073 1.349 . . . . 0.0 113.235 -169.604 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -134.54 -179.38 5.55 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 127.089 2.156 . . . . 0.0 111.296 174.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 4.3 t-105 -110.97 -26.24 9.38 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.217 1.407 . . . . 0.0 112.789 -177.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 62.1 m -134.29 143.74 47.92 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.664 1.186 . . . . 0.0 112.632 -170.091 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -65.3 -16.18 63.3 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 115.232 1.567 . . . . 0.0 115.232 -177.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 11.4 p -51.83 -36.21 47.3 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.497 1.119 . . . . 0.0 113.476 172.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -69.65 -42.0 74.82 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.764 0.825 . . . . 0.0 112.227 176.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 49.4 t -64.81 -35.33 80.75 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.162 0.985 . . . . 0.0 112.459 172.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 89.4 mtp -66.84 -42.32 85.96 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 121.323 -0.861 . . . . 0.0 111.817 173.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -63.73 -29.62 70.81 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 173.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -66.81 -45.95 76.73 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 119.341 0.973 . . . . 0.0 112.301 171.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -63.37 -41.28 98.8 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 121.322 -0.861 . . . . 0.0 112.687 173.091 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 22.7 t30 -57.66 -46.15 84.6 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.831 -0.543 . . . . 0.0 111.578 172.202 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 81.4 m -56.02 -49.82 72.61 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.19 0.996 . . . . 0.0 111.417 175.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 27.3 ttm -56.72 -61.29 2.53 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.224 1.01 . . . . 0.0 112.313 179.255 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -63.16 -40.79 98.56 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -175.107 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 66.5 m -66.72 -45.79 77.55 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.442 -0.786 . . . . 0.0 112.167 176.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -63.19 -30.84 71.91 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 120.102 1.319 . . . . 0.0 112.586 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 82.7 m -60.58 -45.17 94.92 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.266 1.026 . . . . 0.0 112.217 170.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -69.71 -29.56 66.99 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 179.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 88.6 mt -71.21 -55.83 12.56 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 CA-C-N 118.41 0.55 . . . . 0.0 110.126 178.027 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -71.3 -30.45 66.26 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 114.567 1.321 . . . . 0.0 114.567 -172.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 44.4 m-80 -113.61 158.25 21.06 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.012 0.925 . . . . 0.0 112.654 -171.011 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -66.16 147.89 98.66 Favored Pre-proline 0 N--CA 1.472 0.672 0 C-N-CA 124.61 1.164 . . . . 0.0 110.834 176.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -65.72 -6.94 15.06 Favored 'Trans proline' 0 CA--C 1.543 0.954 0 C-N-CA 123.828 3.019 . . . . 0.0 114.973 -175.161 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 70.7 p -116.46 1.18 12.93 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 126.265 1.826 . . . . 0.0 113.096 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -67.53 146.04 54.33 Favored 'General case' 0 CA--C 1.541 0.633 0 O-C-N 121.451 -0.781 . . . . 0.0 110.941 174.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -51.97 -46.25 64.74 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.7 0.8 . . . . 0.0 112.808 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 9.6 tp -57.43 -34.56 46.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 124.488 1.115 . . . . 0.0 113.747 179.39 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 45.4 t -69.95 -43.55 79.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 123.428 0.691 . . . . 0.0 110.67 174.203 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 69.5 mt -63.25 -35.8 81.53 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 119.003 0.819 . . . . 0.0 111.94 176.416 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -57.79 -53.4 58.62 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 118.26 0.482 . . . . 0.0 110.738 170.381 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.87 -39.99 91.26 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.483 0.713 . . . . 0.0 112.611 179.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -60.72 -50.12 74.77 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.07 0.85 . . . . 0.0 112.036 174.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.87 -41.33 99.36 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.427 0.691 . . . . 0.0 112.41 -179.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 85.4 mt -65.48 -45.74 82.47 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.635 0.774 . . . . 0.0 111.848 173.472 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -60.37 -43.24 96.74 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.566 1.075 . . . . 0.0 113.165 -176.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 66.1 mttt -58.23 -38.24 76.46 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.53 0.732 . . . . 0.0 111.857 178.104 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 70.1 mt -78.16 -41.62 26.84 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 123.406 0.682 . . . . 0.0 111.729 176.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 29.2 t80 -50.42 -51.57 45.26 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 119.131 0.878 . . . . 0.0 110.413 172.448 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 99.4 mt -62.04 -42.48 99.22 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.891 0.7 . . . . 0.0 112.891 178.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -67.89 -30.65 70.05 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 120.009 1.277 . . . . 0.0 112.755 179.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 69.2 mmtt -75.52 -48.39 22.76 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 117.616 -1.183 . . . . 0.0 112.435 175.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.7 m -68.43 -25.98 32.51 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 CA-C-N 121.094 1.77 . . . . 0.0 112.362 177.253 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -59.85 -31.12 69.46 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.748 -0.595 . . . . 0.0 112.431 171.394 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 21.6 mm100 -89.97 -5.85 56.26 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.125 1.37 . . . . 0.0 113.027 176.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 40.8 ttp -63.43 137.26 97.03 Favored Pre-proline 0 CA--C 1.546 0.819 0 C-N-CA 123.802 0.841 . . . . 0.0 110.418 171.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_endo -61.63 148.7 92.42 Favored 'Trans proline' 0 CA--C 1.534 0.514 0 C-N-CA 122.601 2.201 . . . . 0.0 111.023 174.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 -92.09 -13.46 30.77 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -174.487 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 9.5 mp0 -100.01 150.54 22.33 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 126.184 1.794 . . . . 0.0 111.862 176.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -98.84 140.93 32.28 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.04 1.336 . . . . 0.0 110.315 177.237 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 8.5 p -146.29 138.04 19.34 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 CA-C-O 122.299 1.047 . . . . 0.0 111.162 169.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -65.51 131.84 47.39 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.452 1.901 . . . . 0.0 111.64 176.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 98.6 mt -78.0 150.36 33.91 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 114.068 1.136 . . . . 0.0 114.068 -177.095 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 4.4 pp -73.43 154.88 89.89 Favored Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 124.738 1.215 . . . . 0.0 111.118 168.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -76.78 145.61 25.75 Favored 'Trans proline' 0 CA--C 1.547 1.139 0 C-N-CA 122.882 2.388 . . . . 0.0 112.529 -177.157 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -73.19 170.21 20.4 Favored 'Trans proline' 0 CA--C 1.543 0.929 0 C-N-CA 123.733 2.956 . . . . 0.0 112.574 175.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -145.97 150.94 43.99 Favored Pre-proline 0 CA--C 1.55 0.959 0 C-N-CA 124.83 1.252 . . . . 0.0 112.072 177.235 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -76.97 75.02 4.74 Favored 'Trans proline' 0 CA--C 1.545 1.041 0 C-N-CA 124.663 3.575 . . . . 0.0 112.231 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -54.46 -35.21 62.78 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 125.465 1.506 . . . . 0.0 113.744 179.476 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . 172.84 170.32 36.41 Favored Glycine 0 CA--C 1.536 1.357 0 C-N-CA 124.966 1.27 . . . . 0.0 113.55 174.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.253 1.266 0 C-N-CA 125.118 1.367 . . . . 0.0 113.864 173.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.463 0 N-CA-C 111.138 -0.785 . . . . 0.0 111.138 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 19.4 m -68.32 -16.64 64.02 Favored 'General case' 0 N--CA 1.479 1.007 0 N-CA-C 114.876 1.435 . . . . 0.0 114.876 -176.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.4 t -152.98 159.95 42.97 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.52 1.528 . . . . 0.0 111.269 176.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 70.51 -171.88 43.18 Favored Glycine 0 CA--C 1.536 1.394 0 C-N-CA 124.544 1.068 . . . . 0.0 114.22 -176.041 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 25.0 m -135.96 -14.6 1.82 Allowed 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 114.772 1.397 . . . . 0.0 114.772 -177.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.3 t -71.6 127.08 31.42 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 119.574 1.079 . . . . 0.0 110.996 173.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 153.51 -32.05 0.77 Allowed Glycine 0 CA--C 1.533 1.16 0 C-N-CA 126.488 1.994 . . . . 0.0 110.923 -175.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 26.4 pt-20 -64.58 162.84 14.75 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.475 1.51 . . . . 0.0 112.691 168.602 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 21.6 m -133.96 5.38 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 C-N-CA 125.71 1.604 . . . . 0.0 113.107 -177.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 12.7 t -149.9 168.69 23.06 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 127.414 2.286 . . . . 0.0 110.055 176.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -140.11 143.78 35.27 Favored Pre-proline 0 CA--C 1.548 0.872 0 C-N-CA 124.707 1.203 . . . . 0.0 113.342 -171.523 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -80.26 -20.25 8.61 Favored 'Trans proline' 0 CA--C 1.542 0.878 0 C-N-CA 123.829 3.019 . . . . 0.0 114.332 -179.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 18.7 t -156.48 -32.63 0.09 Allowed 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 114.656 1.354 . . . . 0.0 114.656 -173.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 21.3 ttpp -54.31 136.99 59.91 Favored Pre-proline 0 N--CA 1.478 0.97 0 C-N-CA 124.831 1.252 . . . . 0.0 112.292 -178.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -71.95 161.24 45.46 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 C-N-CA 122.786 2.324 . . . . 0.0 113.731 179.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 174.68 156.66 14.43 Favored Glycine 0 CA--C 1.536 1.394 0 C-N-CA 126.874 2.178 . . . . 0.0 111.766 172.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 34.6 ptt180 -153.02 152.57 31.52 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.471 1.508 . . . . 0.0 110.675 172.169 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 74.0 tttt -71.75 139.24 48.99 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.362 0.665 . . . . 0.0 110.4 169.531 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 61.9 p -140.41 168.56 19.52 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.864 1.666 . . . . 0.0 110.421 -176.468 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 26.2 p-10 -48.94 -37.36 19.75 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 114.29 1.219 . . . . 0.0 114.29 172.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -72.11 -46.17 57.7 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 121.521 -0.737 . . . . 0.0 111.767 178.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 79.4 mt -65.44 -32.62 74.34 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 121.805 -0.559 . . . . 0.0 112.222 175.097 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 44.3 tt0 -59.6 -52.48 65.36 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 123.292 0.637 . . . . 0.0 109.863 168.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -56.4 -41.38 76.2 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.503 0.721 . . . . 0.0 112.516 179.179 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 89.9 mmm -57.15 -56.03 27.08 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 118.303 0.502 . . . . 0.0 112.017 171.496 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.2 pt20 -77.46 -11.53 59.86 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.952 1.464 . . . . 0.0 114.952 -175.243 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -115.48 -21.14 9.92 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.771 1.228 . . . . 0.0 113.334 -169.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 16.0 t -129.2 -51.4 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 C-N-CA 123.225 0.61 . . . . 0.0 111.229 -179.243 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.5 t -68.04 -63.01 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 123.246 0.618 . . . . 0.0 110.469 -176.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 69.0 t -57.79 -48.36 83.86 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 124.518 1.127 . . . . 0.0 110.523 174.429 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm -58.22 -44.34 88.16 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 118.482 0.583 . . . . 0.0 112.24 -175.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 40.5 m -71.01 -43.05 68.75 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 177.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 75.7 mt -63.16 -33.83 76.31 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.291 0.636 . . . . 0.0 112.355 176.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . 0.464 ' CZ3' ' HE3' ' A' ' 87' ' ' LYS . 19.3 t-105 -70.75 -28.33 64.61 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.741 1.616 . . . . 0.0 113.353 175.056 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.4 mtmp? -83.92 -4.13 58.47 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.291 1.036 . . . . 0.0 113.533 176.122 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 36.1 t-80 -65.99 158.91 27.01 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.902 1.281 . . . . 0.0 113.301 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -58.84 -24.53 62.15 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.518 1.527 . . . . 0.0 113.88 175.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 -125.4 22.1 7.79 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.802 1.241 . . . . 0.0 114.057 -171.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.72 -28.27 65.68 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 176.211 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.427 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 45.0 p-90 -56.69 -37.6 59.41 Favored Pre-proline 0 CA--C 1.547 0.855 0 N-CA-C 117.324 2.342 . . . . 0.0 117.324 -170.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.427 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 64.0 Cg_endo -70.22 -5.53 16.72 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 CA-C-N 123.042 2.122 . . . . 0.0 114.592 172.325 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 80.7 m-85 -113.19 -1.06 14.45 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.345 1.458 . . . . 0.0 113.302 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -64.02 -17.83 63.72 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 113.914 1.079 . . . . 0.0 113.914 175.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 -142.88 157.06 62.01 Favored Pre-proline 0 CA--C 1.546 0.797 0 C-N-CA 125.958 1.703 . . . . 0.0 111.047 -172.311 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -65.42 152.48 81.85 Favored 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 122.998 2.465 . . . . 0.0 112.34 173.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 36.5 t -71.85 144.75 12.92 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 124.485 1.114 . . . . 0.0 110.56 177.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -128.97 97.07 4.52 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.197 1.399 . . . . 0.0 110.604 178.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.0 -28.46 57.35 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.563 1.145 . . . . 0.0 113.858 178.607 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 82.6 mt -66.72 -49.34 75.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 125.071 1.348 . . . . 0.0 111.021 174.614 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 9.6 mtpm? -67.75 -37.73 82.54 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.636 1.174 . . . . 0.0 112.745 -179.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 85.0 mt -90.63 -1.2 57.88 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.952 1.701 . . . . 0.0 113.513 -177.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 51.96 57.43 6.51 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 125.754 1.622 . . . . 0.0 113.296 -178.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 53.9 mt -113.6 83.59 7.25 Favored Pre-proline 0 CA--C 1.547 0.854 0 C-N-CA 125.9 1.68 . . . . 0.0 110.655 -177.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -67.66 -11.6 32.68 Favored 'Trans proline' 0 CA--C 1.541 0.858 0 C-N-CA 123.975 3.117 . . . . 0.0 114.61 -170.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.432 ' HA ' ' HE3' ' A' ' 75' ' ' LYS . 40.9 m-20 -125.8 21.53 7.61 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.416 1.486 . . . . 0.0 113.048 177.878 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -48.28 -55.39 10.7 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 121.212 -0.93 . . . . 0.0 113.009 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -77.39 -16.25 58.94 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 114.672 1.36 . . . . 0.0 114.672 -177.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.432 ' HE3' ' HA ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -68.66 -39.64 80.54 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.141 -0.975 . . . . 0.0 111.714 172.656 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.3 mp -88.65 -46.2 15.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 124.35 1.06 . . . . 0.0 111.189 175.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.574 HD11 ' HB2' ' A' ' 115' ' ' TYR . 32.3 mm -80.34 104.51 8.78 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-O 121.685 0.755 . . . . 0.0 111.189 178.514 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -69.34 -36.65 77.11 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.84 1.256 . . . . 0.0 112.578 174.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -146.35 103.46 4.04 Favored Pre-proline 0 CA--C 1.547 0.83 0 C-N-CA 125.69 1.596 . . . . 0.0 110.686 -178.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -76.32 149.17 31.16 Favored 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 123.403 2.735 . . . . 0.0 111.232 174.191 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 6.8 tpt -157.83 148.66 21.02 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.726 1.211 . . . . 0.0 111.105 177.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -150.56 154.85 38.33 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.771 1.628 . . . . 0.0 111.533 -178.644 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 4.5 ttp -64.07 -33.23 75.28 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.911 0.885 . . . . 0.0 113.369 -174.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.67 -44.97 97.26 Favored Glycine 0 CA--C 1.532 1.138 0 C-N-CA 124.697 1.141 . . . . 0.0 112.899 173.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 57.7 m -68.56 -39.78 80.91 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 121.789 -0.83 . . . . 0.0 111.827 172.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 95.3 mt -55.56 -53.23 38.82 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 CA-C-N 120.104 1.32 . . . . 0.0 111.22 176.119 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.464 ' HE3' ' CZ3' ' A' ' 51' ' ' TRP . 16.3 ptpt -59.74 -30.52 68.89 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 177.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm -66.83 -44.9 79.91 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.814 0.846 . . . . 0.0 112.867 177.037 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 6.9 ptp180 -75.17 -19.6 59.77 Favored 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 172.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 46.3 mt -70.76 -51.55 26.41 Favored 'General case' 0 CA--C 1.543 0.673 0 CA-C-N 119.152 0.887 . . . . 0.0 111.328 167.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -71.46 -41.53 69.29 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 113.461 0.912 . . . . 0.0 113.461 -176.315 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -86.34 110.75 19.89 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 169.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 46.2 t30 -48.79 115.63 1.33 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.54 1.136 . . . . 0.0 112.915 -175.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 54.7 t80 -137.0 -26.76 1.02 Allowed 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 114.365 1.246 . . . . 0.0 114.365 -172.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -138.56 170.79 15.38 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.801 1.24 . . . . 0.0 112.708 178.196 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 8.8 t-105 -99.92 -21.45 15.67 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.136 1.375 . . . . 0.0 112.657 -176.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.7 p -141.42 148.29 39.32 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.452 1.501 . . . . 0.0 113.105 -169.53 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -72.19 -17.18 61.95 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 115.221 1.563 . . . . 0.0 115.221 -176.359 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 5.7 p -52.88 -37.03 60.02 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.033 0.933 . . . . 0.0 113.004 174.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -67.45 -43.72 80.4 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.705 -0.622 . . . . 0.0 112.474 178.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 45.4 t -60.17 -40.77 91.1 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.119 0.968 . . . . 0.0 112.617 170.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 83.9 mtp -62.35 -42.61 99.53 Favored 'General case' 0 N--CA 1.473 0.679 0 O-C-N 121.303 -0.873 . . . . 0.0 112.579 176.136 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 58.0 mm-40 -66.45 -32.99 74.7 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 173.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -66.46 -41.27 89.33 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 120.736 -1.227 . . . . 0.0 111.922 171.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -60.67 -45.49 93.95 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.264 -0.898 . . . . 0.0 112.47 170.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.91 -42.62 94.3 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 121.434 -0.791 . . . . 0.0 110.924 173.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 88.0 m -60.26 -40.23 89.59 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.976 0.91 . . . . 0.0 111.883 178.312 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 17.2 ttm -57.31 -59.61 4.87 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 119.001 0.819 . . . . 0.0 111.534 173.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -64.17 -43.46 95.08 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -176.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 97.5 m -63.71 -47.44 81.13 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.973 0.909 . . . . 0.0 112.054 179.025 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -64.2 -34.25 77.66 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-N 119.711 1.142 . . . . 0.0 112.224 -179.079 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 24.6 m -58.4 -43.8 88.71 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 113.232 0.827 . . . . 0.0 113.232 170.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 14.9 m-85 -68.45 -29.1 67.67 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.861 1.06 . . . . 0.0 113.861 178.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 86.8 mt -70.08 -56.57 10.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 123.27 0.628 . . . . 0.0 110.647 176.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . 0.574 ' HB2' HD11 ' A' ' 77' ' ' ILE . 33.7 t80 -69.33 -35.3 75.78 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 114.371 1.248 . . . . 0.0 114.371 -173.572 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 55.6 m-80 -105.58 154.96 19.68 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.25 1.02 . . . . 0.0 111.535 -172.423 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 53.3 mttm -68.3 151.58 97.12 Favored Pre-proline 0 N--CA 1.471 0.577 0 C-N-CA 123.988 0.915 . . . . 0.0 111.037 175.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -65.24 -1.03 3.97 Favored 'Trans proline' 0 CA--C 1.547 1.168 0 C-N-CA 123.601 2.868 . . . . 0.0 114.763 -179.238 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 52.0 p -117.67 -2.41 11.43 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 127.123 2.169 . . . . 0.0 113.151 -179.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 -69.31 144.38 53.55 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 118.966 0.803 . . . . 0.0 110.648 171.106 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -56.29 -46.27 79.83 Favored 'General case' 0 N--CA 1.471 0.616 0 O-C-N 121.649 -0.657 . . . . 0.0 112.514 -175.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.4 tp -54.42 -30.29 21.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 125.118 1.367 . . . . 0.0 114.209 177.6 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 45.5 t -72.81 -47.18 50.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 O-C-N 121.422 -0.798 . . . . 0.0 110.555 174.015 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 71.8 mt -61.46 -37.08 82.27 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 118.93 0.786 . . . . 0.0 111.599 176.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 7.7 mtt -59.01 -51.91 68.01 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.921 1.288 . . . . 0.0 111.971 169.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.28 -39.65 87.63 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.353 0.661 . . . . 0.0 112.72 176.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 89.3 mt-30 -62.41 -45.36 93.45 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 119.24 0.927 . . . . 0.0 111.902 174.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -67.41 -29.69 69.26 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.246 1.018 . . . . 0.0 113.615 179.149 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 81.5 mt -76.14 -48.52 20.3 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.832 0.853 . . . . 0.0 111.49 169.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -62.05 -37.81 86.39 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 113.376 0.88 . . . . 0.0 113.376 -173.546 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 59.5 pttt -58.9 -44.21 91.15 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 121.593 -0.692 . . . . 0.0 111.679 176.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 65.9 mt -70.99 -39.97 75.71 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 124.413 1.085 . . . . 0.0 110.91 176.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -51.11 -49.5 60.64 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.903 1.229 . . . . 0.0 110.808 171.43 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.7 mt -63.9 -39.68 94.75 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 176.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -57.3 -41.09 79.17 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-N 119.688 1.131 . . . . 0.0 112.652 172.184 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 36.7 mmtm -75.69 -48.83 20.32 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.961 1.304 . . . . 0.0 111.786 -175.309 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.8 m -68.78 -25.96 31.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 CA-C-N 120.121 1.328 . . . . 0.0 112.218 176.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -61.59 -28.3 69.25 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 121.495 -0.753 . . . . 0.0 112.449 171.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -96.51 1.73 51.73 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.399 1.48 . . . . 0.0 112.687 177.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 8.9 ttm -54.28 141.53 51.71 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 124.951 1.3 . . . . 0.0 112.482 174.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -67.6 114.84 3.44 Favored 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 123.076 2.517 . . . . 0.0 109.233 168.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -71.44 -20.58 62.08 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 -169.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -84.41 160.24 20.65 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.74 1.616 . . . . 0.0 112.056 177.149 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -116.43 133.07 56.44 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.116 1.367 . . . . 0.0 110.986 178.04 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 13.0 p -149.28 142.94 18.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 C-N-CA 124.848 1.259 . . . . 0.0 111.286 173.027 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -70.77 137.75 49.86 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.656 1.182 . . . . 0.0 111.636 176.066 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 95.9 mt -79.19 152.53 30.63 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 114.058 1.133 . . . . 0.0 114.058 -175.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 4.4 pp -76.79 154.98 83.3 Favored Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 124.715 1.206 . . . . 0.0 110.875 168.032 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.94 142.23 24.87 Favored 'Trans proline' 0 CA--C 1.547 1.136 0 C-N-CA 122.889 2.393 . . . . 0.0 112.207 -177.497 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -73.44 161.47 42.4 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 123.389 2.726 . . . . 0.0 112.669 178.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -65.98 153.13 92.29 Favored Pre-proline 0 CA--C 1.553 1.066 0 C-N-CA 124.097 0.959 . . . . 0.0 112.446 173.205 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -77.38 36.94 0.57 Allowed 'Trans proline' 0 CA--C 1.551 1.363 0 C-N-CA 124.949 3.766 . . . . 0.0 113.21 177.021 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -58.14 128.12 35.52 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.657 1.583 . . . . 0.0 111.519 -177.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . 78.65 -41.85 2.17 Favored Glycine 0 CA--C 1.539 1.538 0 C-N-CA 125.585 1.564 . . . . 0.0 115.115 176.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 64.6 tttm . . . . . 0 C--O 1.252 1.231 0 C-N-CA 126.085 1.754 . . . . 0.0 111.723 178.716 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.45 0 N-CA-C 110.718 -0.953 . . . . 0.0 110.718 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 20.9 m -145.91 36.92 1.05 Allowed 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 124.836 1.254 . . . . 0.0 112.37 -170.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.6 t -139.36 178.9 6.86 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 125.088 1.355 . . . . 0.0 112.885 -173.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -166.67 -166.42 25.71 Favored Glycine 0 CA--C 1.535 1.338 0 C-N-CA 125.923 1.725 . . . . 0.0 113.276 -173.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 82.9 p -145.48 168.64 20.07 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 124.98 1.312 . . . . 0.0 113.428 -173.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.4 t -67.71 164.67 18.85 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.034 1.334 . . . . 0.0 113.391 179.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 159.4 -0.24 0.08 OUTLIER Glycine 0 CA--C 1.538 1.486 0 N-CA-C 116.868 1.507 . . . . 0.0 116.868 175.556 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -61.64 140.35 58.17 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 119.26 1.53 . . . . 0.0 114.089 -177.756 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 29.8 m -148.46 -27.57 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.438 0 C-N-CA 125.768 1.627 . . . . 0.0 114.452 179.269 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 49.9 m -146.53 130.16 16.96 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.267 1.427 . . . . 0.0 111.549 -177.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 58.3 t30 -159.35 124.86 2.3 Favored Pre-proline 0 CA--C 1.546 0.8 0 C-N-CA 125.558 1.543 . . . . 0.0 109.606 176.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -75.16 -170.44 0.79 Allowed 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 123.706 2.937 . . . . 0.0 110.658 171.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 31.9 m 51.9 22.17 1.68 Allowed 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 126.621 1.969 . . . . 0.0 115.13 -173.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 28.0 ttpp -139.41 131.39 15.1 Favored Pre-proline 0 N--CA 1.476 0.841 0 C-N-CA 126.688 1.995 . . . . 0.0 110.423 -175.16 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_endo -75.35 156.56 41.45 Favored 'Trans proline' 0 CA--C 1.539 0.751 0 C-N-CA 123.078 2.519 . . . . 0.0 113.496 -174.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 174.45 166.33 32.29 Favored Glycine 0 CA--C 1.533 1.207 0 C-N-CA 126.329 1.919 . . . . 0.0 111.753 174.066 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 34.9 ptt180 -162.83 161.2 25.92 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.918 1.687 . . . . 0.0 110.693 179.317 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.589 ' HB3' HD12 ' A' ' 147' ' ' LEU . 46.6 mttp -76.93 141.23 40.57 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 121.398 0.618 . . . . 0.0 110.425 167.516 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 81.0 p -141.04 164.16 31.02 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 125.585 1.554 . . . . 0.0 110.004 176.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -52.68 -30.97 34.82 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 170.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.4 mm-40 -67.9 -54.74 16.45 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.884 0.874 . . . . 0.0 111.188 177.144 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 96.3 mt -65.03 -32.88 74.82 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 121.489 -0.757 . . . . 0.0 112.52 176.326 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.515 ' HB2' HD11 ' A' ' 147' ' ' LEU . 53.4 tt0 -57.16 -52.81 63.8 Favored 'General case' 0 C--O 1.224 -0.26 0 C-N-CA 123.977 0.911 . . . . 0.0 110.92 170.065 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -60.21 -41.18 92.49 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.453 0.701 . . . . 0.0 112.596 179.197 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 93.9 mmm -55.85 -48.35 75.67 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 121.747 -0.595 . . . . 0.0 111.794 171.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -86.42 -5.57 59.13 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 115.114 1.524 . . . . 0.0 115.114 -175.739 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 30.6 m-20 -117.0 -18.36 10.12 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 125.157 1.383 . . . . 0.0 113.481 -176.117 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 46.9 t -133.85 -50.66 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 123.934 0.894 . . . . 0.0 111.686 179.602 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.0 t -71.54 -67.48 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-N 119.407 1.003 . . . . 0.0 110.802 -171.468 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 59.1 t -57.61 -41.85 80.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 123.655 0.782 . . . . 0.0 109.965 171.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.74 -45.02 86.44 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 118.87 0.759 . . . . 0.0 113.005 -177.604 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 62.4 m -71.76 -44.46 64.0 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 122.925 0.49 . . . . 0.0 111.364 176.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 66.6 mt -62.0 -32.49 72.97 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.572 0.749 . . . . 0.0 112.277 178.145 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 16.9 t-105 -73.17 -29.53 62.92 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.022 1.729 . . . . 0.0 112.955 176.066 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 56.5 mtmt -84.25 -5.28 59.24 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.256 1.022 . . . . 0.0 113.462 176.568 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 37.3 t-80 -65.02 156.18 32.23 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.695 1.198 . . . . 0.0 113.564 -178.439 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 18.4 tp60 -58.74 -20.82 52.62 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.604 1.562 . . . . 0.0 114.057 174.49 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -125.12 19.97 8.26 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.399 1.479 . . . . 0.0 113.791 -174.44 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.3 -30.01 65.73 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 177.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.446 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 39.4 p-90 -54.57 -37.84 59.34 Favored Pre-proline 0 CA--C 1.547 0.863 0 N-CA-C 117.094 2.257 . . . . 0.0 117.094 -172.517 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.446 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 56.9 Cg_endo -67.99 -7.28 19.29 Favored 'Trans proline' 0 C--N 1.354 0.866 0 CA-C-N 122.959 2.092 . . . . 0.0 115.012 172.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 72.7 m-85 -114.5 -1.45 13.43 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.132 1.373 . . . . 0.0 113.284 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 20.1 m-30 -65.18 -22.53 66.92 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 113.458 0.91 . . . . 0.0 113.458 176.212 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -138.4 155.46 73.89 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 126.515 1.926 . . . . 0.0 110.005 -176.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -67.24 147.63 78.95 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 122.571 2.18 . . . . 0.0 112.4 178.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 76.6 t -59.75 142.34 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 123.903 0.881 . . . . 0.0 111.258 170.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -122.97 101.24 7.31 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 125.689 1.596 . . . . 0.0 109.497 171.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.27 -27.23 61.91 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 -179.26 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 84.3 mt -64.81 -49.61 79.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 124.855 1.262 . . . . 0.0 110.846 172.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -68.36 -42.31 79.37 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.97 1.308 . . . . 0.0 112.788 -178.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.4 mp -80.74 -4.32 54.04 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.358 1.063 . . . . 0.0 113.329 176.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 61.7 t30 55.02 56.28 6.76 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 126.266 1.826 . . . . 0.0 113.501 -179.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 51.5 mt -115.28 84.05 11.04 Favored Pre-proline 0 CA--C 1.545 0.77 0 C-N-CA 126.312 1.845 . . . . 0.0 110.741 -175.436 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -68.3 -3.88 11.71 Favored 'Trans proline' 0 CA--C 1.544 1.009 0 C-N-CA 123.945 3.097 . . . . 0.0 114.633 -174.368 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -131.24 14.78 5.11 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 126.051 1.74 . . . . 0.0 112.528 -178.681 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 40.9 t80 -51.13 -55.05 19.75 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 120.729 -1.232 . . . . 0.0 113.364 -173.212 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -79.44 -9.44 59.6 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.346 1.059 . . . . 0.0 113.854 178.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -70.65 -47.27 60.88 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.006 0.922 . . . . 0.0 110.337 177.325 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.9 mp -77.11 -50.39 20.85 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 C-N-CA 124.137 0.975 . . . . 0.0 109.84 172.096 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 40.9 mm -91.4 103.04 14.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 CA-C-O 122.48 1.134 . . . . 0.0 112.097 -171.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt -68.06 -32.26 72.48 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.936 1.694 . . . . 0.0 113.487 179.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -147.59 91.67 4.94 Favored Pre-proline 0 CA--C 1.545 0.761 0 C-N-CA 125.715 1.606 . . . . 0.0 110.209 -178.044 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -78.76 159.61 27.97 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 123.499 2.799 . . . . 0.0 111.356 174.522 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 40.8 mmm -147.05 160.87 41.88 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.522 1.129 . . . . 0.0 112.751 168.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -146.81 146.79 30.36 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 127.099 2.159 . . . . 0.0 110.228 175.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.2 ttp -61.84 -35.19 77.55 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.163 0.985 . . . . 0.0 113.63 -170.362 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -57.87 -42.4 94.65 Favored Glycine 0 CA--C 1.531 1.075 0 C-N-CA 123.831 0.729 . . . . 0.0 113.219 177.448 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 19.7 m -67.13 -41.58 85.9 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.826 0.85 . . . . 0.0 111.602 176.147 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 95.0 mt -60.02 -52.06 65.58 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 124.257 1.023 . . . . 0.0 110.493 177.444 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 25.2 ttpp -57.75 -37.4 73.56 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 125.417 1.487 . . . . 0.0 112.888 176.391 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 34.0 ttmt -62.69 -41.88 99.34 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 113.458 0.91 . . . . 0.0 113.458 178.613 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -74.03 -27.09 60.77 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 114.537 1.31 . . . . 0.0 114.537 172.777 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 62.5 mt -61.8 -48.62 79.78 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 118.675 0.67 . . . . 0.0 111.29 168.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -59.29 -42.01 90.28 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.054 0.942 . . . . 0.0 111.977 176.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 -83.51 2.56 36.34 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 125.086 1.354 . . . . 0.0 113.987 179.371 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 34.86 56.72 0.74 Allowed 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 127.579 2.352 . . . . 0.0 115.091 -171.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 71.2 t80 -58.83 -24.37 61.91 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 127.358 2.263 . . . . 0.0 114.948 -176.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -133.22 -175.48 3.81 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 129.043 2.937 . . . . 0.0 111.568 -169.852 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 14.4 t-105 -110.45 -27.45 9.01 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.382 1.073 . . . . 0.0 113.142 -171.511 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 16.9 m -145.95 151.69 38.22 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 124.724 1.21 . . . . 0.0 112.703 -171.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -66.0 -21.23 66.39 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 116.502 2.038 . . . . 0.0 116.502 -172.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 47.0 t -53.85 -36.7 62.88 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 119.282 0.946 . . . . 0.0 112.552 178.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -65.86 -44.78 84.39 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 121.088 -1.008 . . . . 0.0 112.015 179.087 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 53.1 t -57.92 -41.91 83.68 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.088 0.955 . . . . 0.0 112.37 171.123 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 79.9 mtp -61.86 -40.33 94.99 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.999 0.92 . . . . 0.0 112.975 175.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 65.0 mt-30 -62.57 -37.32 85.72 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.093 0.957 . . . . 0.0 112.682 175.269 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -71.96 -33.91 68.55 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.0 -1.063 . . . . 0.0 113.281 174.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -64.25 -45.0 90.07 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 119.346 0.975 . . . . 0.0 112.212 169.538 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 24.1 t30 -56.27 -42.12 76.95 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.866 -0.521 . . . . 0.0 111.534 171.502 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 60.4 m -64.98 -39.57 93.68 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.128 0.971 . . . . 0.0 112.491 176.357 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 21.1 ttm -58.98 -61.09 2.9 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.941 0.897 . . . . 0.0 111.352 174.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -62.91 -39.79 95.63 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 -176.351 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 90.5 m -65.11 -47.33 77.53 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.195 0.598 . . . . 0.0 112.07 178.424 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -64.71 -32.53 74.25 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 119.615 1.098 . . . . 0.0 112.549 -179.227 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 55.9 m -59.8 -45.15 93.2 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.717 0.807 . . . . 0.0 112.543 169.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 14.3 m-85 -67.84 -32.55 73.15 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 177.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 85.6 mt -69.41 -58.19 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 123.576 0.75 . . . . 0.0 111.05 176.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 43.2 t80 -68.31 -34.61 76.45 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 114.246 1.202 . . . . 0.0 114.246 -170.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 60.5 m-80 -101.03 164.7 11.68 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.51 1.124 . . . . 0.0 111.987 -173.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -72.61 150.84 91.32 Favored Pre-proline 0 N--CA 1.476 0.836 0 O-C-N 121.368 -0.833 . . . . 0.0 109.921 170.25 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -66.08 -1.65 5.62 Favored 'Trans proline' 0 CA--C 1.546 1.108 0 C-N-CA 123.393 2.728 . . . . 0.0 114.68 -178.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 50.7 p -118.24 -1.34 11.35 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.994 2.118 . . . . 0.0 113.113 -179.056 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 54.4 m-20 -67.46 145.9 54.53 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.535 -0.728 . . . . 0.0 110.822 170.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -56.22 -46.69 79.4 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.619 -0.675 . . . . 0.0 112.406 -176.068 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.5 tp -54.73 -29.13 20.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 125.227 1.411 . . . . 0.0 114.442 177.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 38.6 t -73.17 -45.57 53.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 O-C-N 121.281 -0.887 . . . . 0.0 110.517 173.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 73.5 mt -63.31 -36.87 85.12 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 118.977 0.808 . . . . 0.0 111.405 176.689 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 7.6 mtt -59.17 -52.11 67.12 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.019 1.328 . . . . 0.0 111.648 169.541 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.54 -38.8 85.64 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.483 0.713 . . . . 0.0 112.707 176.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -62.74 -49.41 75.15 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.955 0.798 . . . . 0.0 112.146 174.049 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -61.25 -39.51 90.62 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.493 0.717 . . . . 0.0 112.295 179.595 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 80.5 mt -66.08 -48.42 71.02 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.487 0.715 . . . . 0.0 111.872 170.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -62.27 -39.72 93.85 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 120.78 -1.2 . . . . 0.0 113.53 -175.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 14.2 mttm -60.02 -29.33 68.42 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.672 0.789 . . . . 0.0 112.595 174.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 59.4 mt -86.61 -39.98 13.79 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 C-N-CA 123.615 0.766 . . . . 0.0 112.055 174.134 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 35.6 t80 -50.43 -53.17 31.49 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.366 0.985 . . . . 0.0 110.455 172.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.2 mt -62.97 -40.24 97.1 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 112.951 0.723 . . . . 0.0 112.951 -179.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.5 pt20 -71.33 -29.67 65.28 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 119.694 1.134 . . . . 0.0 112.847 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -75.69 -48.44 21.97 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 117.638 -1.173 . . . . 0.0 112.439 174.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 6.1 m -66.97 -26.28 36.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 CA-C-N 121.031 1.741 . . . . 0.0 112.075 177.033 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -60.64 -29.99 69.6 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 172.139 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -89.99 -6.25 55.83 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 124.712 1.205 . . . . 0.0 112.838 175.648 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 39.7 ttp -63.77 139.45 97.63 Favored Pre-proline 0 CA--C 1.547 0.847 0 O-C-N 121.251 -0.906 . . . . 0.0 110.278 170.834 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -63.75 154.62 68.34 Favored 'Trans proline' 0 CA--C 1.538 0.699 0 C-N-CA 122.758 2.305 . . . . 0.0 111.907 175.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 20.1 mm100 -84.54 -18.07 36.89 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 176.055 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -96.35 155.22 16.86 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.357 1.463 . . . . 0.0 112.934 -179.441 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -122.32 138.25 54.57 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.652 1.181 . . . . 0.0 111.065 -175.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 9.7 p -145.16 140.08 22.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 C-N-CA 125.289 1.436 . . . . 0.0 110.672 176.121 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -70.24 135.78 49.32 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.67 1.188 . . . . 0.0 111.354 176.385 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . 0.589 HD12 ' HB3' ' A' ' 35' ' ' LYS . 84.1 mt -72.25 132.27 43.85 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 -173.04 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 4.4 pp -67.5 154.63 92.78 Favored Pre-proline 0 CA--C 1.551 0.997 0 C-N-CA 124.687 1.195 . . . . 0.0 111.08 169.044 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -72.17 140.95 35.1 Favored 'Trans proline' 0 CA--C 1.544 0.979 0 C-N-CA 122.578 2.185 . . . . 0.0 111.922 -175.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -72.13 159.99 48.48 Favored 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 123.225 2.617 . . . . 0.0 112.774 -178.381 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -66.41 153.78 92.12 Favored Pre-proline 0 CA--C 1.552 1.056 0 C-N-CA 124.205 1.002 . . . . 0.0 112.619 174.244 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -70.25 168.92 20.81 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 123.431 2.754 . . . . 0.0 112.301 172.353 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 14.9 ptmm? -143.74 157.5 44.34 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.136 1.374 . . . . 0.0 112.82 -178.692 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . 165.8 174.59 35.46 Favored Glycine 0 CA--C 1.537 1.423 0 C-N-CA 125.548 1.547 . . . . 0.0 112.937 179.694 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 19.8 ptpt . . . . . 0 C--O 1.252 1.221 0 C-N-CA 124.754 1.222 . . . . 0.0 113.612 173.722 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.525 0 N-CA-C 111.51 -0.636 . . . . 0.0 111.51 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 33.6 t -63.8 145.33 55.99 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.923 0.889 . . . . 0.0 113.098 178.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 67.7 p -72.79 172.72 10.26 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.177 0.991 . . . . 0.0 110.341 166.329 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 73.75 21.83 78.9 Favored Glycine 0 CA--C 1.535 1.331 0 O-C-N 121.512 -0.743 . . . . 0.0 114.673 177.606 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 8.1 t -58.06 -19.05 28.81 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.263 1.425 . . . . 0.0 113.763 177.356 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 64.8 p -57.78 -26.84 62.47 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.874 1.669 . . . . 0.0 114.219 169.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 57.57 28.37 59.67 Favored Glycine 0 CA--C 1.538 1.492 0 C-N-CA 124.478 1.037 . . . . 0.0 113.835 -172.399 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -62.22 151.48 36.05 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 -169.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 20.9 m -137.42 -4.57 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 C-N-CA 125.8 1.64 . . . . 0.0 113.944 -170.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 43.3 p -149.12 140.44 23.21 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 126.236 1.814 . . . . 0.0 110.302 179.001 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.444 ' HB2' ' HE3' ' A' ' 31' ' ' LYS . 51.4 p30 -144.94 74.14 14.63 Favored Pre-proline 0 CA--C 1.551 0.995 0 N-CA-C 115.704 1.742 . . . . 0.0 115.704 -168.647 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -61.12 -14.79 35.55 Favored 'Trans proline' 0 CA--C 1.549 1.226 0 C-N-CA 123.196 2.597 . . . . 0.0 114.607 176.611 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.0 t -85.64 -4.81 59.27 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.634 1.573 . . . . 0.0 114.256 174.41 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.444 ' HE3' ' HB2' ' A' ' 28' ' ' ASN . 38.4 mtmt -129.2 155.84 79.27 Favored Pre-proline 0 N--CA 1.48 1.06 0 C-N-CA 126.385 1.874 . . . . 0.0 111.584 -175.774 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -73.27 153.2 50.87 Favored 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 122.94 2.427 . . . . 0.0 112.691 178.739 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 163.62 161.08 12.26 Favored Glycine 0 CA--C 1.533 1.191 0 C-N-CA 124.828 1.204 . . . . 0.0 113.367 175.642 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.5 ptt180 -158.4 152.46 23.93 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 126.55 1.94 . . . . 0.0 109.858 168.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 26.2 ttpt -82.63 141.64 32.36 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 121.455 0.645 . . . . 0.0 111.127 174.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 59.3 p -135.74 166.63 22.81 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 125.562 1.545 . . . . 0.0 111.143 -169.24 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 27.3 p-10 -47.54 -38.34 13.95 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.288 1.035 . . . . 0.0 113.767 172.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 15.0 tt0 -72.72 -42.12 64.49 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.424 1.09 . . . . 0.0 112.323 -179.344 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 73.3 mt -67.18 -31.65 72.2 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.566 0.746 . . . . 0.0 112.137 171.262 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -60.96 -48.46 81.7 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 118.539 0.609 . . . . 0.0 110.413 169.551 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -55.76 -41.07 73.44 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.466 0.706 . . . . 0.0 112.415 177.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 90.3 mmm -57.0 -52.87 63.55 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 119.004 -0.522 . . . . 0.0 112.401 172.468 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -77.87 -17.26 57.55 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 114.772 1.397 . . . . 0.0 114.772 -178.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -106.27 -22.35 12.85 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.002 0.921 . . . . 0.0 113.317 -169.122 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 33.7 t -127.96 -51.68 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 C-N-CA 123.234 0.614 . . . . 0.0 111.207 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.7 t -67.72 -62.34 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.206 0.602 . . . . 0.0 110.566 -174.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 55.6 t -57.19 -50.62 76.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 124.375 1.07 . . . . 0.0 110.222 173.138 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm -57.03 -43.49 81.98 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 118.658 0.663 . . . . 0.0 112.407 -174.261 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 56.4 m -69.4 -47.62 63.6 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 117.956 0.344 . . . . 0.0 111.901 176.576 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 70.9 mt -61.43 -33.85 74.41 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.43 0.692 . . . . 0.0 112.313 178.806 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . 0.445 ' CZ3' ' HE3' ' A' ' 87' ' ' LYS . 22.2 t-105 -70.07 -29.64 66.69 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.828 1.651 . . . . 0.0 113.413 176.218 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.4 mtmp? -82.7 -7.1 59.67 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.012 0.925 . . . . 0.0 113.403 177.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 41.0 t-80 -64.76 152.86 41.53 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.707 1.203 . . . . 0.0 113.018 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 26.8 mp0 -60.85 -19.29 59.73 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.578 1.551 . . . . 0.0 113.948 175.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -119.78 15.24 12.64 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.56 1.544 . . . . 0.0 113.672 -175.162 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.93 -26.21 63.09 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.184 1.394 . . . . 0.0 114.345 178.245 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 68.1 p-90 -57.54 -33.89 21.62 Favored Pre-proline 0 CA--C 1.549 0.938 0 N-CA-C 117.967 2.58 . . . . 0.0 117.967 -170.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -77.24 -1.28 11.44 Favored 'Trans proline' 0 CA--C 1.543 0.972 0 CA-C-N 123.437 2.263 . . . . 0.0 113.281 174.755 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 88.4 m-85 -112.03 -4.87 14.37 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.576 1.55 . . . . 0.0 113.411 179.372 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -65.02 -14.76 61.22 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 176.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 69.8 mt-30 -142.91 157.7 60.68 Favored Pre-proline 0 CA--C 1.547 0.861 0 C-N-CA 126.252 1.821 . . . . 0.0 111.069 -176.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -65.65 157.06 60.58 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 123.336 2.691 . . . . 0.0 113.309 176.082 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 21.8 t -77.09 85.8 0.84 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 125.085 1.354 . . . . 0.0 110.015 178.511 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -71.31 86.11 0.8 Allowed 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.025 1.33 . . . . 0.0 111.303 177.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.37 -27.88 26.23 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 124.893 1.277 . . . . 0.0 114.395 -178.492 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 82.0 mt -65.77 -49.96 73.94 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 124.831 1.252 . . . . 0.0 111.109 173.664 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 85.5 mttt -67.3 -40.37 86.03 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.932 1.293 . . . . 0.0 112.4 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.9 mp -82.65 -3.59 56.51 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.869 1.667 . . . . 0.0 112.7 -179.44 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 51.76 56.35 7.97 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.977 1.711 . . . . 0.0 113.123 -178.258 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 28.0 mt -112.76 81.87 4.66 Favored Pre-proline 0 CA--C 1.545 0.751 0 C-N-CA 126.179 1.792 . . . . 0.0 109.926 179.221 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -67.38 -7.82 20.25 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 124.026 3.151 . . . . 0.0 114.827 -170.095 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -132.17 17.49 4.54 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.926 1.691 . . . . 0.0 112.515 -179.156 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -48.12 -51.99 22.38 Favored 'General case' 0 N--CA 1.477 0.911 0 O-C-N 120.86 -1.15 . . . . 0.0 112.985 -175.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -76.19 -6.14 49.95 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.633 1.573 . . . . 0.0 114.496 -179.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.4 mmmp? -84.4 -37.04 21.97 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.979 0.912 . . . . 0.0 111.269 174.757 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.3 mp -81.31 -48.1 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 124.087 0.955 . . . . 0.0 110.099 171.624 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 22.0 mm -86.8 111.67 21.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 123.824 0.85 . . . . 0.0 111.596 -176.518 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 29.6 mmmt -63.14 -32.66 74.1 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.488 1.515 . . . . 0.0 112.878 175.262 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 21.7 p-10 -157.3 96.81 2.04 Favored Pre-proline 0 CA--C 1.551 0.992 0 C-N-CA 126.089 1.756 . . . . 0.0 111.904 -169.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -77.32 149.39 27.78 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 123.557 2.838 . . . . 0.0 111.763 176.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 6.7 tpt -158.42 150.33 21.47 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.663 1.185 . . . . 0.0 111.864 179.358 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -150.21 155.21 39.33 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 126.079 1.751 . . . . 0.0 112.172 -178.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.9 ttp -65.24 -33.68 76.57 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 113.45 0.908 . . . . 0.0 113.45 -174.696 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.93 -44.41 98.17 Favored Glycine 0 CA--C 1.531 1.094 0 C-N-CA 124.594 1.093 . . . . 0.0 112.909 175.242 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 65.0 m -67.2 -42.98 83.25 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 118.382 -0.818 . . . . 0.0 111.597 172.093 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 76.2 mt -52.84 -53.85 19.23 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 CA-C-N 119.801 1.182 . . . . 0.0 111.667 178.15 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.445 ' HE3' ' CZ3' ' A' ' 51' ' ' TRP . 16.0 ptpt -59.95 -29.18 68.23 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 113.891 1.071 . . . . 0.0 113.891 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.6 tpmt? -69.96 -45.59 67.07 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.421 1.089 . . . . 0.0 112.453 177.343 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 5.4 ptp180 -73.07 -27.09 61.53 Favored 'General case' 0 N--CA 1.481 1.095 0 N-CA-C 113.874 1.065 . . . . 0.0 113.874 174.116 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 33.2 mt -67.91 -43.19 79.8 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 113.161 0.8 . . . . 0.0 113.161 168.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -64.67 -46.58 81.81 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 119.006 0.821 . . . . 0.0 112.305 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 64.2 m-80 -75.08 173.91 10.11 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.409 1.484 . . . . 0.0 112.337 174.117 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 60.4 t-20 -87.11 114.17 23.49 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 121.364 -0.835 . . . . 0.0 109.01 168.15 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -137.09 -33.77 0.75 Allowed 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.363 1.065 . . . . 0.0 113.676 179.019 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -139.45 164.84 28.8 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.765 1.626 . . . . 0.0 111.824 177.416 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 5.6 t-105 -91.63 -22.56 20.22 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.736 1.214 . . . . 0.0 112.829 -179.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 7.5 t -143.9 149.01 36.22 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.561 1.144 . . . . 0.0 113.285 -169.353 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -70.96 -18.59 62.62 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 115.764 1.764 . . . . 0.0 115.764 -172.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 11.4 t -60.51 -25.72 66.31 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.403 1.002 . . . . 0.0 113.004 178.491 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -67.08 -42.25 84.98 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 121.31 -0.869 . . . . 0.0 111.87 173.068 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 42.3 t -65.1 -35.4 81.03 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.819 0.847 . . . . 0.0 112.248 172.556 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 80.8 mtp -63.69 -41.43 98.13 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 121.453 -0.78 . . . . 0.0 112.003 173.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -62.17 -39.36 92.39 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 171.373 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 92.4 m-20 -65.0 -42.19 94.7 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 119.414 1.007 . . . . 0.0 112.303 175.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -61.33 -45.79 92.98 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 121.236 -0.915 . . . . 0.0 112.635 172.098 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 31.9 t30 -58.63 -41.11 85.18 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.653 -0.654 . . . . 0.0 111.752 173.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 85.6 m -66.01 -36.56 83.61 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.055 1.342 . . . . 0.0 112.672 178.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 17.3 ttm -58.67 -57.79 11.42 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.025 0.93 . . . . 0.0 111.365 174.179 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 19.3 m-85 -64.86 -38.18 90.11 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 122.831 0.452 . . . . 0.0 112.141 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 92.6 m -64.63 -48.09 76.14 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.502 0.721 . . . . 0.0 112.167 178.414 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -64.23 -30.14 71.21 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 119.785 1.175 . . . . 0.0 112.578 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 98.8 m -61.39 -43.68 98.45 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.356 0.663 . . . . 0.0 112.66 170.052 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 -68.3 -32.26 72.27 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 177.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 73.5 mt -73.24 -57.51 6.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 123.214 0.606 . . . . 0.0 111.091 179.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -68.59 -27.18 65.82 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 114.111 1.152 . . . . 0.0 114.111 -172.242 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 -113.74 164.61 13.49 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.479 1.112 . . . . 0.0 112.506 -171.373 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -71.06 146.02 92.16 Favored Pre-proline 0 N--CA 1.474 0.741 0 C-N-CA 123.918 0.887 . . . . 0.0 110.513 175.629 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -66.87 -5.25 12.89 Favored 'Trans proline' 0 CA--C 1.543 0.97 0 C-N-CA 123.839 3.026 . . . . 0.0 114.659 -176.14 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 45.3 p -112.98 -3.55 14.03 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 126.999 2.12 . . . . 0.0 113.169 -179.652 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 37.1 t0 -68.91 152.38 45.35 Favored 'General case' 0 CA--C 1.542 0.658 0 O-C-N 121.462 -0.774 . . . . 0.0 111.319 174.099 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -54.65 -48.28 72.49 Favored 'General case' 0 N--CA 1.47 0.546 0 O-C-N 121.625 -0.672 . . . . 0.0 111.927 -179.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.5 tp -55.94 -31.98 31.9 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 -177.011 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 49.0 t -71.05 -51.21 36.89 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 C-N-CA 123.362 0.665 . . . . 0.0 110.647 173.406 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 75.5 mt -61.13 -37.46 82.92 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 119.082 0.856 . . . . 0.0 112.005 179.715 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 37.3 mtp -60.59 -49.52 77.21 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 126.183 1.793 . . . . 0.0 111.672 171.416 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -62.1 -39.61 93.07 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 175.043 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 90.6 mt-30 -61.88 -44.47 96.75 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 119.209 0.913 . . . . 0.0 111.98 175.465 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.62 -42.76 95.29 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.656 0.782 . . . . 0.0 112.785 176.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 85.3 mt -63.26 -44.89 93.84 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.282 0.633 . . . . 0.0 111.634 172.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -60.85 -41.43 95.86 Favored 'General case' 0 CA--C 1.538 0.483 0 O-C-N 121.145 -0.972 . . . . 0.0 112.744 -177.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 55.5 mtmt -60.06 -28.49 67.84 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 175.297 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 58.5 mt -84.9 -39.89 14.56 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 C-N-CA 123.481 0.712 . . . . 0.0 111.901 173.251 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -51.88 -51.34 57.49 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.134 -0.978 . . . . 0.0 110.554 172.034 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 99.3 mt -62.35 -40.88 97.84 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.596 0.758 . . . . 0.0 113.006 179.229 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -70.83 -28.4 64.59 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.663 1.119 . . . . 0.0 112.996 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 70.8 mmtt -76.14 -47.09 25.61 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 117.925 -1.036 . . . . 0.0 112.74 173.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 9.1 m -68.41 -24.92 30.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 CA-C-N 121.024 1.738 . . . . 0.0 112.187 176.024 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -60.19 -28.08 67.66 Favored 'General case' 0 CA--C 1.541 0.633 0 O-C-N 121.523 -0.736 . . . . 0.0 112.682 171.058 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 93.7 mt-30 -98.58 2.75 47.69 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.358 1.463 . . . . 0.0 112.769 177.709 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 8.1 ttm -53.45 141.76 42.48 Favored Pre-proline 0 CA--C 1.545 0.769 0 C-N-CA 124.863 1.265 . . . . 0.0 112.78 175.265 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -68.95 111.34 2.62 Favored 'Trans proline' 0 CA--C 1.537 0.666 0 C-N-CA 123.111 2.541 . . . . 0.0 109.02 168.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 -69.3 -22.1 63.82 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 -172.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -84.81 156.77 21.2 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.649 1.579 . . . . 0.0 111.662 175.355 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -131.09 128.84 41.01 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.739 1.216 . . . . 0.0 112.547 -168.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 7.7 p -150.46 146.0 16.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 125.134 1.374 . . . . 0.0 111.88 -178.521 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -63.22 140.66 58.9 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.008 1.323 . . . . 0.0 112.383 175.745 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 83.3 mt -77.09 153.54 34.22 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 114.202 1.186 . . . . 0.0 114.202 -177.633 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 95.3 mt -78.03 157.85 78.2 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 125.254 1.421 . . . . 0.0 111.899 169.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_endo -72.82 161.35 43.98 Favored 'Trans proline' 0 CA--C 1.548 1.224 0 C-N-CA 123.267 2.645 . . . . 0.0 112.725 177.074 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -69.81 162.73 40.97 Favored 'Trans proline' 0 CA--C 1.541 0.838 0 C-N-CA 123.591 2.86 . . . . 0.0 112.871 176.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -64.81 148.37 97.35 Favored Pre-proline 0 CA--C 1.553 1.063 0 C-N-CA 124.227 1.011 . . . . 0.0 113.433 -179.444 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo -77.27 71.3 6.41 Favored 'Trans proline' 0 CA--C 1.545 1.053 0 C-N-CA 124.908 3.739 . . . . 0.0 111.874 176.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 65.5 pttt -52.82 148.6 7.28 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 125.468 1.507 . . . . 0.0 113.992 -178.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . 134.8 -25.55 3.37 Favored Glycine 0 CA--C 1.536 1.37 0 C-N-CA 125.498 1.523 . . . . 0.0 114.296 174.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 4.3 mppt? . . . . . 0 C--O 1.253 1.261 0 C-N-CA 126.687 1.995 . . . . 0.0 110.948 178.779 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.41 0 N-CA-C 111.376 -0.69 . . . . 0.0 111.376 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 48.9 m -142.98 176.15 9.3 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 125.686 1.595 . . . . 0.0 111.839 -174.317 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 56.8 m -153.33 155.31 36.23 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 125.194 1.398 . . . . 0.0 111.494 172.398 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -68.84 158.3 53.01 Favored Glycine 0 CA--C 1.536 1.372 0 C-N-CA 123.927 0.775 . . . . 0.0 114.071 -178.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 89.4 p 40.49 42.04 1.22 Allowed 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 126.843 2.057 . . . . 0.0 115.22 -179.269 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.4 t -59.83 147.17 39.21 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.529 1.132 . . . . 0.0 112.639 -179.786 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 176.33 79.14 0.05 OUTLIER Glycine 0 CA--C 1.532 1.108 0 C-N-CA 124.485 1.04 . . . . 0.0 112.116 -172.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -55.99 155.64 6.11 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 114.209 1.189 . . . . 0.0 114.209 -178.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 19.5 m -127.0 -9.35 4.48 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.267 0 C-N-CA 124.547 1.139 . . . . 0.0 113.985 -170.643 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.3 t -154.18 147.19 24.54 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 125.304 1.442 . . . . 0.0 110.763 175.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -151.3 122.68 3.83 Favored Pre-proline 0 CA--C 1.548 0.871 0 C-N-CA 124.271 1.028 . . . . 0.0 110.778 -175.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_endo -81.48 -10.37 12.13 Favored 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 123.77 2.98 . . . . 0.0 114.365 -177.248 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.2 t -104.66 -41.27 5.73 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.649 1.18 . . . . 0.0 112.673 -172.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.6 ttpm? -68.02 131.64 92.25 Favored Pre-proline 0 CA--C 1.547 0.841 0 C-N-CA 124.043 0.937 . . . . 0.0 110.577 174.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -71.47 156.78 57.7 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 122.76 2.306 . . . . 0.0 113.041 -177.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 176.38 159.46 22.0 Favored Glycine 0 CA--C 1.533 1.164 0 C-N-CA 125.224 1.392 . . . . 0.0 112.621 178.389 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 36.0 ptt180 -144.86 154.43 42.63 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.198 1.399 . . . . 0.0 110.58 169.44 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.6 tptm -81.93 130.73 35.16 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.365 1.066 . . . . 0.0 110.279 177.438 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 65.3 p -135.24 165.22 25.93 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.972 1.309 . . . . 0.0 111.936 -169.459 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -50.31 -35.43 27.41 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 112.354 0.502 . . . . 0.0 112.354 174.617 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 14.2 mp0 -57.91 -65.1 0.69 Allowed 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.137 1.375 . . . . 0.0 111.263 173.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 76.1 mt -63.37 -32.71 74.21 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -175.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 -62.22 -54.65 37.81 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 118.473 0.578 . . . . 0.0 110.77 169.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 65.4 t80 -56.86 -38.26 72.46 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.881 0.872 . . . . 0.0 112.632 -179.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 86.1 mmm -55.07 -49.39 71.77 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 172.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -82.92 -18.03 41.57 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 120.385 1.448 . . . . 0.0 114.524 179.206 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 59.5 t30 -99.09 -24.56 14.85 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.77 1.228 . . . . 0.0 112.767 -170.405 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 39.9 t -130.38 -49.83 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 C-N-CA 123.945 0.898 . . . . 0.0 111.576 -179.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 17.1 t -72.17 -68.14 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 CA-C-N 118.943 0.792 . . . . 0.0 111.058 -170.667 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 60.4 t -58.54 -40.57 79.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 124.578 1.151 . . . . 0.0 110.199 172.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.4 tppt? -52.84 -51.03 62.49 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 118.837 0.744 . . . . 0.0 112.262 177.151 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 72.5 m -70.52 -43.42 69.64 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.191 0.596 . . . . 0.0 111.82 179.253 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 46.5 mt -63.71 -32.04 73.41 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.396 0.679 . . . . 0.0 112.333 179.216 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 14.3 t-105 -74.33 -30.73 62.16 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.887 1.675 . . . . 0.0 113.058 173.038 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp -79.12 -8.8 59.28 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.135 0.974 . . . . 0.0 113.402 175.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 38.6 t-80 -63.02 156.05 25.84 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.278 1.431 . . . . 0.0 113.436 -178.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 19.1 mm100 -60.34 -22.16 62.92 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.052 1.341 . . . . 0.0 114.039 174.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -124.31 21.24 8.76 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.155 1.382 . . . . 0.0 113.666 -172.577 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.01 -24.77 62.44 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.093 1.357 . . . . 0.0 113.95 174.377 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 64.4 p-90 -59.38 -33.88 19.39 Favored Pre-proline 0 CA--C 1.547 0.827 0 N-CA-C 117.538 2.421 . . . . 0.0 117.538 -170.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -79.31 2.47 8.3 Favored 'Trans proline' 0 CA--C 1.547 1.132 0 CA-C-N 122.985 2.102 . . . . 0.0 113.058 172.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -117.9 9.89 13.0 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.273 1.829 . . . . 0.0 113.206 178.077 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 22.5 m-30 -74.6 -17.02 60.78 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 120.396 -1.44 . . . . 0.0 113.538 174.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 31.4 mm-40 -149.21 148.58 27.15 Favored Pre-proline 0 CA--C 1.546 0.805 0 C-N-CA 126.495 1.918 . . . . 0.0 110.753 -178.685 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -68.05 163.26 36.54 Favored 'Trans proline' 0 CA--C 1.537 0.627 0 C-N-CA 124.085 3.19 . . . . 0.0 113.572 -177.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 46.9 t -72.59 89.12 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 124.685 1.194 . . . . 0.0 110.012 173.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -69.57 78.77 0.41 Allowed 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.824 1.25 . . . . 0.0 109.96 169.165 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -52.28 -24.92 8.22 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.677 1.362 . . . . 0.0 114.677 -174.739 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 84.9 mt -62.94 -48.89 85.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 125.204 1.401 . . . . 0.0 111.32 170.651 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 56.5 mttm -76.01 -40.97 52.44 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 125.912 1.685 . . . . 0.0 112.836 -179.159 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -72.12 -11.03 60.56 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.244 1.018 . . . . 0.0 113.555 172.43 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.5 t30 58.46 54.07 5.8 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 126.697 1.999 . . . . 0.0 112.71 178.652 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 37.2 mt -114.61 81.29 6.91 Favored Pre-proline 0 CA--C 1.543 0.691 0 C-N-CA 126.289 1.836 . . . . 0.0 110.17 -178.274 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -66.15 -12.66 36.44 Favored 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 123.325 2.683 . . . . 0.0 113.296 -177.383 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 35.0 m-20 -111.42 6.01 20.02 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 126.074 1.75 . . . . 0.0 113.365 177.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -54.26 -52.22 62.07 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 120.472 1.487 . . . . 0.0 112.15 -178.335 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -76.75 -15.26 59.81 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.692 1.197 . . . . 0.0 114.121 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 9.5 mptt -69.41 -44.52 71.21 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 121.304 -0.873 . . . . 0.0 110.731 174.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.4 mp -81.87 -51.67 14.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 C-N-CA 123.524 0.73 . . . . 0.0 110.151 173.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 22.7 mm -83.41 101.79 8.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 CA-C-O 122.328 1.061 . . . . 0.0 111.599 -177.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -65.7 -30.88 71.62 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 126.046 1.738 . . . . 0.0 113.473 178.063 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -148.6 111.72 3.66 Favored Pre-proline 0 CA--C 1.546 0.819 0 C-N-CA 125.996 1.719 . . . . 0.0 110.488 174.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -87.84 160.23 7.55 Favored 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 124.306 3.337 . . . . 0.0 112.016 172.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.5 tpt -159.3 155.71 27.36 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.84 1.256 . . . . 0.0 111.88 175.578 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -149.65 151.16 33.28 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.103 1.361 . . . . 0.0 113.42 -175.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 4.3 ttp -65.67 -33.24 75.42 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.244 1.017 . . . . 0.0 112.804 -174.396 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -58.53 -45.65 94.24 Favored Glycine 0 CA--C 1.528 0.875 0 C-N-CA 124.327 0.965 . . . . 0.0 112.163 176.012 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 25.4 m -70.13 -43.68 70.47 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.104 0.962 . . . . 0.0 111.885 176.308 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 83.3 mt -52.97 -52.71 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.182 0 CA-C-N 119.428 1.013 . . . . 0.0 111.413 177.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 6.5 ttpm? -56.43 -32.59 65.03 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.424 1.489 . . . . 0.0 113.201 177.548 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.1 tpmt? -72.72 -45.33 59.29 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.936 1.294 . . . . 0.0 113.275 177.394 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 3.1 ptp180 -69.04 -31.09 69.63 Favored 'General case' 0 N--CA 1.483 1.218 0 CA-C-N 119.49 1.041 . . . . 0.0 113.421 174.448 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 55.4 mt -64.94 -41.31 95.62 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 113.774 1.027 . . . . 0.0 113.774 169.255 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -62.3 -33.44 74.66 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 118.809 0.731 . . . . 0.0 112.756 176.709 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 52.5 m-80 -79.52 -176.49 5.31 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 125.624 1.569 . . . . 0.0 112.511 171.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -105.39 42.54 1.22 Allowed 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 125.555 1.542 . . . . 0.0 110.394 174.08 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 45.5 t80 -66.61 -32.99 74.67 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 114.046 1.128 . . . . 0.0 114.046 -168.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -139.04 -177.26 4.81 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.531 1.932 . . . . 0.0 112.755 -177.269 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 4.5 t-105 -107.57 -25.73 11.22 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.41 1.484 . . . . 0.0 112.848 -177.013 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 47.0 t -136.55 143.08 43.49 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.709 1.204 . . . . 0.0 112.162 -170.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -57.56 -19.3 24.5 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.625 1.17 . . . . 0.0 113.839 169.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 10.4 m -53.17 -36.57 61.04 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 119.098 0.863 . . . . 0.0 112.65 177.416 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -71.85 -40.92 68.67 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 123.75 0.82 . . . . 0.0 112.731 176.384 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 43.0 t -61.06 -36.51 79.8 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 123.912 0.885 . . . . 0.0 112.572 170.301 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 78.8 mtp -68.33 -39.8 81.81 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.335 1.054 . . . . 0.0 111.95 175.641 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -61.0 -40.82 95.01 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 123.236 0.614 . . . . 0.0 112.006 169.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -64.03 -43.11 96.55 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 121.535 -0.728 . . . . 0.0 112.245 175.53 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 -61.0 -41.72 97.06 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 121.301 -0.874 . . . . 0.0 112.912 172.375 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 13.9 t30 -57.53 -50.47 72.98 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 118.398 0.544 . . . . 0.0 111.193 172.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 53.7 m -57.84 -38.59 75.92 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 176.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 19.3 ttm -59.96 -62.4 1.9 Allowed 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.515 1.052 . . . . 0.0 111.611 176.152 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -63.02 -39.82 95.91 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -176.479 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 60.8 m -66.25 -44.39 83.83 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 118.272 -0.871 . . . . 0.0 112.572 178.176 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -64.29 -32.63 74.31 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 120.921 1.691 . . . . 0.0 112.398 178.126 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 57.5 m -60.82 -43.98 97.51 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.229 0.612 . . . . 0.0 112.433 169.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -67.66 -32.99 74.05 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 176.604 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 80.0 mt -72.58 -58.01 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 123.613 0.765 . . . . 0.0 111.038 178.25 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -69.71 -19.53 63.56 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 114.381 1.252 . . . . 0.0 114.381 -170.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 36.5 m-80 -123.25 160.15 27.24 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.724 1.21 . . . . 0.0 112.144 -173.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.85 148.72 96.51 Favored Pre-proline 0 N--CA 1.472 0.642 0 C-N-CA 124.242 1.017 . . . . 0.0 110.641 176.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -65.32 -8.52 19.02 Favored 'Trans proline' 0 CA--C 1.543 0.947 0 C-N-CA 123.67 2.913 . . . . 0.0 114.723 -175.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 44.8 p -107.92 -4.08 18.28 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.745 2.018 . . . . 0.0 113.471 179.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -67.09 145.99 54.75 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 118.909 0.777 . . . . 0.0 111.11 175.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -52.68 -45.32 66.76 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.682 0.793 . . . . 0.0 112.736 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 9.1 tp -57.37 -35.19 48.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 124.387 1.075 . . . . 0.0 113.785 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 48.0 t -68.51 -44.38 83.07 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 C-N-CA 123.393 0.677 . . . . 0.0 110.534 174.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 68.9 mt -62.7 -36.43 82.92 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 118.848 0.749 . . . . 0.0 112.094 176.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 1.1 mmt -57.61 -52.27 66.12 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 118.241 0.473 . . . . 0.0 111.004 170.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -63.17 -37.37 86.95 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.582 0.753 . . . . 0.0 112.758 179.322 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 83.2 mt-30 -62.08 -40.61 96.4 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 119.607 1.094 . . . . 0.0 112.861 173.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -69.81 -45.46 67.83 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.545 -0.722 . . . . 0.0 112.107 176.502 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 83.1 mt -64.54 -43.97 92.31 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.622 0.769 . . . . 0.0 112.234 177.193 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -63.27 -40.95 98.83 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 119.81 1.186 . . . . 0.0 112.874 -175.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 36.0 mtmm -59.77 -39.62 85.49 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 121.528 -0.733 . . . . 0.0 111.954 175.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 77.0 mt -72.75 -41.11 61.91 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 C-N-CA 122.947 0.499 . . . . 0.0 111.424 176.467 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 16.7 t80 -51.06 -51.24 55.19 Favored 'General case' 0 CA--C 1.538 0.511 0 O-C-N 121.491 -0.756 . . . . 0.0 110.53 172.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 98.1 mt -65.14 -41.28 94.91 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 178.301 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -65.53 -32.16 73.61 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 120.118 1.327 . . . . 0.0 112.293 179.678 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 70.3 mmtt -75.5 -48.67 21.53 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 117.536 -1.221 . . . . 0.0 112.146 177.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 6.1 m -67.06 -26.76 37.42 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 CA-C-N 121.13 1.786 . . . . 0.0 112.3 177.12 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -61.22 -30.96 70.75 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 172.041 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 99.5 mt-30 -89.58 -7.92 53.76 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.992 1.317 . . . . 0.0 112.955 175.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 46.2 ttp -65.49 144.32 98.91 Favored Pre-proline 0 CA--C 1.547 0.84 0 CA-C-N 119.141 0.882 . . . . 0.0 111.301 173.725 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -53.69 142.94 60.0 Favored 'Trans proline' 0 CA--C 1.539 0.738 0 C-N-CA 122.548 2.165 . . . . 0.0 111.904 168.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -91.29 -24.0 19.97 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 112.581 0.586 . . . . 0.0 112.581 176.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -86.74 155.33 20.39 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.662 1.185 . . . . 0.0 111.508 172.562 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -103.09 138.56 39.77 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.196 1.398 . . . . 0.0 111.558 -174.151 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 69.2 t -137.85 124.65 28.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 125.529 1.532 . . . . 0.0 109.129 177.51 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -69.84 128.73 37.41 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.52 1.128 . . . . 0.0 111.084 169.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 49.8 mt -83.09 161.94 21.5 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -176.126 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 99.3 mt -68.28 155.47 92.3 Favored Pre-proline 0 CA--C 1.549 0.919 0 C-N-CA 124.441 1.096 . . . . 0.0 111.322 169.023 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -72.13 155.85 56.25 Favored 'Trans proline' 0 CA--C 1.547 1.132 0 C-N-CA 122.871 2.38 . . . . 0.0 111.957 177.144 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -72.42 156.41 54.45 Favored 'Trans proline' 0 CA--C 1.539 0.75 0 C-N-CA 123.191 2.594 . . . . 0.0 112.3 177.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -82.14 152.28 67.87 Favored Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 124.265 1.026 . . . . 0.0 112.146 175.533 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -71.11 154.16 62.38 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 123.184 2.589 . . . . 0.0 111.953 173.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -87.95 165.93 14.87 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.918 1.287 . . . . 0.0 111.654 178.102 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . -171.16 -174.72 39.14 Favored Glycine 0 CA--C 1.536 1.345 0 C-N-CA 124.915 1.245 . . . . 0.0 113.545 -178.632 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.166 0 C-N-CA 126.28 1.832 . . . . 0.0 112.971 -179.135 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.396 0 N-CA-C 110.594 -1.002 . . . . 0.0 110.594 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 23.5 m -139.97 26.58 2.24 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 124.778 1.231 . . . . 0.0 112.972 -169.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 65.4 p -141.38 167.17 22.82 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.587 1.555 . . . . 0.0 113.06 -172.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -79.1 -166.76 32.09 Favored Glycine 0 CA--C 1.537 1.423 0 C-N-CA 125.179 1.371 . . . . 0.0 113.917 177.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 25.1 m -52.26 133.93 33.93 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.245 1.018 . . . . 0.0 112.444 177.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 40.2 m -60.79 155.06 20.28 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.49 1.116 . . . . 0.0 113.7 -176.471 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -153.06 42.83 0.65 Allowed Glycine 0 CA--C 1.533 1.173 0 C-N-CA 125.362 1.458 . . . . 0.0 112.345 -176.309 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.423 ' HB2' HD21 ' A' ' 28' ' ' ASN . 11.9 pt-20 -59.11 153.63 17.58 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.344 1.458 . . . . 0.0 113.799 -178.027 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 23.5 m -138.93 -22.37 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 N-CA-C 115.673 1.731 . . . . 0.0 115.673 -170.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 47.5 t -148.53 105.62 3.61 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.402 1.081 . . . . 0.0 110.992 -172.11 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.423 HD21 ' HB2' ' A' ' 25' ' ' GLU . 51.8 m-80 -146.07 117.13 4.88 Favored Pre-proline 0 CA--C 1.548 0.872 0 C-N-CA 124.354 1.062 . . . . 0.0 111.361 -170.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -76.17 -10.51 19.37 Favored 'Trans proline' 0 CA--C 1.544 0.984 0 C-N-CA 124.032 3.155 . . . . 0.0 113.416 177.119 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 64.3 p -67.04 -13.75 62.22 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.756 1.623 . . . . 0.0 114.671 176.759 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 36.0 mtmm -125.19 143.28 43.84 Favored Pre-proline 0 CA--C 1.541 0.615 0 C-N-CA 126.596 1.958 . . . . 0.0 110.798 179.172 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -70.77 146.88 55.08 Favored 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.591 2.194 . . . . 0.0 112.282 -179.121 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 172.61 162.33 24.56 Favored Glycine 0 CA--C 1.529 0.935 0 C-N-CA 124.431 1.015 . . . . 0.0 113.311 177.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -173.49 165.12 4.64 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 127.289 2.236 . . . . 0.0 110.983 175.737 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 5.5 mmtp -64.64 136.22 56.75 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.609 1.164 . . . . 0.0 111.959 173.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 71.0 p -142.0 161.84 36.97 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 126.307 1.843 . . . . 0.0 109.899 177.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 16.0 t30 -52.7 -33.61 48.38 Favored 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 114.622 1.341 . . . . 0.0 114.622 177.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -72.25 -47.15 52.45 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.084 -1.01 . . . . 0.0 112.208 174.002 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 86.1 mt -62.56 -30.88 71.63 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 121.223 -0.923 . . . . 0.0 112.33 174.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -58.98 -54.33 48.3 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.816 1.247 . . . . 0.0 109.947 169.126 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 63.3 t80 -58.49 -41.61 85.72 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.966 0.907 . . . . 0.0 112.909 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 96.2 mmm -54.78 -52.33 62.93 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 118.348 0.522 . . . . 0.0 111.834 173.333 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -71.09 -31.79 68.24 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 113.793 1.034 . . . . 0.0 113.793 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 42.9 t30 -98.89 -16.27 18.88 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 114.658 1.355 . . . . 0.0 114.658 -166.653 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 17.2 t -132.81 -50.26 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 122.8 0.44 . . . . 0.0 111.271 -179.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 17.9 t -69.86 -66.41 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 123.645 0.778 . . . . 0.0 110.423 -174.291 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 48.7 t -55.1 -47.74 76.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 125.836 1.654 . . . . 0.0 110.303 173.266 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 52.0 tttt -59.8 -37.94 80.55 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.89 0.876 . . . . 0.0 113.176 -175.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 22.2 m -83.52 -38.54 21.61 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 118.542 0.61 . . . . 0.0 112.37 177.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 67.9 mt -60.86 -35.49 76.73 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 121.585 -0.697 . . . . 0.0 112.343 172.684 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 20.2 t-105 -70.55 -29.69 66.21 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.201 1.4 . . . . 0.0 113.543 176.507 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 55.0 mttm -71.15 -17.59 62.54 Favored 'General case' 0 N--CA 1.484 1.261 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 172.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 44.5 t-80 -62.37 151.15 37.64 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.58 1.152 . . . . 0.0 113.596 -171.736 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 26.4 mp0 -59.28 -16.77 23.62 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.018 1.727 . . . . 0.0 114.167 176.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 -124.63 17.85 8.78 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.721 1.608 . . . . 0.0 113.747 -177.403 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.24 -28.57 66.46 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 176.139 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.411 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 42.9 p-90 -57.42 -38.05 63.63 Favored Pre-proline 0 CA--C 1.547 0.86 0 N-CA-C 117.613 2.449 . . . . 0.0 117.613 -170.201 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.411 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 73.3 Cg_endo -70.97 -6.26 18.8 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 CA-C-N 123.115 2.148 . . . . 0.0 114.225 173.485 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 56.6 m-85 -109.61 -4.32 16.28 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.343 1.457 . . . . 0.0 112.921 178.646 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 21.0 m-30 -62.43 -18.26 61.28 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 114.343 1.238 . . . . 0.0 114.343 178.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 86.5 mt-30 -143.79 155.75 59.46 Favored Pre-proline 0 CA--C 1.544 0.727 0 C-N-CA 125.787 1.635 . . . . 0.0 110.559 -175.165 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -64.84 146.36 87.96 Favored 'Trans proline' 0 CA--C 1.539 0.773 0 C-N-CA 122.733 2.289 . . . . 0.0 111.862 173.436 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 95.9 t -62.13 120.54 8.6 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 123.932 0.893 . . . . 0.0 111.732 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 38.2 m-20 -89.02 89.45 7.99 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.505 1.122 . . . . 0.0 109.952 169.646 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.95 -28.11 48.85 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 113.603 0.964 . . . . 0.0 113.603 178.54 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 81.8 mt -64.86 -50.08 76.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 124.876 1.27 . . . . 0.0 111.039 172.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -66.86 -41.17 87.76 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.039 1.336 . . . . 0.0 112.807 -179.223 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.4 mp -80.2 -3.78 50.44 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.124 0.969 . . . . 0.0 113.21 176.359 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 61.8 t30 54.89 55.73 7.45 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 126.259 1.824 . . . . 0.0 113.448 -179.422 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 44.1 mt -115.2 80.43 7.26 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 126.587 1.955 . . . . 0.0 110.594 -176.301 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -68.88 -4.7 13.91 Favored 'Trans proline' 0 CA--C 1.544 1.023 0 C-N-CA 123.992 3.128 . . . . 0.0 114.418 -175.203 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -124.54 15.11 8.84 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.524 1.929 . . . . 0.0 111.951 179.195 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -51.12 -57.12 9.54 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 120.727 -1.233 . . . . 0.0 112.788 -176.345 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -73.54 -2.41 22.63 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.962 1.305 . . . . 0.0 114.194 178.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -84.52 -43.23 14.74 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.395 1.078 . . . . 0.0 110.611 176.807 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.3 mp -82.14 -47.57 19.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 C-N-CA 124.397 1.079 . . . . 0.0 110.423 172.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.593 HD11 ' HB2' ' A' ' 115' ' ' TYR . 34.4 mm -78.6 113.7 18.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 123.549 0.74 . . . . 0.0 111.254 -179.04 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -77.01 -31.05 56.14 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.947 1.299 . . . . 0.0 112.575 174.302 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 18.4 p30 -149.88 83.29 6.29 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 125.609 1.564 . . . . 0.0 112.215 -168.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -70.34 138.42 35.93 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 123.179 2.586 . . . . 0.0 110.932 178.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 8.5 tpt -156.32 137.58 13.81 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.863 1.265 . . . . 0.0 110.017 -174.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -146.17 148.31 32.41 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 125.316 1.446 . . . . 0.0 111.364 -175.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 9.4 ttp -57.54 -36.98 72.33 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.173 1.389 . . . . 0.0 113.181 -171.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.56 -27.05 65.45 Favored Glycine 0 CA--C 1.533 1.206 0 C-N-CA 124.989 1.28 . . . . 0.0 114.366 173.584 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 26.0 m -87.36 -37.28 17.23 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.457 1.103 . . . . 0.0 111.215 172.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 66.5 mt -56.43 -51.14 68.08 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 CA-C-N 119.61 1.096 . . . . 0.0 110.892 176.184 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 15.0 ptmm? -59.39 -37.07 77.04 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 175.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.71 -36.41 80.85 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.473 1.109 . . . . 0.0 112.842 -178.634 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 5.7 ptp180 -80.59 -30.62 36.89 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 114.114 1.153 . . . . 0.0 114.114 172.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 76.2 mt -63.74 -30.9 71.94 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-N 119.759 1.163 . . . . 0.0 113.794 168.588 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -66.16 -15.0 62.76 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 114.618 1.34 . . . . 0.0 114.618 -178.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -138.56 177.85 7.58 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 125.397 1.479 . . . . 0.0 113.592 -174.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 4.0 p30 -78.34 97.65 5.68 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 124.431 1.092 . . . . 0.0 111.78 173.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 78.7 t80 -131.24 -37.78 1.24 Allowed 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.54 1.136 . . . . 0.0 113.023 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -132.9 173.44 11.4 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.896 1.678 . . . . 0.0 111.098 169.831 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.6 t-105 -106.78 -19.07 13.76 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.306 1.042 . . . . 0.0 112.544 -177.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 78.6 p -137.63 145.71 43.05 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.487 1.115 . . . . 0.0 114.009 -170.251 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -63.53 -22.22 66.77 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 114.847 1.425 . . . . 0.0 114.847 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 15.3 p -51.54 -35.29 40.18 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.273 1.029 . . . . 0.0 113.452 174.612 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -70.01 -43.52 71.2 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.117 0.967 . . . . 0.0 112.105 176.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 51.0 t -63.32 -39.33 94.25 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.245 1.018 . . . . 0.0 112.298 173.04 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 86.7 mtp -61.75 -42.14 98.58 Favored 'General case' 0 N--CA 1.47 0.546 0 O-C-N 121.291 -0.881 . . . . 0.0 112.279 174.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 90.8 mm-40 -62.93 -38.57 91.51 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 172.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -63.77 -42.45 97.78 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 119.347 0.976 . . . . 0.0 112.421 174.503 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -59.66 -45.28 92.51 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 121.21 -0.931 . . . . 0.0 112.356 171.313 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -57.97 -46.03 85.8 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.82 -0.55 . . . . 0.0 112.222 174.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 84.0 m -63.75 -38.31 90.64 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.177 0.991 . . . . 0.0 112.669 176.415 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 51.0 ttp -59.13 -53.07 62.55 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 119.385 0.993 . . . . 0.0 112.03 176.214 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -68.33 -39.53 81.91 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 121.996 -0.44 . . . . 0.0 112.081 179.367 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 86.4 m -64.24 -48.26 76.5 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.65 0.78 . . . . 0.0 112.063 -179.719 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -64.06 -32.18 73.64 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 119.055 0.843 . . . . 0.0 112.067 -179.7 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 88.7 m -61.16 -44.24 97.63 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.731 0.812 . . . . 0.0 112.885 170.406 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 17.0 m-85 -67.63 -29.45 68.76 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 114.031 1.122 . . . . 0.0 114.031 178.326 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 87.5 mt -68.83 -56.91 10.43 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 123.136 0.574 . . . . 0.0 110.648 175.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . 0.593 ' HB2' HD11 ' A' ' 77' ' ' ILE . 25.8 t80 -69.61 -37.83 77.03 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 -173.028 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 52.3 m-80 -103.55 151.88 22.36 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.408 1.083 . . . . 0.0 111.164 -172.468 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.34 153.87 93.97 Favored Pre-proline 0 N--CA 1.469 0.493 0 C-N-CA 123.804 0.842 . . . . 0.0 111.135 178.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -64.02 -3.28 5.71 Favored 'Trans proline' 0 CA--C 1.547 1.133 0 C-N-CA 124.288 3.325 . . . . 0.0 114.79 -178.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 62.1 p -122.22 0.02 9.47 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 126.944 2.097 . . . . 0.0 113.256 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 65.5 m-20 -67.93 146.1 53.93 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 118.886 0.766 . . . . 0.0 110.759 170.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -56.45 -46.46 80.31 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 121.537 -0.727 . . . . 0.0 112.36 -176.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.5 tp -55.38 -29.84 24.48 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 125.008 1.323 . . . . 0.0 114.321 177.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 40.3 t -72.31 -47.22 53.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 O-C-N 121.272 -0.893 . . . . 0.0 110.431 173.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 71.0 mt -61.03 -36.97 80.94 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 118.943 0.792 . . . . 0.0 111.617 176.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 9.4 mtt -58.92 -51.88 68.13 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.957 1.303 . . . . 0.0 112.081 169.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.6 -40.08 90.51 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.349 0.659 . . . . 0.0 112.702 176.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 89.1 mt-30 -61.73 -45.92 91.85 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 119.072 0.851 . . . . 0.0 111.975 173.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -67.65 -28.72 67.96 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.55 1.14 . . . . 0.0 113.794 178.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 77.1 mt -76.72 -46.84 23.87 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.513 0.725 . . . . 0.0 111.455 169.517 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -61.4 -40.36 94.1 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.186 0.903 . . . . 0.0 113.084 -174.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -60.52 -33.72 73.05 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 113.187 0.81 . . . . 0.0 113.187 177.254 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 48.1 mt -78.75 -43.21 25.36 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 124.026 0.93 . . . . 0.0 111.415 173.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -49.33 -50.06 41.28 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 120.036 1.289 . . . . 0.0 110.907 172.168 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 99.9 mt -62.99 -42.72 99.92 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 113.126 0.788 . . . . 0.0 113.126 179.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -69.7 -28.44 65.83 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.793 1.179 . . . . 0.0 112.782 178.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 33.9 mmtm -72.8 -52.03 16.6 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 125.423 1.489 . . . . 0.0 111.639 175.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.9 m -68.89 -25.09 29.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 CA-C-N 119.88 1.218 . . . . 0.0 112.382 178.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -59.15 -29.01 67.11 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 173.071 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -92.57 -4.11 53.97 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.637 1.175 . . . . 0.0 112.866 176.371 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 40.7 ttp -65.87 139.14 96.7 Favored Pre-proline 0 CA--C 1.546 0.814 0 O-C-N 121.189 -0.945 . . . . 0.0 110.371 170.557 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -65.74 133.25 33.32 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 122.929 2.419 . . . . 0.0 110.896 176.103 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -69.1 -30.8 69.16 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 178.317 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -76.57 162.04 28.1 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.651 1.58 . . . . 0.0 111.153 169.383 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -134.81 145.19 48.11 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.678 1.191 . . . . 0.0 111.802 -176.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 54.9 t -131.55 134.17 60.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 125.311 1.444 . . . . 0.0 110.622 -174.472 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -69.19 120.61 15.29 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.599 1.559 . . . . 0.0 111.399 171.004 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 91.2 mt -82.58 154.84 24.79 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.115 0.966 . . . . 0.0 112.986 -179.347 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 4.3 pp -66.39 153.87 91.9 Favored Pre-proline 0 CA--C 1.551 1.005 0 C-N-CA 123.955 0.902 . . . . 0.0 111.863 169.216 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -76.24 141.79 23.56 Favored 'Trans proline' 0 CA--C 1.547 1.159 0 C-N-CA 123.04 2.493 . . . . 0.0 111.794 -179.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -73.91 165.45 32.11 Favored 'Trans proline' 0 CA--C 1.54 0.807 0 C-N-CA 123.393 2.728 . . . . 0.0 112.779 179.229 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -61.28 152.81 71.18 Favored Pre-proline 0 CA--C 1.553 1.082 0 C-N-CA 124.089 0.955 . . . . 0.0 111.884 169.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -66.62 147.29 81.53 Favored 'Trans proline' 0 CA--C 1.538 0.713 0 C-N-CA 122.853 2.368 . . . . 0.0 112.548 -179.479 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -150.27 126.92 10.91 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.918 1.687 . . . . 0.0 110.035 -178.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . 159.66 -163.86 33.8 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 124.347 0.975 . . . . 0.0 113.611 -175.067 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.252 1.235 0 C-N-CA 126.308 1.843 . . . . 0.0 109.818 177.227 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.385 0 N-CA-C 111.113 -0.795 . . . . 0.0 111.113 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 39.1 m -60.36 151.25 28.37 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.424 1.09 . . . . 0.0 112.954 177.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.9 m -74.8 -8.2 55.7 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 113.961 1.097 . . . . 0.0 113.961 174.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -175.34 -175.61 42.92 Favored Glycine 0 CA--C 1.534 1.236 0 C-N-CA 126.579 2.038 . . . . 0.0 111.564 178.269 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 32.2 p -61.92 107.08 0.79 Allowed 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.304 1.042 . . . . 0.0 112.018 174.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 56.1 m -63.7 -25.33 68.15 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 115.236 1.569 . . . . 0.0 115.236 -172.083 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 52.32 44.89 58.45 Favored Glycine 0 CA--C 1.537 1.424 0 C-N-CA 125.133 1.349 . . . . 0.0 115.831 169.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -57.81 151.86 16.96 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 114.676 1.362 . . . . 0.0 114.676 -176.436 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 16.5 m -135.12 -10.3 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 C-N-CA 124.879 1.272 . . . . 0.0 113.911 -176.431 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 56.3 p -149.06 135.33 19.25 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 126.265 1.826 . . . . 0.0 110.561 -179.395 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 28.7 p-10 -148.22 141.2 15.24 Favored Pre-proline 0 CA--C 1.551 1.004 0 C-N-CA 124.642 1.177 . . . . 0.0 113.253 -171.475 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -82.58 -20.67 5.57 Favored 'Trans proline' 0 CA--C 1.543 0.95 0 C-N-CA 123.877 3.051 . . . . 0.0 112.976 170.178 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 50.4 p -76.22 -11.18 59.87 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 126.188 1.795 . . . . 0.0 115.22 -174.826 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -133.76 130.5 20.72 Favored Pre-proline 0 CA--C 1.543 0.706 0 C-N-CA 125.982 1.713 . . . . 0.0 110.56 -176.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -75.11 164.06 33.89 Favored 'Trans proline' 0 CA--C 1.539 0.767 0 C-N-CA 122.93 2.42 . . . . 0.0 111.448 175.564 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -168.67 171.8 42.88 Favored Glycine 0 CA--C 1.527 0.82 0 N-CA-C 115.34 0.896 . . . . 0.0 115.34 178.159 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 47.7 mtm180 -145.75 179.47 7.42 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 127.129 2.172 . . . . 0.0 111.681 -172.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 40.1 tttm -128.49 69.89 1.37 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 127.196 2.198 . . . . 0.0 109.063 172.389 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 50.3 p -82.71 170.54 14.98 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.313 1.445 . . . . 0.0 113.501 -175.64 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 27.6 p-10 -48.47 -37.43 17.31 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 125.084 1.354 . . . . 0.0 114.503 169.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -72.82 -49.58 29.51 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 121.481 -0.762 . . . . 0.0 111.539 178.761 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 93.5 mt -63.53 -30.98 72.02 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 121.552 -0.717 . . . . 0.0 112.386 175.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.465 ' HB2' HD11 ' A' ' 147' ' ' LEU . 52.3 tt0 -58.79 -53.78 54.47 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 123.635 0.774 . . . . 0.0 110.498 168.835 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -59.67 -39.76 85.56 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.794 0.838 . . . . 0.0 112.772 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 93.0 mmm -55.89 -49.19 74.08 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 121.559 -0.713 . . . . 0.0 111.668 171.257 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -85.65 -3.79 58.98 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 115.046 1.499 . . . . 0.0 115.046 -175.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 37.1 m-80 -122.08 -16.76 7.42 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.305 1.442 . . . . 0.0 114.46 -176.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 54.8 t -134.07 -50.26 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 123.77 0.828 . . . . 0.0 111.359 -179.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 22.0 t -69.65 -63.19 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 CA-C-N 119.16 0.891 . . . . 0.0 110.594 -174.36 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 85.1 t -58.65 -44.66 90.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 123.946 0.898 . . . . 0.0 110.405 172.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? -56.91 -45.01 82.92 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.949 0.9 . . . . 0.0 112.614 -177.462 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 56.4 m -72.75 -45.04 60.74 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 122.813 0.445 . . . . 0.0 111.679 177.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 69.8 mt -62.97 -33.54 75.6 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.137 0.575 . . . . 0.0 112.237 179.331 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 19.5 t-105 -71.55 -29.85 65.21 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.288 1.435 . . . . 0.0 113.339 174.073 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -80.49 -7.8 59.32 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 176.032 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 40.2 t-80 -64.02 154.28 34.71 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.691 1.196 . . . . 0.0 113.357 -179.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -61.95 -17.59 57.44 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.143 1.377 . . . . 0.0 114.179 175.721 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -122.9 17.33 10.14 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.557 1.543 . . . . 0.0 113.664 -174.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.53 -27.99 65.64 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 114.165 1.172 . . . . 0.0 114.165 177.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.408 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 43.3 p-90 -57.65 -37.81 60.44 Favored Pre-proline 0 CA--C 1.548 0.882 0 N-CA-C 117.808 2.521 . . . . 0.0 117.808 -169.636 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.408 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 97.9 Cg_endo -74.09 -3.46 13.83 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 CA-C-N 123.143 2.158 . . . . 0.0 113.9 173.609 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -109.96 -4.67 15.79 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.475 1.51 . . . . 0.0 112.969 178.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 22.5 m-30 -63.11 -16.39 59.83 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 114.143 1.164 . . . . 0.0 114.143 175.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 90.3 mt-30 -145.73 157.96 50.47 Favored Pre-proline 0 CA--C 1.546 0.817 0 C-N-CA 126.175 1.79 . . . . 0.0 110.837 -175.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -66.53 155.35 70.63 Favored 'Trans proline' 0 C--N 1.35 0.63 0 C-N-CA 122.933 2.422 . . . . 0.0 111.844 171.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 37.1 t -76.61 99.72 2.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 124.202 1.001 . . . . 0.0 109.879 177.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -71.6 88.63 0.95 Allowed 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.319 1.048 . . . . 0.0 111.351 175.193 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.64 -31.16 46.29 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.576 1.15 . . . . 0.0 114.094 -179.154 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 84.3 mt -66.12 -49.33 77.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 124.702 1.201 . . . . 0.0 111.075 174.476 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -65.42 -37.01 85.67 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 125.464 1.505 . . . . 0.0 113.376 -179.026 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.8 mp -88.25 -2.97 58.91 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.431 1.493 . . . . 0.0 112.558 177.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 24.1 m120 52.55 57.97 5.86 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.015 1.726 . . . . 0.0 113.255 -178.237 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 47.0 mt -114.29 81.75 6.82 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 126.625 1.97 . . . . 0.0 109.992 -179.369 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -67.19 -8.65 22.54 Favored 'Trans proline' 0 CA--C 1.543 0.963 0 C-N-CA 123.969 3.113 . . . . 0.0 113.684 -175.183 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 18.7 p-10 -118.21 8.2 12.27 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 127.988 2.515 . . . . 0.0 113.078 179.781 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 86.3 t80 -52.25 -57.24 10.31 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 120.164 1.347 . . . . 0.0 112.124 -179.215 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 99.8 m-70 -75.89 -5.93 48.39 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.21 1.404 . . . . 0.0 114.104 178.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -78.08 -32.65 50.84 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.974 0.909 . . . . 0.0 111.419 174.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.1 mp -98.26 -44.85 12.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 125.734 1.613 . . . . 0.0 111.296 175.371 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 21.3 mm -71.48 114.65 10.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 123.552 0.741 . . . . 0.0 110.929 176.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.69 -35.9 51.73 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 124.709 1.204 . . . . 0.0 113.226 172.448 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 15.2 p30 -145.34 83.81 8.9 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 125.213 1.405 . . . . 0.0 112.119 -167.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -68.63 138.58 42.02 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 123.482 2.788 . . . . 0.0 110.927 178.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.9 tpt -159.58 145.55 16.03 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 125.352 1.461 . . . . 0.0 110.116 -175.43 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -149.77 152.42 35.2 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.869 1.267 . . . . 0.0 112.005 -177.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 6.8 ttp -59.72 -33.87 72.18 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.524 1.129 . . . . 0.0 112.564 -177.51 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -60.51 -23.45 60.5 Favored Glycine 0 CA--C 1.536 1.366 0 C-N-CA 125.86 1.695 . . . . 0.0 114.977 172.123 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 89.8 m -97.11 -37.04 10.28 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.393 1.077 . . . . 0.0 111.372 173.178 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 98.7 mt -53.45 -49.75 52.59 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 CA-C-N 119.877 1.217 . . . . 0.0 111.088 175.368 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.7 -30.3 65.4 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 113.828 1.048 . . . . 0.0 113.828 175.846 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.449 ' HA ' ' HE3' ' A' ' 88' ' ' LYS . 1.2 tpmt? -80.17 -35.61 36.21 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.099 0.96 . . . . 0.0 112.992 -175.811 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 9.4 ptp180 -70.27 -29.84 66.73 Favored 'General case' 0 N--CA 1.482 1.138 0 CA-C-N 119.399 0.999 . . . . 0.0 113.03 169.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 70.3 mt -63.58 -43.32 97.32 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.664 0.786 . . . . 0.0 112.341 169.213 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -71.93 -2.22 17.25 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 114.662 1.356 . . . . 0.0 114.662 175.082 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 39.4 m-80 -124.77 15.05 8.67 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.667 1.587 . . . . 0.0 113.565 -177.539 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 40.62 47.83 2.45 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 126.247 1.819 . . . . 0.0 114.287 -179.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 85.8 t80 -63.17 -20.64 65.59 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 126.243 1.817 . . . . 0.0 114.179 -170.318 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -143.18 164.82 29.14 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 128.158 2.583 . . . . 0.0 111.729 -171.009 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 23.9 t-105 -87.6 -25.38 23.61 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.804 1.242 . . . . 0.0 112.703 -179.184 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 6.4 t -145.68 152.52 39.76 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 125.418 1.487 . . . . 0.0 111.981 -169.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -67.38 -15.76 63.86 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 115.248 1.574 . . . . 0.0 115.248 -176.622 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 32.0 p -54.06 -34.93 61.37 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 177.844 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -72.36 -41.36 66.49 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.669 0.787 . . . . 0.0 111.989 176.651 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 48.0 t -62.71 -40.48 97.27 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 123.914 0.886 . . . . 0.0 111.838 172.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 88.2 mtp -60.63 -41.69 95.38 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.9 0.88 . . . . 0.0 112.075 172.657 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 43.2 mm-40 -66.82 -30.32 70.48 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 173.617 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 80.3 m-20 -69.8 -39.95 76.24 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 119.702 1.137 . . . . 0.0 112.075 172.601 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -60.98 -47.99 83.89 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 121.631 -0.668 . . . . 0.0 111.959 169.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 33.0 t30 -55.45 -44.54 76.45 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.616 0.766 . . . . 0.0 111.805 173.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 96.0 m -61.49 -46.8 88.48 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.207 1.003 . . . . 0.0 111.884 177.358 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 50.7 ttp -56.75 -52.91 63.18 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.1 0.96 . . . . 0.0 112.439 177.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -67.16 -39.48 86.5 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.744 -0.597 . . . . 0.0 112.139 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 96.8 m -64.32 -47.89 77.69 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.951 0.9 . . . . 0.0 112.013 178.769 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.3 p30 -63.72 -30.66 71.73 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 118.814 0.734 . . . . 0.0 112.382 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 67.4 m -64.25 -42.24 96.59 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.279 1.031 . . . . 0.0 112.54 172.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 15.0 m-85 -68.23 -29.75 68.64 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 177.704 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 88.1 mt -69.73 -56.34 11.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 123.331 0.652 . . . . 0.0 110.557 176.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 57.4 t80 -70.49 -38.43 74.37 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 114.595 1.332 . . . . 0.0 114.595 -172.004 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 59.9 m-80 -97.36 159.26 15.02 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.262 1.025 . . . . 0.0 111.939 -175.103 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -68.85 150.55 97.59 Favored Pre-proline 0 N--CA 1.473 0.676 0 O-C-N 121.299 -0.875 . . . . 0.0 109.721 173.282 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -65.66 -1.75 5.35 Favored 'Trans proline' 0 CA--C 1.546 1.115 0 C-N-CA 123.854 3.036 . . . . 0.0 114.722 -179.119 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 56.2 p -120.88 -0.33 10.13 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 126.947 2.099 . . . . 0.0 113.198 -179.301 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -66.75 145.77 55.17 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.601 -0.687 . . . . 0.0 110.805 170.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -56.45 -45.42 80.85 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.445 -0.784 . . . . 0.0 112.441 -176.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.6 tp -55.7 -29.93 26.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 124.955 1.302 . . . . 0.0 114.171 177.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 42.3 t -72.81 -45.97 54.65 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 O-C-N 121.314 -0.866 . . . . 0.0 110.519 173.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 68.5 mt -61.44 -36.76 81.27 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 119.137 0.88 . . . . 0.0 111.675 176.231 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 11.5 mtt -59.39 -52.48 65.42 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.581 1.152 . . . . 0.0 111.994 169.72 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -59.56 -40.26 86.73 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.589 0.755 . . . . 0.0 112.431 177.165 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -61.21 -50.39 73.3 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.977 0.911 . . . . 0.0 111.745 174.437 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -63.07 -40.0 96.38 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.434 0.693 . . . . 0.0 112.823 179.573 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 73.7 mt -65.53 -46.88 77.86 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.485 0.714 . . . . 0.0 111.72 172.167 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -62.78 -37.4 86.5 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.11 -0.994 . . . . 0.0 112.908 -177.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 23.5 mmmt -55.79 -41.82 74.66 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.234 1.014 . . . . 0.0 112.214 172.175 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 78.2 mt -78.18 -39.06 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 C-N-CA 123.921 0.888 . . . . 0.0 111.288 178.386 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 31.9 t80 -50.85 -51.99 45.82 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.53 -0.731 . . . . 0.0 110.302 172.08 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.9 mt -62.53 -41.8 99.11 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 178.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -67.64 -30.15 69.64 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 119.885 1.221 . . . . 0.0 112.664 179.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 69.8 mmtt -76.65 -50.18 14.37 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 117.646 -1.168 . . . . 0.0 112.505 175.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 6.6 m -66.71 -25.34 34.56 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 CA-C-N 121.084 1.765 . . . . 0.0 112.329 178.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -58.93 -28.25 66.05 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 171.284 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 95.0 mm-40 -95.95 -4.73 42.82 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.07 1.348 . . . . 0.0 112.925 177.129 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 41.6 ttp -64.96 137.3 97.11 Favored Pre-proline 0 CA--C 1.545 0.779 0 O-C-N 121.402 -0.811 . . . . 0.0 109.994 169.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -67.85 131.3 23.74 Favored 'Trans proline' 0 CA--C 1.535 0.538 0 C-N-CA 122.642 2.228 . . . . 0.0 110.72 178.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 83.0 mt-30 -70.35 -24.95 63.07 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -76.72 154.82 33.76 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.187 0.995 . . . . 0.0 112.469 169.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -132.4 133.22 43.65 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.363 1.065 . . . . 0.0 110.827 -172.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 7.8 p -150.47 142.73 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 124.678 1.191 . . . . 0.0 111.56 -177.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -65.11 142.3 58.42 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-O 121.554 0.692 . . . . 0.0 111.179 171.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . 0.465 HD11 ' HB2' ' A' ' 40' ' ' GLN . 98.6 mt -73.86 166.47 23.27 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 113.882 1.067 . . . . 0.0 113.882 -178.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 4.3 pp -136.75 153.99 76.11 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 126.823 2.049 . . . . 0.0 111.03 177.026 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_endo -77.16 150.65 29.5 Favored 'Trans proline' 0 CA--C 1.547 1.128 0 C-N-CA 123.005 2.47 . . . . 0.0 112.749 -173.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -72.19 159.68 49.17 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 123.338 2.692 . . . . 0.0 112.335 175.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -153.2 152.27 27.52 Favored Pre-proline 0 CA--C 1.548 0.893 0 C-N-CA 125.304 1.441 . . . . 0.0 111.344 176.44 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -69.92 135.06 29.13 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 123.051 2.501 . . . . 0.0 111.635 177.364 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -156.52 152.37 27.25 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.851 1.66 . . . . 0.0 111.75 178.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . 160.92 34.19 0.02 OUTLIER Glycine 0 CA--C 1.537 1.429 0 N-CA-C 115.298 0.879 . . . . 0.0 115.298 -179.022 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 99.4 mttt . . . . . 0 C--O 1.252 1.229 0 C-N-CA 125.164 1.386 . . . . 0.0 113.031 -179.225 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.532 0 CA-C-O 121.327 0.404 . . . . 0.0 112.165 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 29.9 m -160.43 163.1 33.29 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 126.153 1.781 . . . . 0.0 111.068 174.82 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.2 t -154.79 170.95 20.41 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.417 1.087 . . . . 0.0 112.601 -178.625 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 77.02 -60.36 3.48 Favored Glycine 0 CA--C 1.533 1.203 0 C-N-CA 126.622 2.058 . . . . 0.0 114.145 177.367 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 8.4 t -62.41 165.87 5.67 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.844 1.258 . . . . 0.0 112.669 176.61 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.2 t -53.67 140.3 29.66 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.338 1.055 . . . . 0.0 112.092 175.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -171.48 -174.36 39.09 Favored Glycine 0 CA--C 1.533 1.16 0 CA-C-O 121.873 0.707 . . . . 0.0 114.663 -171.657 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -63.0 164.69 7.88 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.958 1.703 . . . . 0.0 115.562 -174.37 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 30.4 m -122.83 -8.25 8.25 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 C-N-CA 126.651 1.98 . . . . 0.0 113.868 -172.38 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 38.8 t -145.34 125.12 13.38 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 126.071 1.748 . . . . 0.0 109.854 178.114 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 23.2 t-20 -151.56 130.04 6.19 Favored Pre-proline 0 CA--C 1.549 0.931 0 C-N-CA 124.619 1.168 . . . . 0.0 110.9 -176.177 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -79.59 -18.91 10.4 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 C-N-CA 123.577 2.851 . . . . 0.0 114.578 -176.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 15.3 t -87.14 -38.76 16.14 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.439 1.096 . . . . 0.0 112.444 -178.183 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.1 ttmp? -60.94 126.68 86.26 Favored Pre-proline 0 CA--C 1.546 0.819 0 C-N-CA 124.817 1.247 . . . . 0.0 110.548 174.426 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -72.84 144.32 38.65 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.795 2.33 . . . . 0.0 112.336 -178.361 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 160.38 164.42 15.39 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 124.288 0.947 . . . . 0.0 113.705 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 12.4 ptm180 -163.34 162.05 24.85 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 126.602 1.961 . . . . 0.0 110.974 172.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 47.8 pttt -61.48 142.4 57.04 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 170.299 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 69.7 p -148.22 165.34 31.23 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 126.763 2.025 . . . . 0.0 110.895 179.661 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 19.7 p-10 -51.41 -35.37 38.8 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 114.561 1.319 . . . . 0.0 114.561 175.781 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -69.37 -50.64 44.3 Favored 'General case' 0 CA--C 1.531 0.243 0 O-C-N 121.899 -0.501 . . . . 0.0 110.531 178.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 86.9 mt -61.44 -34.88 76.16 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.983 0.913 . . . . 0.0 112.052 175.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.5 ' HB2' HD11 ' A' ' 147' ' ' LEU . 7.5 tp60 -59.41 -52.73 64.35 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.253 1.021 . . . . 0.0 111.516 171.736 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 73.3 t80 -55.04 -42.54 72.8 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.128 0.971 . . . . 0.0 112.269 177.019 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.413 ' HG3' ' HB1' ' A' ' 98' ' ' ALA . 96.0 mmm -58.27 -51.11 71.15 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.291 0.636 . . . . 0.0 112.615 174.865 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -79.33 -15.02 58.6 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 114.952 1.464 . . . . 0.0 114.952 179.455 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 35.5 m-20 -103.52 -19.5 14.36 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 119.644 1.111 . . . . 0.0 113.902 -174.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 39.3 t -133.64 -48.55 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 123.926 0.89 . . . . 0.0 111.506 -178.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.424 HG22 ' HB3' ' A' ' 136' ' ' LYS . 19.9 t -72.3 -64.42 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 CA-C-N 119.015 0.825 . . . . 0.0 110.908 -171.865 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 86.5 t -57.06 -43.3 80.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 124.098 0.959 . . . . 0.0 109.939 171.335 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 12.2 tppt? -58.89 -34.48 71.7 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.195 0.998 . . . . 0.0 113.341 -178.328 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 78.1 m -84.01 -42.97 15.64 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 118.716 0.689 . . . . 0.0 111.555 175.673 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 67.9 mt -61.85 -33.04 73.44 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.567 0.747 . . . . 0.0 112.313 177.693 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 19.8 t-105 -74.71 -28.73 60.93 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.782 1.633 . . . . 0.0 113.303 175.335 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 32.5 mtmm -74.71 -13.55 60.63 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 114.001 1.112 . . . . 0.0 114.001 171.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 36.1 t-80 -61.92 154.5 26.11 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.386 1.075 . . . . 0.0 113.507 -175.141 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 65.4 mt-30 -59.87 -18.27 43.13 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.345 1.458 . . . . 0.0 114.148 176.019 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -126.36 20.51 7.38 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.372 1.469 . . . . 0.0 113.882 -174.221 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.1 -28.08 65.11 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 113.774 1.028 . . . . 0.0 113.774 175.177 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.408 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 49.7 p-90 -57.89 -37.14 52.56 Favored Pre-proline 0 CA--C 1.548 0.878 0 N-CA-C 117.689 2.477 . . . . 0.0 117.689 -170.171 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.408 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 87.4 Cg_endo -73.02 -5.32 16.99 Favored 'Trans proline' 0 CA--C 1.542 0.924 0 CA-C-N 123.048 2.124 . . . . 0.0 113.925 173.606 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 72.0 m-85 -109.01 -4.87 16.33 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.312 1.445 . . . . 0.0 113.135 178.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -61.97 -18.24 59.73 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 114.327 1.232 . . . . 0.0 114.327 179.388 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -141.44 154.41 66.87 Favored Pre-proline 0 CA--C 1.544 0.718 0 C-N-CA 125.995 1.718 . . . . 0.0 110.348 179.36 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -67.67 150.19 79.37 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 122.755 2.303 . . . . 0.0 112.626 176.732 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 89.2 t -62.59 142.24 16.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 123.892 0.877 . . . . 0.0 110.904 171.375 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -125.06 96.0 4.7 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.467 1.507 . . . . 0.0 109.767 174.214 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.8 -29.18 59.29 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -178.15 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 85.3 mt -64.88 -49.04 81.8 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 124.652 1.181 . . . . 0.0 110.831 173.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -68.19 -42.05 80.5 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.092 1.357 . . . . 0.0 112.731 -179.501 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.6 mp -78.79 -5.15 52.61 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 124.418 1.087 . . . . 0.0 113.231 176.274 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 61.5 t30 55.34 53.67 9.63 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.213 1.805 . . . . 0.0 113.647 -179.224 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 25.7 mt -113.43 86.39 10.0 Favored Pre-proline 0 CA--C 1.544 0.715 0 C-N-CA 126.285 1.834 . . . . 0.0 110.094 -177.374 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_endo -67.82 -4.1 11.66 Favored 'Trans proline' 0 CA--C 1.543 0.965 0 C-N-CA 123.548 2.832 . . . . 0.0 113.247 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 16.9 p-10 -123.7 1.25 8.8 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 127.35 2.26 . . . . 0.0 114.277 -178.436 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -54.42 -51.1 65.97 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 120.288 1.404 . . . . 0.0 112.034 178.056 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 99.7 m-70 -77.26 1.99 16.95 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.607 1.563 . . . . 0.0 114.281 177.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.6 mmtp -95.92 -42.55 8.24 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.835 1.254 . . . . 0.0 110.553 177.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.9 mp -76.59 -48.33 26.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 C-N-CA 124.05 0.94 . . . . 0.0 110.279 171.357 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 36.6 mm -96.3 128.7 47.25 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 124.318 1.047 . . . . 0.0 111.35 -177.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -95.86 -37.86 10.54 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.831 1.252 . . . . 0.0 111.588 -178.597 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 42.2 m-20 -130.13 78.73 74.17 Favored Pre-proline 0 CA--C 1.547 0.863 0 C-N-CA 125.421 1.488 . . . . 0.0 109.963 -173.063 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -71.13 143.96 45.65 Favored 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 123.948 3.099 . . . . 0.0 111.6 -179.514 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 8.5 tpt -156.88 141.09 16.47 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.316 1.046 . . . . 0.0 111.875 -171.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -148.99 150.8 33.45 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 125.765 1.626 . . . . 0.0 112.409 -175.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 7.0 ttp -59.04 -36.84 75.68 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.893 1.277 . . . . 0.0 113.77 -171.355 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -59.99 -21.27 55.62 Favored Glycine 0 CA--C 1.533 1.183 0 C-N-CA 125.591 1.567 . . . . 0.0 114.739 175.025 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 35.1 m -90.18 -42.04 11.27 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.724 0.81 . . . . 0.0 111.196 173.367 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 66.4 mt -56.15 -48.28 79.43 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 124.215 1.006 . . . . 0.0 111.407 -178.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.78 -33.59 66.78 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 178.531 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 2.5 tppp? -74.31 -41.89 60.41 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.483 1.113 . . . . 0.0 112.362 -178.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 4.6 ptp180 -71.52 -30.9 66.46 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 172.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 23.7 mt -61.31 -39.16 89.47 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.292 0.951 . . . . 0.0 113.404 169.547 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -67.58 -13.13 61.8 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 115.354 1.613 . . . . 0.0 115.354 -174.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -132.67 175.36 9.39 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.426 1.49 . . . . 0.0 113.727 -178.357 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -77.69 80.84 4.14 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 125.0 1.32 . . . . 0.0 111.999 -178.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 49.3 t80 -114.79 -36.5 4.48 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.815 1.246 . . . . 0.0 113.097 -175.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -137.92 169.95 16.9 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 127.431 2.292 . . . . 0.0 110.925 171.769 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.1 t-105 -102.19 -23.84 13.99 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.675 1.19 . . . . 0.0 112.763 -175.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 35.3 t -139.34 146.51 40.36 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.897 1.279 . . . . 0.0 111.003 177.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.413 ' HB1' ' HG3' ' A' ' 42' ' ' MET . . . -59.74 -13.99 12.49 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.789 2.036 . . . . 0.0 115.133 176.14 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 53.5 p -52.23 -33.0 39.33 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 120.564 1.529 . . . . 0.0 113.353 172.503 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -74.86 -39.56 61.49 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.608 1.163 . . . . 0.0 112.479 176.412 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -71.89 -31.05 66.03 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 124.142 0.977 . . . . 0.0 112.391 178.157 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 86.2 mtp -62.18 -40.72 96.98 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 125.114 1.365 . . . . 0.0 111.875 170.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -66.31 -31.08 71.65 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 174.658 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -67.85 -42.77 80.86 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 119.42 1.009 . . . . 0.0 111.659 170.439 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -59.96 -44.7 94.27 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 121.072 -1.018 . . . . 0.0 112.646 171.818 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 19.3 t30 -57.45 -44.58 84.87 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 121.57 -0.706 . . . . 0.0 111.656 172.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 63.7 m -65.66 -35.76 81.71 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.333 1.053 . . . . 0.0 112.528 178.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 16.5 ttm -58.89 -60.27 4.13 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.982 0.913 . . . . 0.0 111.475 173.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -63.63 -38.58 91.65 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 122.612 0.365 . . . . 0.0 111.781 -177.684 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 72.9 m -64.8 -47.85 76.58 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.377 0.671 . . . . 0.0 112.133 178.036 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -64.64 -30.98 72.01 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 120.155 1.343 . . . . 0.0 112.406 178.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 85.5 m -62.35 -45.98 90.75 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.356 0.662 . . . . 0.0 112.229 170.072 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -66.12 -34.45 78.08 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 177.126 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 77.4 mt -69.78 -57.6 7.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 C-N-CA 123.407 0.683 . . . . 0.0 110.782 177.583 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 48.7 t80 -69.45 -26.71 64.73 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -171.069 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 46.0 m-80 -114.76 161.04 18.7 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.091 0.956 . . . . 0.0 112.45 -171.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -66.26 146.01 99.01 Favored Pre-proline 0 N--CA 1.473 0.695 0 C-N-CA 124.228 1.011 . . . . 0.0 110.341 176.398 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -65.89 -7.84 17.99 Favored 'Trans proline' 0 CA--C 1.542 0.924 0 C-N-CA 123.659 2.906 . . . . 0.0 114.595 -175.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 56.8 p -115.26 0.96 13.67 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 126.703 2.001 . . . . 0.0 113.175 179.133 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -65.83 148.0 52.47 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 121.476 -0.765 . . . . 0.0 110.844 172.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -51.55 -49.55 61.78 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 123.417 0.687 . . . . 0.0 112.203 178.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 9.7 tp -57.28 -30.14 34.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 -179.221 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 42.7 t -73.15 -47.08 48.76 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 O-C-N 121.515 -0.74 . . . . 0.0 110.588 173.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 80.3 mt -61.29 -37.39 83.01 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 119.11 0.868 . . . . 0.0 111.649 176.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 8.8 mtt -59.12 -51.14 71.32 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.993 1.317 . . . . 0.0 111.915 169.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.09 -39.67 86.93 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 176.196 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -62.49 -45.32 93.54 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 119.502 1.046 . . . . 0.0 111.872 174.094 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -66.57 -29.61 69.72 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.304 1.042 . . . . 0.0 113.724 179.637 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 80.4 mt -78.05 -47.61 17.99 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.976 0.91 . . . . 0.0 111.65 169.91 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -62.1 -38.65 89.69 Favored 'General case' 0 N--CA 1.468 0.45 0 O-C-N 121.05 -1.032 . . . . 0.0 113.128 -174.486 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 19.7 pttp -58.26 -42.88 87.44 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 118.783 0.72 . . . . 0.0 111.874 176.179 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 77.0 mt -67.74 -46.49 82.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 C-N-CA 124.3 1.04 . . . . 0.0 110.743 176.073 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 44.8 t80 -50.94 -50.63 57.44 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.142 0.883 . . . . 0.0 111.237 173.753 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.1 mt -62.98 -41.21 99.5 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 179.151 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -61.43 -37.96 85.41 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 119.409 1.004 . . . . 0.0 112.955 173.154 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . 0.424 ' HB3' HG22 ' A' ' 46' ' ' VAL . 71.6 mmtt -72.47 -49.5 32.79 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.175 0.99 . . . . 0.0 112.616 179.709 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 7.1 m -69.21 -25.79 30.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 CA-C-N 119.955 1.252 . . . . 0.0 112.126 177.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -59.37 -31.02 68.83 Favored 'General case' 0 CA--C 1.541 0.596 0 O-C-N 121.607 -0.683 . . . . 0.0 112.208 171.377 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 29.1 mm100 -97.0 3.84 51.79 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.239 1.415 . . . . 0.0 113.106 177.729 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 9.6 ttm -54.26 140.89 53.32 Favored Pre-proline 0 CA--C 1.546 0.826 0 C-N-CA 124.642 1.177 . . . . 0.0 112.164 174.392 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -68.82 112.62 2.95 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 122.901 2.401 . . . . 0.0 109.008 168.184 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -68.81 -20.13 64.31 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 -173.654 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -82.41 157.7 23.59 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.547 1.539 . . . . 0.0 112.269 176.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -117.65 128.22 54.71 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.608 1.563 . . . . 0.0 110.865 -174.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 63.4 t -141.88 135.07 29.1 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 126.472 1.909 . . . . 0.0 109.901 -171.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -70.55 131.29 43.76 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.534 1.534 . . . . 0.0 112.404 175.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . 0.5 HD11 ' HB2' ' A' ' 40' ' ' GLN . 93.9 mt -80.61 160.07 25.21 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 177.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 95.8 mt -67.58 159.0 80.77 Favored Pre-proline 0 CA--C 1.549 0.942 0 C-N-CA 125.647 1.579 . . . . 0.0 112.813 172.689 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -71.2 153.97 61.98 Favored 'Trans proline' 0 CA--C 1.548 1.187 0 C-N-CA 123.007 2.471 . . . . 0.0 112.424 176.341 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_endo -76.57 170.34 20.11 Favored 'Trans proline' 0 CA--C 1.54 0.811 0 C-N-CA 123.87 3.047 . . . . 0.0 112.913 179.157 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -61.21 155.62 55.26 Favored Pre-proline 0 CA--C 1.553 1.074 0 C-N-CA 124.384 1.073 . . . . 0.0 112.021 169.383 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -74.73 -9.65 21.26 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 123.254 2.636 . . . . 0.0 115.095 -177.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 28.2 ttpp -77.17 139.44 39.92 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.737 1.615 . . . . 0.0 111.28 175.251 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . 178.51 174.69 44.98 Favored Glycine 0 CA--C 1.535 1.315 0 C-N-CA 124.297 0.951 . . . . 0.0 113.951 176.451 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.254 1.29 0 C-N-CA 127.818 2.447 . . . . 0.0 113.223 -176.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.484 0 N-CA-C 111.263 -0.735 . . . . 0.0 111.263 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.3 t -139.43 17.79 2.56 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.822 1.249 . . . . 0.0 113.296 -178.022 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 40.2 m -156.88 138.35 13.95 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.726 1.61 . . . . 0.0 110.23 171.719 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -110.84 -172.07 19.68 Favored Glycine 0 CA--C 1.533 1.2 0 C-N-CA 125.31 1.433 . . . . 0.0 112.61 177.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 47.4 m -54.77 108.64 0.41 Allowed 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.902 1.281 . . . . 0.0 112.09 178.058 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 9.3 t -154.84 159.49 40.58 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.342 1.457 . . . . 0.0 111.38 -176.095 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 155.17 69.58 0.01 OUTLIER Glycine 0 CA--C 1.529 0.916 0 C-N-CA 124.776 1.179 . . . . 0.0 111.612 -174.07 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.2 pm0 -54.02 153.53 4.87 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 115.28 1.585 . . . . 0.0 115.28 -174.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 27.3 m -141.24 -7.27 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 C-N-CA 125.563 1.545 . . . . 0.0 114.311 -169.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.4 m -142.88 29.26 1.52 Allowed 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.813 1.245 . . . . 0.0 114.113 -172.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -53.45 125.46 44.12 Favored Pre-proline 0 CA--C 1.553 1.061 0 C-N-CA 124.369 1.068 . . . . 0.0 112.718 -175.852 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -79.71 -167.61 0.53 Allowed 'Trans proline' 0 CA--C 1.542 0.913 0 C-N-CA 124.558 3.505 . . . . 0.0 110.959 175.862 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 32.6 m 49.29 29.29 2.63 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 126.96 2.104 . . . . 0.0 114.799 179.093 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.8 ttpp -147.6 139.05 13.55 Favored Pre-proline 0 CA--C 1.544 0.734 0 C-N-CA 127.276 2.23 . . . . 0.0 110.47 -168.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -73.56 161.02 43.16 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 123.252 2.635 . . . . 0.0 112.744 177.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 155.69 159.2 9.21 Favored Glycine 0 CA--C 1.533 1.164 0 C-N-CA 125.869 1.7 . . . . 0.0 112.165 172.779 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 7.2 ptp180 -160.1 165.46 31.7 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 126.072 1.749 . . . . 0.0 110.44 178.881 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.0 ttpt -75.4 132.52 40.94 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 166.352 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 66.6 p -124.85 170.14 11.35 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 126.115 1.766 . . . . 0.0 108.829 177.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 23.8 p-10 -52.03 -32.09 32.71 Favored 'General case' 0 N--CA 1.475 0.819 0 O-C-N 121.161 -0.962 . . . . 0.0 113.349 173.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.9 mm-40 -70.7 -53.44 15.63 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 123.846 0.859 . . . . 0.0 111.745 177.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.8 mt -64.25 -32.75 74.46 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 119.067 0.848 . . . . 0.0 112.551 176.657 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 22.8 tt0 -59.65 -50.22 74.71 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.144 0.977 . . . . 0.0 111.146 170.126 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 62.5 t80 -57.83 -40.9 81.13 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.625 0.77 . . . . 0.0 112.376 176.63 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 82.0 mmm -56.64 -52.44 64.86 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 122.765 0.426 . . . . 0.0 112.007 174.106 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -78.24 -18.1 55.82 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 -178.837 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 42.3 m-20 -99.47 -21.56 15.9 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.594 0.961 . . . . 0.0 113.594 -173.241 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 29.3 t -135.89 -48.45 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 CA-C-O 118.511 -0.757 . . . . 0.0 111.915 -177.898 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 18.4 t -68.23 -63.67 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 CA-C-N 119.151 0.887 . . . . 0.0 110.669 -173.811 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 81.7 t -57.83 -47.13 86.83 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 C-N-CA 124.454 1.101 . . . . 0.0 110.13 173.348 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -57.41 -44.09 84.32 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 118.682 0.674 . . . . 0.0 112.703 -176.341 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 48.1 m -69.87 -46.72 64.9 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 121.977 -0.452 . . . . 0.0 111.654 176.856 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 66.7 mt -61.63 -33.46 73.97 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.236 0.614 . . . . 0.0 112.157 178.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 24.0 t-105 -71.29 -29.36 64.96 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.88 1.672 . . . . 0.0 113.413 176.013 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 54.2 mtmt -83.83 -8.34 59.24 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.066 0.947 . . . . 0.0 113.503 177.442 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 43.2 t-80 -62.69 154.67 28.64 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.719 1.208 . . . . 0.0 113.152 -178.249 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -60.29 -17.14 40.45 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.307 1.443 . . . . 0.0 114.176 174.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -124.14 15.24 9.13 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.735 1.614 . . . . 0.0 113.984 -174.562 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.82 -30.2 67.66 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.802 1.241 . . . . 0.0 114.14 178.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.428 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 38.6 p-90 -56.26 -37.85 61.95 Favored Pre-proline 0 CA--C 1.548 0.9 0 N-CA-C 117.466 2.395 . . . . 0.0 117.466 -170.471 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.428 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 72.1 Cg_endo -72.05 -5.71 17.65 Favored 'Trans proline' 0 CA--C 1.544 0.976 0 CA-C-N 123.164 2.166 . . . . 0.0 114.179 173.434 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -108.91 -4.83 16.46 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.352 1.461 . . . . 0.0 113.057 178.323 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 21.3 m-30 -64.29 -16.17 61.63 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 113.927 1.084 . . . . 0.0 113.927 176.107 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -143.37 158.61 57.42 Favored Pre-proline 0 CA--C 1.546 0.826 0 C-N-CA 126.437 1.895 . . . . 0.0 110.726 -177.123 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -64.81 157.67 55.05 Favored 'Trans proline' 0 CA--C 1.536 0.6 0 C-N-CA 123.052 2.501 . . . . 0.0 112.75 175.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 36.0 t -75.71 87.3 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 C-N-CA 124.679 1.192 . . . . 0.0 109.434 174.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 58.4 m-20 -69.87 85.81 0.5 Allowed 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.837 1.255 . . . . 0.0 111.78 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.3 -28.24 27.19 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.913 1.285 . . . . 0.0 114.128 178.621 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 82.7 mt -66.44 -49.89 71.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 125.177 1.391 . . . . 0.0 111.152 173.265 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -66.69 -38.63 87.18 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.93 1.292 . . . . 0.0 112.543 178.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 84.7 mt -85.24 -5.29 59.33 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 126.439 1.896 . . . . 0.0 113.205 -178.118 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 51.37 54.88 10.32 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.907 1.683 . . . . 0.0 113.174 -176.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 45.0 mt -114.41 81.5 6.79 Favored Pre-proline 0 N--CA 1.474 0.742 0 C-N-CA 125.803 1.641 . . . . 0.0 110.676 -179.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -66.57 -14.14 42.79 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 123.423 2.748 . . . . 0.0 113.583 -175.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 34.4 m-20 -106.95 5.07 27.89 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.615 1.566 . . . . 0.0 113.269 177.005 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -53.54 -51.65 62.22 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 120.321 1.419 . . . . 0.0 112.788 -175.244 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -76.8 -16.05 59.56 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.857 1.263 . . . . 0.0 113.839 -179.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 9.4 mptt -68.37 -42.22 79.48 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.875 0.87 . . . . 0.0 110.363 174.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.9 mp -81.1 -55.34 8.37 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 C-N-CA 124.534 1.133 . . . . 0.0 110.431 173.637 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 50.5 mm -85.44 100.69 8.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 CA-C-O 122.322 1.058 . . . . 0.0 111.295 -176.386 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -66.93 -29.38 69.23 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 126.121 1.769 . . . . 0.0 114.091 179.328 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -145.51 78.34 12.06 Favored Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 125.689 1.596 . . . . 0.0 110.909 -171.349 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -68.66 149.67 73.85 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 124.157 3.238 . . . . 0.0 112.087 -178.441 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 8.7 tpt -158.22 148.83 20.46 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.771 1.228 . . . . 0.0 111.1 -171.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -152.75 152.08 31.24 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.069 1.348 . . . . 0.0 112.278 178.774 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 6.6 ttp -60.24 -33.73 72.69 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.632 1.173 . . . . 0.0 112.477 -176.541 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -61.52 -23.52 62.82 Favored Glycine 0 CA--C 1.536 1.397 0 C-N-CA 125.734 1.635 . . . . 0.0 114.769 172.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 93.3 m -93.98 -38.95 10.91 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 118.363 1.081 . . . . 0.0 111.387 172.079 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 89.9 mt -53.07 -50.03 47.27 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 CA-C-N 119.69 1.132 . . . . 0.0 111.108 176.462 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -57.89 -35.78 71.49 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 176.414 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 22.5 ttmm -70.86 -38.51 73.13 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.229 1.012 . . . . 0.0 113.208 -177.842 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -72.78 -30.48 64.14 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-N 119.122 0.874 . . . . 0.0 113.189 171.062 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 48.8 mt -63.7 -39.09 93.45 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-N 119.744 1.156 . . . . 0.0 113.243 168.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -77.52 14.42 1.0 Allowed 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.88 1.272 . . . . 0.0 113.732 176.685 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 32.6 m-80 -137.08 167.51 21.39 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 127.006 2.122 . . . . 0.0 111.317 177.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -75.94 37.0 0.15 Allowed 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 125.514 1.526 . . . . 0.0 111.952 173.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 30.0 t80 -70.82 -31.03 67.64 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 120.438 -1.413 . . . . 0.0 113.324 -169.254 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -144.12 -178.31 5.88 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 127.127 2.171 . . . . 0.0 110.389 175.196 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 6.6 t-105 -113.99 -25.17 8.68 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.565 1.146 . . . . 0.0 111.485 177.002 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.1 m -130.27 136.45 49.19 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 125.165 1.386 . . . . 0.0 111.775 -168.493 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -66.24 -16.48 64.04 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 115.669 1.729 . . . . 0.0 115.669 -173.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 16.5 m -53.76 -32.31 51.81 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.381 0.991 . . . . 0.0 112.909 175.089 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -69.87 -44.13 70.44 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.822 0.849 . . . . 0.0 112.442 175.632 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 43.4 t -61.72 -37.55 84.62 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.165 0.986 . . . . 0.0 112.466 171.277 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 83.2 mtp -65.96 -40.04 90.95 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.037 0.935 . . . . 0.0 112.155 176.395 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -63.44 -36.31 83.32 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 112.716 0.635 . . . . 0.0 112.716 170.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 91.8 m-20 -65.47 -43.67 89.57 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 119.445 1.02 . . . . 0.0 112.12 173.29 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -57.72 -45.78 85.29 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 121.374 -0.829 . . . . 0.0 112.445 171.482 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 13.6 t30 -55.92 -52.43 64.15 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.385 0.674 . . . . 0.0 111.779 174.293 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 53.5 m -57.86 -43.43 85.96 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.831 0.852 . . . . 0.0 112.476 178.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 53.2 ttp -56.72 -53.42 57.92 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 118.996 0.817 . . . . 0.0 112.9 177.407 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -69.25 -35.54 76.22 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 179.689 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.7 m -58.75 -49.96 75.68 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.372 1.069 . . . . 0.0 111.983 172.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -57.86 -38.72 76.22 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.316 0.646 . . . . 0.0 112.108 -178.335 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 24.0 m -56.1 -42.22 76.46 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.027 0.931 . . . . 0.0 112.707 172.612 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 7.0 m-85 -71.18 -29.34 65.06 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 176.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 79.3 mt -75.26 -57.75 5.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 123.617 0.767 . . . . 0.0 110.654 179.546 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -71.44 -27.06 63.02 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 114.362 1.245 . . . . 0.0 114.362 -171.739 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 36.6 m-80 -113.1 161.68 16.82 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.591 1.156 . . . . 0.0 111.729 -173.1 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -71.82 151.45 93.19 Favored Pre-proline 0 N--CA 1.471 0.621 0 C-N-CA 123.998 0.919 . . . . 0.0 109.79 176.557 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -65.38 -1.03 4.07 Favored 'Trans proline' 0 CA--C 1.547 1.134 0 C-N-CA 123.763 2.976 . . . . 0.0 114.691 -179.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 53.8 p -118.8 -2.28 10.92 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 127.176 2.191 . . . . 0.0 113.167 -179.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 58.4 m-20 -68.56 145.87 53.59 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 118.929 0.786 . . . . 0.0 110.804 170.598 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -56.74 -45.1 82.2 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.413 -0.805 . . . . 0.0 112.589 -176.318 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.6 tp -55.88 -29.37 25.96 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 124.946 1.298 . . . . 0.0 114.214 178.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 37.3 t -71.07 -48.3 56.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 O-C-N 121.364 -0.835 . . . . 0.0 110.416 172.779 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 66.4 mt -61.41 -36.59 80.72 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 118.829 0.74 . . . . 0.0 111.697 177.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 10.8 mtt -58.93 -51.73 68.8 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 124.854 1.261 . . . . 0.0 112.048 170.153 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.82 -39.35 91.46 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.358 0.663 . . . . 0.0 112.681 176.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 90.1 mt-30 -61.51 -47.06 87.3 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 119.107 0.867 . . . . 0.0 111.817 174.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -63.16 -45.2 92.97 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 123.802 0.841 . . . . 0.0 112.512 178.112 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 81.7 mt -64.96 -45.02 87.43 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.742 0.817 . . . . 0.0 112.084 175.525 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -63.71 -37.46 87.43 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 121.093 -1.004 . . . . 0.0 112.751 -177.071 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -58.53 -40.03 81.81 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 121.399 -0.813 . . . . 0.0 112.272 172.377 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 78.5 mt -74.3 -40.92 50.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 C-N-CA 123.243 0.617 . . . . 0.0 111.349 177.086 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -51.16 -51.36 54.46 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.456 -0.778 . . . . 0.0 110.364 171.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 96.1 mt -62.92 -41.31 99.43 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 112.904 0.705 . . . . 0.0 112.904 177.581 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -67.16 -29.98 69.82 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 120.199 1.363 . . . . 0.0 112.845 -179.737 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 71.5 mmtt -74.86 -52.43 11.35 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.953 0.901 . . . . 0.0 112.285 174.34 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.8 m -65.96 -24.81 34.66 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 120.316 1.416 . . . . 0.0 112.151 179.126 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -61.84 -28.54 69.56 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 121.475 -0.765 . . . . 0.0 112.933 171.207 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -96.51 -3.34 43.39 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.462 1.505 . . . . 0.0 112.599 177.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 5.9 ttm -57.24 142.01 76.21 Favored Pre-proline 0 CA--C 1.548 0.898 0 C-N-CA 124.298 1.039 . . . . 0.0 110.727 169.686 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_endo -63.16 145.96 93.89 Favored 'Trans proline' 0 CA--C 1.537 0.675 0 C-N-CA 122.563 2.175 . . . . 0.0 110.252 169.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -77.75 -17.66 57.32 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 120.827 -1.171 . . . . 0.0 113.344 177.468 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -94.45 154.11 17.6 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.32 1.448 . . . . 0.0 112.605 -177.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -128.91 133.28 47.83 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.247 1.419 . . . . 0.0 111.335 -172.168 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 9.1 p -147.87 145.13 18.98 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 124.184 0.994 . . . . 0.0 112.914 -174.289 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -64.15 132.93 51.88 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.304 1.841 . . . . 0.0 111.684 171.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 92.8 mt -78.01 173.63 11.98 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 178.722 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 4.4 pp -121.25 153.94 58.53 Favored Pre-proline 0 CA--C 1.547 0.857 0 C-N-CA 126.005 1.722 . . . . 0.0 110.641 173.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -73.51 151.69 47.81 Favored 'Trans proline' 0 CA--C 1.545 1.061 0 C-N-CA 122.654 2.236 . . . . 0.0 113.398 -169.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -72.46 167.78 26.1 Favored 'Trans proline' 0 CA--C 1.54 0.777 0 C-N-CA 123.878 3.052 . . . . 0.0 112.737 177.288 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -61.02 150.53 78.14 Favored Pre-proline 0 CA--C 1.551 1.019 0 C-N-CA 124.238 1.015 . . . . 0.0 112.71 174.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -75.03 76.57 3.37 Favored 'Trans proline' 0 CA--C 1.545 1.051 0 C-N-CA 124.513 3.475 . . . . 0.0 112.086 178.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -134.97 155.64 50.41 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 126.241 1.816 . . . . 0.0 111.562 -178.381 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . -78.13 161.89 49.39 Favored Glycine 0 CA--C 1.536 1.375 0 C-N-CA 124.008 0.813 . . . . 0.0 113.491 176.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt . . . . . 0 C--O 1.252 1.221 0 C-N-CA 125.938 1.695 . . . . 0.0 111.351 -179.912 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.424 0 N-CA-C 110.883 -0.887 . . . . 0.0 110.883 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 23.2 t -53.44 133.53 40.59 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.87 0.868 . . . . 0.0 111.752 177.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 60.2 m -138.11 26.18 2.7 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.957 1.303 . . . . 0.0 113.29 -168.662 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -60.12 155.99 30.15 Favored Glycine 0 CA--C 1.54 1.595 0 C-N-CA 124.266 0.936 . . . . 0.0 114.173 176.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 16.7 m -72.73 -18.8 61.48 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 114.905 1.446 . . . . 0.0 114.905 -173.664 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 35.6 m -67.73 168.77 10.73 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.161 1.385 . . . . 0.0 113.446 179.191 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -141.0 156.58 25.59 Favored Glycine 0 CA--C 1.534 1.276 0 C-N-CA 124.993 1.282 . . . . 0.0 112.755 173.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -78.87 154.93 29.36 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.325 1.05 . . . . 0.0 113.65 -174.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 29.6 m -134.36 -11.59 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 C-N-CA 125.239 1.416 . . . . 0.0 113.614 178.271 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 81.2 p -145.99 149.77 34.78 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 126.38 1.872 . . . . 0.0 109.995 171.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 40.0 p30 -154.36 145.96 16.82 Favored Pre-proline 0 CA--C 1.55 0.954 0 C-N-CA 123.967 0.907 . . . . 0.0 112.929 -170.631 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -87.92 -27.45 0.54 Allowed 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 123.622 2.881 . . . . 0.0 113.322 174.247 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 24.9 m -83.68 -38.02 22.0 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 -168.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 34.2 ttmt -80.31 134.67 54.9 Favored Pre-proline 0 N--CA 1.476 0.864 0 C-N-CA 123.54 0.736 . . . . 0.0 109.952 176.441 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_endo -71.37 154.67 60.94 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 122.361 2.04 . . . . 0.0 111.754 174.347 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -173.65 159.81 29.72 Favored Glycine 0 CA--C 1.53 0.974 0 C-N-CA 123.976 0.798 . . . . 0.0 113.314 176.06 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.5 ptt180 -157.53 164.84 36.94 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.39 1.876 . . . . 0.0 110.601 174.019 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 8.3 mmmt -71.48 121.02 17.9 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.878 1.271 . . . . 0.0 111.419 170.259 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 34.3 p -135.02 160.01 39.67 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 125.027 1.331 . . . . 0.0 112.376 -179.254 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 36.1 t30 -53.69 -33.21 54.69 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.808 1.643 . . . . 0.0 114.53 174.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 70.1 mm-40 -62.93 -56.94 12.81 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.041 0.936 . . . . 0.0 111.148 170.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 89.8 mt -65.42 -31.37 72.43 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 179.306 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.47 ' HB2' HD11 ' A' ' 147' ' ' LEU . 21.9 tt0 -58.44 -55.25 37.4 Favored 'General case' 0 C--O 1.223 -0.298 0 C-N-CA 123.332 0.653 . . . . 0.0 110.082 169.693 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -57.29 -40.61 78.17 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 118.819 0.736 . . . . 0.0 112.305 -178.74 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 95.3 mmm -56.8 -52.36 65.35 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 121.856 -0.527 . . . . 0.0 112.373 172.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -83.64 -10.31 58.3 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 114.904 1.446 . . . . 0.0 114.904 -174.323 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -116.75 -18.6 10.21 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.477 1.511 . . . . 0.0 112.744 -170.069 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 10.9 t -133.03 -53.08 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 C-N-CA 123.574 0.75 . . . . 0.0 111.628 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.7 t -66.0 -63.99 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 CA-C-N 118.856 0.753 . . . . 0.0 110.599 -175.41 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 82.8 t -57.15 -47.59 83.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 124.022 0.929 . . . . 0.0 109.757 172.021 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.0 tptp -57.34 -43.12 83.16 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 113.442 0.904 . . . . 0.0 113.442 -171.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 91.2 m -77.67 -42.95 32.83 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 118.915 0.78 . . . . 0.0 112.556 174.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 79.7 mt -58.31 -30.85 66.99 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.397 0.998 . . . . 0.0 112.258 175.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 40.9 t-105 -75.77 -35.51 60.1 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 126.521 1.929 . . . . 0.0 114.129 179.171 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 21.6 pttp -88.93 -3.64 58.68 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 114.244 1.202 . . . . 0.0 114.244 178.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 60.1 t-80 -54.31 152.67 6.1 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.99 2.116 . . . . 0.0 113.318 173.088 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 22.8 tp60 -56.8 -21.39 28.44 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 126.158 1.783 . . . . 0.0 114.738 177.308 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -123.19 15.2 9.81 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.43 1.492 . . . . 0.0 114.077 -173.507 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.06 -27.39 62.65 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 114.444 1.276 . . . . 0.0 114.444 179.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.401 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 38.0 p-90 -55.64 -37.14 53.72 Favored Pre-proline 0 CA--C 1.55 0.958 0 N-CA-C 117.725 2.491 . . . . 0.0 117.725 -170.853 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.401 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 85.5 Cg_endo -73.28 -5.49 17.24 Favored 'Trans proline' 0 CA--C 1.543 0.949 0 CA-C-N 123.249 2.196 . . . . 0.0 114.022 174.219 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 62.0 m-85 -107.47 -5.53 17.59 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.479 1.512 . . . . 0.0 112.918 179.086 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -64.29 -14.79 58.04 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.673 1.36 . . . . 0.0 114.673 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -138.87 153.98 72.4 Favored Pre-proline 0 CA--C 1.543 0.688 0 C-N-CA 125.597 1.559 . . . . 0.0 110.146 -179.377 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -65.41 149.11 88.4 Favored 'Trans proline' 0 CA--C 1.537 0.632 0 C-N-CA 122.595 2.197 . . . . 0.0 111.898 174.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 74.0 t -58.58 138.04 20.14 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 123.505 0.722 . . . . 0.0 110.991 171.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -128.7 106.62 9.06 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 125.547 1.539 . . . . 0.0 108.841 171.593 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.08 -28.0 64.16 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.276 1.03 . . . . 0.0 113.576 -178.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 79.7 mt -66.94 -50.91 60.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 124.751 1.22 . . . . 0.0 110.913 172.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 56.6 mttm -66.09 -39.33 89.9 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.771 1.228 . . . . 0.0 112.854 -177.587 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 55.3 mt -91.29 1.0 57.43 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.851 1.26 . . . . 0.0 113.745 179.624 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 65.0 t30 51.42 53.54 12.65 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 126.237 1.815 . . . . 0.0 113.768 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 36.0 mt -107.47 98.26 22.94 Favored Pre-proline 0 CA--C 1.544 0.718 0 C-N-CA 125.802 1.641 . . . . 0.0 109.769 -177.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -69.11 -10.55 29.4 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 122.984 2.456 . . . . 0.0 114.744 -171.318 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -139.95 17.54 2.47 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.261 1.424 . . . . 0.0 113.384 -173.337 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -47.99 -52.01 21.57 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-N 120.025 1.284 . . . . 0.0 113.729 -172.248 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -75.37 -9.62 58.72 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.166 1.387 . . . . 0.0 114.38 -178.7 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 29.4 mmmt -78.7 -44.85 22.63 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 121.229 -0.92 . . . . 0.0 110.59 174.337 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.3 mp -74.14 -45.35 48.13 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 124.111 0.964 . . . . 0.0 110.426 173.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 35.3 mm -101.24 109.97 26.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 CA-C-O 122.252 1.025 . . . . 0.0 111.896 -175.6 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.5 mptp? -79.49 -29.77 41.74 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.754 1.622 . . . . 0.0 113.0 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -138.06 85.1 19.65 Favored Pre-proline 0 CA--C 1.544 0.737 0 C-N-CA 125.207 1.403 . . . . 0.0 110.463 -178.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -73.15 144.89 38.28 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 123.529 2.82 . . . . 0.0 111.058 176.369 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.8 tpt -155.0 142.18 19.38 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.969 1.307 . . . . 0.0 110.508 -178.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 20.4 m-20 -146.36 150.44 35.69 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.639 1.576 . . . . 0.0 111.422 -175.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.9 ttp -61.13 -35.73 77.86 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.331 1.052 . . . . 0.0 112.743 -173.169 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -59.93 -21.86 56.5 Favored Glycine 0 CA--C 1.537 1.428 0 C-N-CA 125.625 1.583 . . . . 0.0 114.433 171.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 19.2 m -98.27 -34.08 10.84 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.208 1.403 . . . . 0.0 111.81 174.134 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 90.0 mt -55.36 -50.38 65.75 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 CA-C-N 119.538 1.063 . . . . 0.0 110.655 172.467 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -60.16 -37.04 78.94 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 113.218 0.822 . . . . 0.0 113.218 176.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.435 ' HE2' ' HA ' ' A' ' 88' ' ' LYS . 0.5 OUTLIER -62.09 -36.32 81.35 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.319 1.048 . . . . 0.0 113.008 -177.761 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 6.2 ptp180 -80.53 -32.35 36.8 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 173.83 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 65.0 mt -62.01 -32.1 72.55 Favored 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 114.447 1.277 . . . . 0.0 114.447 169.225 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -64.38 -12.23 40.64 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 114.745 1.387 . . . . 0.0 114.745 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 6.9 p30 -134.89 176.27 8.81 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.781 1.632 . . . . 0.0 112.851 177.033 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -78.03 44.94 0.5 Allowed 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 125.286 1.435 . . . . 0.0 113.126 -177.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 50.9 t80 -65.18 -30.69 71.62 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 121.278 -0.889 . . . . 0.0 112.977 -174.7 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -141.01 172.16 13.06 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 127.249 2.22 . . . . 0.0 111.479 176.796 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 15.8 t-105 -95.45 -22.25 17.81 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.42 1.088 . . . . 0.0 113.23 177.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 24.2 t -145.07 153.22 41.21 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.581 1.152 . . . . 0.0 113.448 -169.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -65.18 -21.24 66.74 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 116.285 1.957 . . . . 0.0 116.285 -175.442 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 15.2 m -58.84 -32.7 69.65 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 119.485 1.039 . . . . 0.0 113.24 -175.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -63.85 -44.07 94.24 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.408 -0.808 . . . . 0.0 112.17 173.601 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 50.5 t -64.21 -38.07 89.74 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.036 0.935 . . . . 0.0 112.117 175.143 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 78.3 mtp -62.43 -41.12 98.47 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.272 -0.892 . . . . 0.0 112.393 173.581 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -61.39 -39.65 91.46 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 112.27 0.471 . . . . 0.0 112.27 170.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -65.81 -39.85 91.3 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 118.963 0.801 . . . . 0.0 112.713 177.343 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 -60.05 -45.37 93.08 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 121.51 -0.744 . . . . 0.0 112.369 170.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 18.1 t30 -57.72 -46.81 83.9 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 121.875 -0.516 . . . . 0.0 112.023 174.628 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 93.1 m -65.36 -34.45 78.36 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.888 0.875 . . . . 0.0 112.764 177.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 50.9 ttp -61.21 -55.21 34.77 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 119.608 1.095 . . . . 0.0 111.844 174.495 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 24.0 m-85 -65.18 -38.36 90.24 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 122.004 -0.435 . . . . 0.0 111.977 179.536 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 88.6 m -64.69 -47.78 77.13 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 123.601 0.761 . . . . 0.0 112.397 179.009 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.1 p30 -64.67 -31.28 72.43 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 119.774 1.17 . . . . 0.0 112.568 -179.726 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 56.1 m -60.95 -44.24 97.57 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.542 0.737 . . . . 0.0 112.547 169.522 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -67.84 -31.32 71.07 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 113.736 1.013 . . . . 0.0 113.736 177.291 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 80.9 mt -72.17 -56.65 9.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 123.343 0.657 . . . . 0.0 110.617 177.042 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 41.9 t80 -67.31 -30.54 70.41 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 114.152 1.168 . . . . 0.0 114.152 -173.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -113.47 156.35 23.69 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.03 0.932 . . . . 0.0 112.361 -171.577 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 3.0 mppt? -67.43 148.68 98.64 Favored Pre-proline 0 N--CA 1.471 0.576 0 C-N-CA 124.684 1.194 . . . . 0.0 110.666 176.213 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -65.46 -7.23 15.42 Favored 'Trans proline' 0 CA--C 1.544 0.976 0 C-N-CA 123.749 2.966 . . . . 0.0 114.674 -176.243 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 43.5 p -108.55 -4.74 16.94 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 127.123 2.169 . . . . 0.0 113.268 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -67.79 146.55 53.61 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 118.883 0.765 . . . . 0.0 110.821 174.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -53.27 -47.76 68.85 Favored 'General case' 0 N--CA 1.469 0.519 0 O-C-N 121.59 -0.694 . . . . 0.0 112.258 179.097 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.2 tp -57.39 -30.03 34.79 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 C-N-CA 124.298 1.039 . . . . 0.0 113.786 -178.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 42.5 t -71.99 -48.52 49.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 O-C-N 121.535 -0.728 . . . . 0.0 110.442 174.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 79.8 mt -61.13 -36.96 81.16 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 118.978 0.808 . . . . 0.0 111.857 177.508 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 13.5 mtt -58.55 -52.73 64.43 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.919 1.288 . . . . 0.0 111.965 169.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.61 -38.75 88.76 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.464 0.706 . . . . 0.0 112.704 177.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -59.48 -51.11 71.27 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 119.229 0.922 . . . . 0.0 111.687 173.26 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.57 -43.28 99.19 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.752 0.821 . . . . 0.0 112.844 179.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 80.0 mt -62.95 -43.75 97.94 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.718 0.807 . . . . 0.0 111.748 173.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -60.9 -39.13 88.14 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 121.018 -1.051 . . . . 0.0 112.699 -179.111 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 7.2 mmpt? -61.69 -37.99 86.15 Favored 'General case' 0 N--CA 1.476 0.871 0 O-C-N 121.191 -0.943 . . . . 0.0 111.304 178.027 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 77.7 mt -74.41 -39.95 48.79 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 C-N-CA 123.685 0.794 . . . . 0.0 111.312 176.611 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -51.53 -51.36 55.95 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 118.943 0.792 . . . . 0.0 110.411 172.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 93.1 mt -63.67 -40.79 97.71 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 118.532 -0.747 . . . . 0.0 112.819 177.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -67.18 -32.69 73.95 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 120.327 1.421 . . . . 0.0 112.426 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 65.3 mmtt -71.23 -53.4 14.49 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.952 0.901 . . . . 0.0 111.753 175.49 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.4 m -65.48 -25.15 36.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 CA-C-N 120.326 1.421 . . . . 0.0 112.222 179.662 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -64.42 -34.9 79.26 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 171.588 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -84.3 -13.28 52.9 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.475 1.11 . . . . 0.0 113.087 173.532 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 48.0 ttp -61.62 141.97 94.6 Favored Pre-proline 0 CA--C 1.543 0.704 0 CA-C-N 119.262 0.937 . . . . 0.0 110.564 172.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -60.53 152.2 69.87 Favored 'Trans proline' 0 CA--C 1.538 0.705 0 C-N-CA 122.716 2.277 . . . . 0.0 111.205 172.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -88.8 -21.17 23.9 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 121.777 -0.577 . . . . 0.0 112.388 172.23 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -84.75 167.16 16.37 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.835 1.254 . . . . 0.0 112.396 172.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -137.13 146.76 45.42 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.76 1.224 . . . . 0.0 111.175 -176.848 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 8.2 p -144.16 145.18 21.99 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 C-N-CA 124.899 1.279 . . . . 0.0 110.437 176.344 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -69.38 137.92 53.23 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.429 0.692 . . . . 0.0 111.246 173.12 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . 0.47 HD11 ' HB2' ' A' ' 40' ' ' GLN . 83.4 mt -78.46 173.65 12.14 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 113.886 1.069 . . . . 0.0 113.886 -175.666 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 98.3 mt -119.68 153.99 54.61 Favored Pre-proline 0 CA--C 1.547 0.831 0 C-N-CA 126.479 1.912 . . . . 0.0 110.615 177.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -71.69 155.39 58.79 Favored 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 122.975 2.45 . . . . 0.0 112.661 -176.349 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -71.8 158.6 52.71 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 123.43 2.753 . . . . 0.0 112.322 177.361 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -70.96 152.05 95.0 Favored Pre-proline 0 CA--C 1.553 1.072 0 C-N-CA 123.978 0.911 . . . . 0.0 112.709 176.45 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -75.68 -176.71 3.13 Favored 'Trans proline' 0 CA--C 1.546 1.103 0 C-N-CA 123.861 3.041 . . . . 0.0 112.018 171.09 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 63.6 tttm -47.99 -44.26 30.51 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 126.114 1.766 . . . . 0.0 114.547 -178.143 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . 167.61 31.13 0.02 OUTLIER Glycine 0 CA--C 1.538 1.472 0 N-CA-C 115.338 0.895 . . . . 0.0 115.338 -179.335 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 4.4 mptp? . . . . . 0 C--O 1.252 1.205 0 C-N-CA 125.237 1.415 . . . . 0.0 112.149 -178.994 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.456 0 N-CA-C 111.763 -0.535 . . . . 0.0 111.763 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 42.2 p -67.83 -19.54 65.07 Favored 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 114.735 1.383 . . . . 0.0 114.735 179.495 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 78.8 p -154.17 169.82 22.68 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 126.0 1.72 . . . . 0.0 111.863 178.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -167.48 26.98 0.15 Allowed Glycine 0 CA--C 1.536 1.402 0 C-N-CA 123.996 0.808 . . . . 0.0 114.783 -178.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 12.5 t -60.97 152.92 26.46 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.458 1.103 . . . . 0.0 112.976 -177.025 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.1 m -161.0 153.44 20.46 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.826 1.25 . . . . 0.0 112.716 174.174 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -177.31 -31.24 0.05 OUTLIER Glycine 0 CA--C 1.538 1.485 0 C-N-CA 125.973 1.749 . . . . 0.0 112.957 174.631 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.57 166.98 22.74 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 126.182 1.793 . . . . 0.0 112.352 168.023 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 19.6 m -136.28 -6.71 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.294 0 C-N-CA 124.943 1.297 . . . . 0.0 113.811 -177.204 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.3 t -149.09 144.86 26.94 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 125.252 1.421 . . . . 0.0 110.877 179.509 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -90.71 152.47 44.9 Favored Pre-proline 0 CA--C 1.55 0.964 0 N-CA-C 113.234 0.828 . . . . 0.0 113.234 -171.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -83.19 -29.46 1.18 Allowed 'Trans proline' 0 CA--C 1.542 0.917 0 C-N-CA 123.607 2.871 . . . . 0.0 113.303 173.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.5 t -158.24 -13.67 0.07 Allowed 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 115.484 1.661 . . . . 0.0 115.484 -172.519 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.3 mtpm? -58.9 152.99 46.27 Favored Pre-proline 0 N--CA 1.482 1.159 0 C-N-CA 124.389 1.076 . . . . 0.0 112.668 -178.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -67.82 144.14 63.95 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 121.99 1.793 . . . . 0.0 111.547 169.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 162.17 150.39 5.96 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 124.981 1.277 . . . . 0.0 113.251 174.811 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 8.0 ptm180 -164.63 165.44 21.01 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.761 2.025 . . . . 0.0 110.87 175.232 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 30.7 tttp -61.83 132.23 52.4 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.143 1.377 . . . . 0.0 110.938 173.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 48.9 p -139.38 165.04 28.26 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.967 1.707 . . . . 0.0 110.141 178.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 24.8 t30 -52.6 -32.49 41.69 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 175.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 63.4 mm-40 -60.68 -59.92 4.62 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.535 1.134 . . . . 0.0 111.616 169.663 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 94.5 mt -67.12 -32.21 73.2 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.215 1.006 . . . . 0.0 112.911 -177.297 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 -58.8 -51.34 70.42 Favored 'General case' 0 C--O 1.225 -0.225 0 C-N-CA 124.362 1.065 . . . . 0.0 110.223 170.031 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 49.8 t80 -58.07 -39.34 78.27 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 118.909 0.777 . . . . 0.0 112.347 178.366 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 89.0 mmm -57.08 -55.04 39.89 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 121.662 -0.649 . . . . 0.0 112.266 172.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -82.32 -4.44 57.23 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 115.108 1.521 . . . . 0.0 115.108 -175.2 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -117.21 -19.64 9.56 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.247 1.419 . . . . 0.0 112.778 -174.041 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.6 t -133.47 -52.72 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 CA-C-O 118.757 -0.64 . . . . 0.0 112.266 179.202 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.8 t -69.08 -67.71 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 CA-C-N 118.794 0.724 . . . . 0.0 110.848 -172.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 99.3 t -57.07 -46.11 84.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.928 1.291 . . . . 0.0 109.743 171.587 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 40.3 tptt -58.77 -22.22 57.56 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 114.301 1.222 . . . . 0.0 114.301 -176.233 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 34.2 m -99.43 -41.09 7.56 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.196 0.998 . . . . 0.0 113.151 172.717 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 62.3 mt -60.05 -28.95 68.2 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.257 0.935 . . . . 0.0 112.682 173.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 36.0 t-105 -79.04 -33.85 44.38 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 127.123 2.169 . . . . 0.0 113.843 178.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 61.2 pttt -86.56 -5.18 59.21 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 175.682 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 57.4 t-80 -54.28 152.53 6.19 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.507 1.923 . . . . 0.0 113.473 174.526 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 22.7 tp60 -56.83 -21.13 26.66 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 126.029 1.732 . . . . 0.0 114.676 176.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -124.35 19.66 8.91 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.409 1.484 . . . . 0.0 113.916 -175.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -74.0 -24.69 59.62 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 114.106 1.151 . . . . 0.0 114.106 175.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.423 ' CD2' ' HD3' ' A' ' 58' ' ' PRO . 49.4 p-90 -57.17 -36.4 46.1 Favored Pre-proline 0 CA--C 1.548 0.876 0 N-CA-C 117.206 2.299 . . . . 0.0 117.206 -173.508 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.423 ' HD3' ' CD2' ' A' ' 57' ' ' TRP . 85.0 Cg_endo -74.82 0.02 9.33 Favored 'Trans proline' 0 CA--C 1.545 1.039 0 CA-C-N 123.013 2.112 . . . . 0.0 113.934 171.514 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -117.98 6.19 12.15 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.96 1.704 . . . . 0.0 113.321 -178.83 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 23.3 m-30 -72.31 -14.22 61.69 Favored 'General case' 0 CA--C 1.545 0.758 0 O-C-N 120.28 -1.512 . . . . 0.0 114.059 176.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 89.1 mt-30 -151.57 145.99 18.41 Favored Pre-proline 0 CA--C 1.544 0.724 0 C-N-CA 125.233 1.413 . . . . 0.0 110.536 -177.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -65.36 151.65 84.49 Favored 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 123.383 2.722 . . . . 0.0 112.765 -178.218 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 41.6 t -64.17 135.79 27.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 124.737 1.215 . . . . 0.0 111.071 -178.703 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 52.8 m-20 -112.71 92.41 4.01 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.925 1.29 . . . . 0.0 110.163 175.33 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.57 -27.42 38.79 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.286 1.034 . . . . 0.0 113.682 175.651 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 81.8 mt -65.71 -49.6 76.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 C-N-CA 125.392 1.477 . . . . 0.0 111.104 173.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -65.99 -38.92 89.73 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.48 1.112 . . . . 0.0 112.589 179.21 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 90.3 mt -87.35 -3.6 59.03 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.893 1.677 . . . . 0.0 113.518 -177.268 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 51.14 56.55 7.81 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 125.584 1.554 . . . . 0.0 113.01 -176.424 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 58.0 mt -113.87 78.36 4.05 Favored Pre-proline 0 CA--C 1.543 0.7 0 C-N-CA 126.157 1.783 . . . . 0.0 110.651 -179.811 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -66.28 -17.2 53.87 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 123.323 2.682 . . . . 0.0 113.101 -177.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 -100.35 7.13 44.52 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.884 1.674 . . . . 0.0 113.184 175.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 85.8 t80 -52.28 -57.62 9.16 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 120.015 1.28 . . . . 0.0 112.117 -177.474 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -74.81 -11.65 60.2 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.888 1.275 . . . . 0.0 114.33 179.606 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 10.1 mptt -72.7 -32.54 65.83 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 121.263 -0.898 . . . . 0.0 111.296 176.349 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.2 mp -99.07 -48.71 11.86 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 125.439 1.496 . . . . 0.0 111.088 175.003 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 28.0 mm -67.18 110.95 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 C-N-CA 123.66 0.784 . . . . 0.0 110.082 178.48 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -68.25 -44.87 74.65 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.972 0.909 . . . . 0.0 112.113 -178.441 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 71.5 m-80 -150.22 117.83 3.56 Favored Pre-proline 0 CA--C 1.546 0.789 0 C-N-CA 126.5 1.92 . . . . 0.0 109.075 173.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -74.24 146.95 36.76 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 123.116 2.544 . . . . 0.0 111.478 177.346 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.0 tpt -156.25 146.68 21.63 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.984 1.314 . . . . 0.0 110.52 176.678 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -152.11 153.22 33.48 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.258 1.423 . . . . 0.0 112.099 -171.881 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 2.7 ttp -64.74 -38.3 90.53 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.197 0.599 . . . . 0.0 112.456 -175.426 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -59.26 -34.09 78.49 Favored Glycine 0 CA--C 1.53 1.02 0 C-N-CA 124.63 1.11 . . . . 0.0 113.056 173.552 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 24.2 m -76.23 -47.17 24.91 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 117.868 0.834 . . . . 0.0 111.278 172.056 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 86.7 mt -52.66 -53.14 21.98 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.197 0 C-N-CA 124.568 1.147 . . . . 0.0 111.247 178.128 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.37 -30.42 71.24 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -178.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.402 ' HA ' ' HE3' ' A' ' 88' ' ' LYS . 0.1 OUTLIER -65.02 -40.0 94.21 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 117.712 -1.137 . . . . 0.0 113.413 171.012 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . 0.275 6.4 ptp180 -72.68 -30.03 63.9 Favored 'General case' 0 N--CA 1.484 1.24 0 CA-C-N 120.544 1.52 . . . . 0.0 114.135 172.712 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 86.9 mt -66.87 -36.14 81.63 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 119.763 1.165 . . . . 0.0 112.949 167.679 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 88.5 mt-10 -78.02 9.33 3.74 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.685 1.594 . . . . 0.0 113.704 178.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 38.8 m-80 -138.42 166.79 23.35 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 127.023 2.129 . . . . 0.0 111.788 179.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 13.9 p-10 -79.96 108.41 13.51 Favored 'General case' 0 CA--C 1.544 0.719 0 O-C-N 121.4 -0.813 . . . . 0.0 109.773 168.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 49.4 t80 -140.36 -46.26 0.42 Allowed 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -178.277 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -133.15 177.0 8.01 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.836 2.054 . . . . 0.0 111.625 178.427 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.3 t-105 -112.99 -21.86 10.89 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.898 1.279 . . . . 0.0 112.787 -177.598 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 28.2 t -138.07 142.95 40.27 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.046 -1.034 . . . . 0.0 112.337 -172.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -68.89 -13.55 62.49 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 115.316 1.599 . . . . 0.0 115.316 -173.647 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 23.2 m -55.45 -29.97 59.66 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 119.412 1.006 . . . . 0.0 112.775 173.873 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 40.0 mm-40 -72.5 -41.37 66.01 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.202 -0.936 . . . . 0.0 112.258 174.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 42.2 t -62.23 -38.24 88.45 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.025 0.93 . . . . 0.0 111.998 172.209 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 82.9 mtp -65.6 -40.67 92.92 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 124.124 0.969 . . . . 0.0 112.171 174.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 62.6 mt-30 -59.96 -44.5 94.39 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 122.895 0.478 . . . . 0.0 111.606 171.072 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -64.44 -38.56 91.46 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 118.797 0.726 . . . . 0.0 112.663 178.173 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -61.21 -45.04 96.22 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 121.265 -0.897 . . . . 0.0 112.357 170.002 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 33.2 t30 -59.22 -43.05 92.32 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 121.506 -0.747 . . . . 0.0 111.963 174.722 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 85.0 m -62.69 -39.51 94.21 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.192 0.997 . . . . 0.0 112.414 174.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 12.9 ttm -58.2 -60.88 3.07 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 119.485 1.039 . . . . 0.0 111.272 174.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -61.01 -41.0 95.68 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.035 0.534 . . . . 0.0 111.966 -177.506 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 77.3 m -64.46 -47.93 77.18 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.294 0.638 . . . . 0.0 112.083 178.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -64.7 -31.93 73.38 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 119.493 1.042 . . . . 0.0 112.643 -178.687 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 40.8 m -59.91 -43.7 94.73 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.906 0.883 . . . . 0.0 112.516 169.647 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -68.9 -29.17 67.39 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 179.106 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 86.1 mt -72.25 -57.47 7.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 123.256 0.622 . . . . 0.0 110.906 178.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -71.62 -35.03 70.32 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -171.221 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 59.5 m-80 -95.99 162.65 13.47 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.456 1.103 . . . . 0.0 111.733 -178.651 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -73.45 152.07 89.74 Favored Pre-proline 0 N--CA 1.474 0.764 0 O-C-N 121.261 -0.9 . . . . 0.0 110.426 170.545 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -65.87 -1.67 5.45 Favored 'Trans proline' 0 CA--C 1.544 1.019 0 C-N-CA 123.569 2.846 . . . . 0.0 114.922 -178.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 65.0 p -118.06 -0.62 11.58 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.703 2.001 . . . . 0.0 113.063 -179.609 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 58.5 m-20 -68.48 144.98 54.45 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 118.719 0.69 . . . . 0.0 110.709 170.791 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -55.87 -45.77 78.43 Favored 'General case' 0 N--CA 1.471 0.625 0 O-C-N 121.682 -0.636 . . . . 0.0 112.504 -175.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.5 tp -55.32 -30.4 25.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 124.918 1.287 . . . . 0.0 114.058 177.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 48.3 t -73.31 -46.56 49.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 O-C-N 121.427 -0.796 . . . . 0.0 110.582 174.06 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 72.4 mt -61.39 -37.15 82.39 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 119.103 0.865 . . . . 0.0 111.523 177.008 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 8.9 mtt -59.63 -51.21 70.77 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.963 1.305 . . . . 0.0 112.04 169.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -60.97 -38.75 87.03 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.387 0.675 . . . . 0.0 112.701 176.425 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 90.0 mt-30 -62.5 -45.51 92.69 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 119.329 0.968 . . . . 0.0 112.094 173.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.25 -44.28 96.91 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.543 0.737 . . . . 0.0 112.473 177.045 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 85.2 mt -65.4 -45.67 83.06 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.913 0.885 . . . . 0.0 112.042 174.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.94 -37.68 88.02 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.138 -0.976 . . . . 0.0 113.075 -176.502 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 55.7 mtmt -58.85 -46.16 88.37 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 121.744 -0.598 . . . . 0.0 111.727 172.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 89.6 mt -67.6 -43.9 86.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 123.429 0.692 . . . . 0.0 110.702 178.142 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 34.0 t80 -50.57 -51.09 51.42 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.851 0.861 . . . . 0.0 111.095 174.608 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 99.6 mt -64.0 -40.26 95.96 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 178.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 82.8 mm-40 -62.64 -37.25 85.6 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 119.42 1.009 . . . . 0.0 113.004 173.576 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 33.2 mmtm -70.99 -52.66 18.35 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.111 1.364 . . . . 0.0 111.47 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 5.5 m -67.44 -25.16 32.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 CA-C-N 119.603 1.092 . . . . 0.0 112.366 178.395 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -62.22 -30.4 71.06 Favored 'General case' 0 CA--C 1.54 0.582 0 O-C-N 121.573 -0.705 . . . . 0.0 112.703 172.043 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -88.77 -9.16 52.86 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.478 1.111 . . . . 0.0 112.844 174.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 40.1 ttp -67.26 145.2 98.55 Favored Pre-proline 0 CA--C 1.545 0.786 0 C-N-CA 124.074 0.95 . . . . 0.0 110.347 170.033 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -60.13 156.75 38.0 Favored 'Trans proline' 0 CA--C 1.539 0.737 0 C-N-CA 123.23 2.62 . . . . 0.0 111.63 170.159 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.25 -26.74 19.91 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.503 0.721 . . . . 0.0 112.893 172.152 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -85.7 170.38 12.56 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 126.254 1.822 . . . . 0.0 111.333 171.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -132.57 171.72 13.45 Favored 'General case' 0 CA--C 1.533 0.304 0 O-C-N 120.683 -1.261 . . . . 0.0 112.294 173.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 15.0 p -152.2 142.74 15.5 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 C-N-CA 124.033 0.933 . . . . 0.0 110.656 174.05 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -64.88 136.88 57.36 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.701 1.6 . . . . 0.0 111.686 173.615 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 59.8 mt -99.65 161.36 13.66 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.069 0.947 . . . . 0.0 113.327 -174.054 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 99.3 mt -63.0 156.24 68.54 Favored Pre-proline 0 CA--C 1.55 0.981 0 C-N-CA 125.092 1.357 . . . . 0.0 112.133 169.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -71.62 158.78 52.79 Favored 'Trans proline' 0 CA--C 1.546 1.124 0 C-N-CA 123.082 2.521 . . . . 0.0 112.153 176.196 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -71.18 159.68 51.33 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 123.297 2.664 . . . . 0.0 112.619 178.054 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -66.43 153.79 92.17 Favored Pre-proline 0 CA--C 1.552 1.03 0 C-N-CA 124.205 1.002 . . . . 0.0 112.473 174.467 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.44 114.03 3.33 Favored 'Trans proline' 0 CA--C 1.539 0.75 0 C-N-CA 123.413 2.742 . . . . 0.0 110.775 173.27 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -142.79 174.11 10.95 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 126.197 1.799 . . . . 0.0 111.952 -170.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . -157.06 -168.94 20.36 Favored Glycine 0 CA--C 1.536 1.35 0 C-N-CA 125.522 1.534 . . . . 0.0 113.375 -178.658 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 36.7 mtmm . . . . . 0 C--O 1.254 1.332 0 C-N-CA 125.89 1.676 . . . . 0.0 113.501 179.955 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.485 0 N-CA-C 111.808 -0.517 . . . . 0.0 111.808 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 59.8 p -75.88 -15.14 60.25 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 115.24 1.57 . . . . 0.0 115.24 -177.253 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.4 t -63.68 144.35 57.09 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.247 1.019 . . . . 0.0 112.506 177.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 179.97 32.76 0.06 OUTLIER Glycine 0 CA--C 1.536 1.363 0 N-CA-C 114.983 0.753 . . . . 0.0 114.983 -176.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 22.4 p -63.66 -46.88 83.59 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.305 1.042 . . . . 0.0 113.07 179.232 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.9 p -64.29 148.91 49.18 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 125.481 1.513 . . . . 0.0 113.759 -178.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -102.76 -174.56 26.86 Favored Glycine 0 CA--C 1.535 1.334 0 C-N-CA 124.897 1.237 . . . . 0.0 114.199 179.555 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -132.99 172.63 12.37 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 126.33 1.852 . . . . 0.0 112.902 -170.518 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 20.5 m -131.74 7.79 1.75 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 C-N-CA 124.66 1.184 . . . . 0.0 113.461 -176.55 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 11.7 t -148.11 166.71 27.01 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 127.526 2.33 . . . . 0.0 110.085 175.168 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -142.46 149.37 50.77 Favored Pre-proline 0 CA--C 1.545 0.76 0 C-N-CA 124.423 1.089 . . . . 0.0 113.417 -172.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -74.01 -32.19 7.27 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.34 2.694 . . . . 0.0 113.567 177.447 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 7.7 t -156.18 -5.09 0.12 Allowed 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 116.566 2.061 . . . . 0.0 116.566 -175.536 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 34.9 ttpt -63.98 131.35 94.93 Favored Pre-proline 0 N--CA 1.481 1.098 0 CA-C-N 120.72 1.6 . . . . 0.0 110.761 179.545 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -71.93 156.34 56.51 Favored 'Trans proline' 0 CA--C 1.54 0.778 0 C-N-CA 122.658 2.239 . . . . 0.0 112.631 -178.657 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -178.29 160.65 26.9 Favored Glycine 0 CA--C 1.532 1.119 0 C-N-CA 124.255 0.931 . . . . 0.0 113.59 176.317 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 32.3 ptt180 -163.23 159.55 22.94 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 126.739 2.016 . . . . 0.0 110.721 172.717 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.2 tttm -71.11 137.25 48.72 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.192 0.997 . . . . 0.0 111.244 174.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 76.0 p -144.44 167.24 22.96 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 125.817 1.647 . . . . 0.0 110.922 -175.319 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 25.5 p-10 -51.13 -36.01 38.53 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 113.51 0.929 . . . . 0.0 113.51 169.359 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 10.5 mm100 -64.67 -54.09 37.24 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.269 1.028 . . . . 0.0 110.762 178.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.1 mt -66.97 -34.36 77.59 Favored 'General case' 0 CA--C 1.537 0.442 0 N-CA-C 112.524 0.564 . . . . 0.0 112.524 178.647 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.1 tp60 -57.55 -53.86 53.42 Favored 'General case' 0 C--O 1.222 -0.354 0 C-N-CA 123.036 0.534 . . . . 0.0 110.498 169.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 60.5 t80 -56.58 -41.89 77.72 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.348 0.976 . . . . 0.0 112.626 179.701 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 94.8 mmm -57.62 -51.24 70.32 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.69 -0.631 . . . . 0.0 112.184 172.421 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -85.32 -5.29 59.32 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 -173.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 60.0 t30 -124.72 -14.48 6.75 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.764 1.626 . . . . 0.0 113.294 -171.549 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 21.4 t -133.15 -52.8 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 C-N-CA 123.192 0.597 . . . . 0.0 111.058 177.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.4 t -68.95 -65.63 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 123.34 0.656 . . . . 0.0 110.696 -174.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 89.9 t -57.8 -46.7 87.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 C-N-CA 124.093 0.957 . . . . 0.0 110.322 173.24 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 69.7 tttt -58.62 -39.19 79.8 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.357 0.663 . . . . 0.0 112.552 -174.734 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 40.9 m -78.03 -43.56 29.05 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 118.461 0.573 . . . . 0.0 112.212 175.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 62.8 mt -61.6 -33.32 73.69 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 118.821 0.737 . . . . 0.0 112.411 177.67 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 30.9 t-105 -71.27 -31.44 67.51 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.701 1.6 . . . . 0.0 113.346 176.12 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.7 mtmp? -80.49 -7.42 59.17 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 175.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 53.0 t-80 -63.56 152.94 37.28 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.701 1.2 . . . . 0.0 112.981 -179.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 99.9 mm-40 -61.54 -19.63 62.35 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.072 1.349 . . . . 0.0 114.394 177.299 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -117.85 13.06 14.0 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.34 1.456 . . . . 0.0 113.706 -176.289 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.14 -25.93 64.63 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.815 1.246 . . . . 0.0 114.12 177.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 69.2 p-90 -56.5 -35.49 35.77 Favored Pre-proline 0 CA--C 1.547 0.865 0 N-CA-C 118.113 2.635 . . . . 0.0 118.113 -169.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -78.71 -6.94 15.54 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 CA-C-N 123.33 2.225 . . . . 0.0 112.985 176.565 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 57.7 m-85 -103.09 -7.67 21.15 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.307 1.443 . . . . 0.0 112.382 179.311 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 20.3 m-30 -62.42 -17.61 59.67 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 114.559 1.318 . . . . 0.0 114.559 179.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 89.5 mt-30 -139.7 150.88 64.63 Favored Pre-proline 0 CA--C 1.544 0.727 0 C-N-CA 124.947 1.299 . . . . 0.0 111.127 -179.088 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -70.67 143.89 47.66 Favored 'Trans proline' 0 CA--C 1.537 0.645 0 C-N-CA 123.151 2.567 . . . . 0.0 112.672 178.397 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 63.8 t -64.64 145.32 13.99 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 C-N-CA 124.309 1.043 . . . . 0.0 110.56 169.152 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -130.04 109.51 10.91 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.315 1.446 . . . . 0.0 110.116 173.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.32 -29.12 60.86 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.478 1.111 . . . . 0.0 113.645 179.082 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 84.4 mt -66.33 -48.87 79.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 125.227 1.411 . . . . 0.0 110.882 174.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 45.9 mmtm -68.46 -39.16 81.54 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.767 1.227 . . . . 0.0 113.126 -178.707 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.5 mp -87.89 -3.97 58.88 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.611 1.164 . . . . 0.0 112.774 179.482 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 52.29 58.15 5.7 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 126.083 1.753 . . . . 0.0 113.243 -177.007 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 44.7 mt -115.63 82.67 10.33 Favored Pre-proline 0 CA--C 1.544 0.749 0 C-N-CA 126.135 1.774 . . . . 0.0 110.512 -177.157 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -67.04 -8.31 21.37 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 123.911 3.074 . . . . 0.0 114.108 -173.419 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 24.9 p-10 -116.02 2.58 13.48 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 127.566 2.346 . . . . 0.0 113.737 179.24 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 58.7 t80 -49.65 -50.68 42.28 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 119.933 1.242 . . . . 0.0 113.199 -175.167 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 99.7 m-70 -76.39 -18.47 58.85 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.878 1.271 . . . . 0.0 114.115 -178.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 10.7 mmpt? -69.7 -45.13 68.94 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.071 0.948 . . . . 0.0 110.563 174.654 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.6 mp -72.37 -51.71 27.83 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 C-N-CA 123.44 0.696 . . . . 0.0 109.929 171.241 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 37.7 mm -99.54 103.66 15.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 CA-C-O 122.586 1.184 . . . . 0.0 112.156 -171.774 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 40.3 mmtm -65.47 -32.91 74.78 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.318 1.447 . . . . 0.0 113.146 175.689 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -137.01 76.77 44.87 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 125.217 1.407 . . . . 0.0 111.561 -170.03 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -70.78 128.51 15.19 Favored 'Trans proline' 0 CA--C 1.537 0.658 0 C-N-CA 124.102 3.202 . . . . 0.0 111.052 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 17.7 tpp -155.41 140.99 17.9 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.078 1.751 . . . . 0.0 109.455 -173.461 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -141.26 148.34 39.68 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 127.561 2.344 . . . . 0.0 109.161 172.752 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 13.0 ttp -49.45 -33.11 13.34 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 115.341 1.608 . . . . 0.0 115.341 -170.077 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -57.49 -20.07 36.49 Favored Glycine 0 CA--C 1.538 1.502 0 C-N-CA 125.382 1.468 . . . . 0.0 115.271 173.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 28.7 m -85.58 -40.13 16.6 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.51 1.124 . . . . 0.0 111.694 172.743 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 34.5 mt -56.39 -49.5 76.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 C-N-CA 124.431 1.092 . . . . 0.0 110.945 -177.472 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -58.32 -33.74 69.82 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 178.352 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -70.73 -45.6 64.56 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.415 1.086 . . . . 0.0 112.214 -178.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 3.8 ptp180 -69.47 -26.87 64.79 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 113.76 1.022 . . . . 0.0 113.76 172.121 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 45.7 mt -68.97 -42.47 76.56 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 119.339 0.972 . . . . 0.0 113.344 168.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -71.73 -36.37 70.45 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.666 0.786 . . . . 0.0 112.83 178.231 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 -74.17 167.62 21.21 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.004 0.922 . . . . 0.0 111.43 169.251 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 61.3 t-20 -89.6 96.51 10.73 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 121.064 -1.022 . . . . 0.0 109.139 168.074 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 57.8 t80 -123.6 -25.61 4.32 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.317 1.047 . . . . 0.0 113.74 -178.313 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -145.61 179.97 7.07 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.737 1.215 . . . . 0.0 113.565 175.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 2.3 t-105 -113.0 -27.5 8.04 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 126.057 1.743 . . . . 0.0 112.361 -177.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 21.0 p -135.9 137.0 40.95 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 125.164 1.386 . . . . 0.0 112.688 -168.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -58.27 -19.88 37.86 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 115.588 1.699 . . . . 0.0 115.588 -178.308 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 11.1 m -56.2 -34.43 66.26 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 119.466 1.03 . . . . 0.0 113.173 176.305 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -67.0 -44.03 81.39 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.508 0.671 . . . . 0.0 111.437 173.447 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 1.9 m -66.53 -33.39 75.57 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 126.046 1.738 . . . . 0.0 112.279 178.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 76.0 mtp -68.25 -43.58 77.53 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 125.138 1.375 . . . . 0.0 112.376 172.209 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -63.49 -30.8 71.87 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 118.02 0.373 . . . . 0.0 111.704 176.206 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 93.2 m-20 -68.36 -44.04 76.11 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.727 0.811 . . . . 0.0 112.116 173.212 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -60.54 -45.1 95.11 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 118.936 0.789 . . . . 0.0 112.528 171.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 16.8 t30 -56.33 -45.98 80.09 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.241 0.617 . . . . 0.0 111.402 172.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 71.6 m -63.33 -33.36 75.37 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.462 1.105 . . . . 0.0 112.581 176.428 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 12.1 tmm? -68.99 -55.44 10.87 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 124.59 1.156 . . . . 0.0 111.906 -177.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 29.6 m-85 -62.58 -39.13 92.74 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.392 0.677 . . . . 0.0 112.423 173.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 97.0 m -66.08 -47.19 75.07 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 121.427 -0.796 . . . . 0.0 112.287 -179.662 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -62.98 -30.71 71.8 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 119.891 1.223 . . . . 0.0 112.479 179.473 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 92.1 m -63.45 -43.5 97.21 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.059 0.944 . . . . 0.0 112.54 170.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 15.2 m-30 -65.18 -35.76 82.1 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 175.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 77.6 mt -70.27 -56.83 9.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 C-N-CA 123.214 0.606 . . . . 0.0 110.923 -178.504 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.3 t80 -69.28 -32.5 71.71 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 114.087 1.143 . . . . 0.0 114.087 -172.198 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 60.2 m-80 -101.39 164.76 11.61 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.232 1.013 . . . . 0.0 112.546 -174.235 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -67.07 140.88 96.13 Favored Pre-proline 0 N--CA 1.472 0.659 0 C-N-CA 123.816 0.846 . . . . 0.0 109.831 173.538 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -67.48 -5.32 13.78 Favored 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 123.669 2.912 . . . . 0.0 114.634 -174.637 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 51.7 p -116.6 -0.29 12.45 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.573 1.949 . . . . 0.0 113.187 179.69 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -67.08 151.7 47.13 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 121.601 -0.687 . . . . 0.0 111.222 172.59 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -50.45 -49.88 53.78 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.499 0.719 . . . . 0.0 112.257 178.472 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 10.5 tp -56.55 -33.18 38.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 -176.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 54.6 t -71.25 -49.3 49.14 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 CA-C-O 118.868 -0.586 . . . . 0.0 110.583 173.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 76.0 mt -61.47 -37.06 82.24 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.499 1.045 . . . . 0.0 112.115 178.659 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 32.0 mtp -61.97 -48.57 79.77 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 126.027 1.731 . . . . 0.0 111.543 172.281 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -61.6 -39.72 92.23 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 173.319 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -63.66 -38.7 92.11 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 119.37 0.986 . . . . 0.0 112.696 175.273 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -66.4 -46.32 76.98 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.629 0.772 . . . . 0.0 111.874 175.311 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 86.6 mt -63.73 -44.43 93.58 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.186 0.994 . . . . 0.0 112.308 175.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -65.18 -37.06 86.17 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.045 -1.035 . . . . 0.0 113.056 -175.655 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 36.1 mtmm -61.0 -41.94 97.48 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 121.341 -0.85 . . . . 0.0 111.719 172.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 81.4 mt -65.62 -45.55 91.93 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 CA-C-O 118.785 -0.626 . . . . 0.0 110.464 174.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 34.1 t80 -50.2 -51.08 47.0 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 119.226 0.921 . . . . 0.0 111.427 174.385 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.4 mt -63.19 -42.24 99.31 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 121.652 -0.655 . . . . 0.0 112.643 179.075 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 93.3 mm-40 -61.56 -36.12 79.73 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 119.341 0.973 . . . . 0.0 113.022 174.086 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 34.5 mmtm -70.98 -53.57 14.38 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.99 1.316 . . . . 0.0 111.409 179.435 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 4.7 m -68.92 -25.54 30.41 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 CA-C-N 119.654 1.115 . . . . 0.0 112.647 179.707 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -59.14 -28.37 66.51 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 173.06 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -93.52 -4.96 50.14 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.943 1.297 . . . . 0.0 112.569 177.603 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 38.8 ttp -67.2 139.16 94.87 Favored Pre-proline 0 CA--C 1.548 0.901 0 C-N-CA 124.028 0.931 . . . . 0.0 110.532 171.577 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -64.91 156.08 64.26 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 123.045 2.497 . . . . 0.0 112.269 175.609 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 62.2 mm-40 -85.37 -16.04 41.2 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.98 0.912 . . . . 0.0 113.172 177.489 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 13.6 mp0 -103.82 146.56 28.46 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.587 1.155 . . . . 0.0 113.097 -175.673 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.43 146.09 27.14 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.305 1.042 . . . . 0.0 111.715 174.056 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 82.4 t -141.46 125.47 16.58 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 C-N-CA 127.338 2.255 . . . . 0.0 108.71 174.071 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -65.61 125.07 24.09 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.84 1.656 . . . . 0.0 111.329 169.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 90.6 mt -78.17 159.98 28.26 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.485 0.714 . . . . 0.0 112.75 177.719 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 93.5 mt -65.69 154.61 88.24 Favored Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 123.892 0.877 . . . . 0.0 111.366 169.181 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -70.65 159.6 52.19 Favored 'Trans proline' 0 CA--C 1.546 1.093 0 C-N-CA 122.973 2.448 . . . . 0.0 112.621 -179.299 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.46 170.7 15.62 Favored 'Trans proline' 0 CA--C 1.542 0.915 0 C-N-CA 123.631 2.887 . . . . 0.0 112.991 177.304 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -137.61 156.93 74.52 Favored Pre-proline 0 CA--C 1.549 0.913 0 C-N-CA 125.768 1.627 . . . . 0.0 111.211 -178.023 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 152' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -69.58 150.12 68.9 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 122.954 2.436 . . . . 0.0 112.733 -179.36 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 2.2 mppt? -95.03 80.06 3.61 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.497 1.519 . . . . 0.0 109.911 177.517 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . -66.38 -18.39 67.45 Favored Glycine 0 CA--C 1.539 1.584 0 C-N-CA 124.649 1.119 . . . . 0.0 115.106 -179.271 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 22.7 ptmt . . . . . 0 C--O 1.251 1.157 0 C-N-CA 126.86 2.064 . . . . 0.0 112.316 175.332 . . . . . . . . 0 0 . 1 stop_ save_