data_2rnb_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 2rnb _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 ' 30' ' ' CYS . . . . . . . . . . . . . 38.7 m . . . . . 0 CA--C 1.553 1.085 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.6 -24.67 30.16 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.429 2.752 . . . . 0.0 112.309 -158.331 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -63.07 -48.3 79.25 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.458 1.903 . . . . 0.0 113.789 169.219 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.48 -34.27 74.1 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 119.483 1.038 . . . . 0.0 111.732 168.707 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 7.0 tmtt? -58.8 -45.49 89.79 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.895 1.278 . . . . 0.0 112.211 173.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 72.6 tttt -55.51 -51.22 67.73 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 126.427 1.891 . . . . 0.0 111.422 172.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.05 -37.97 89.36 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 114.796 -1.093 . . . . 0.0 112.641 178.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 10.2 ttp85 -59.94 -57.25 13.66 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.767 1.227 . . . . 0.0 110.178 174.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 62.0 m-20 -69.18 -29.74 67.79 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.163 0.985 . . . . 0.0 112.67 -175.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.61 -41.41 96.22 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 120.542 -1.349 . . . . 0.0 112.35 168.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.8 t -57.67 -34.53 69.49 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 122.21 1.005 . . . . 0.0 111.76 172.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 64.3 mt -77.11 -33.76 20.75 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 C-N-CA 125.182 1.393 . . . . 0.0 112.257 178.429 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 74.0 mt -64.99 -34.97 74.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 124.052 0.941 . . . . 0.0 111.395 168.365 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -72.92 -36.03 67.17 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 114.54 1.311 . . . . 0.0 114.54 177.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -139.24 -58.64 0.59 Allowed 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 125.078 1.351 . . . . 0.0 113.788 175.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 139.79 161.93 8.91 Favored Glycine 0 CA--C 1.53 1.003 0 C-N-CA 126.278 1.894 . . . . 0.0 109.558 -159.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -73.45 -28.49 61.99 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 120.993 -1.298 . . . . 0.0 112.928 -169.102 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -55.98 -33.67 65.03 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 123.501 0.72 . . . . 0.0 112.444 177.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -85.81 5.82 30.89 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.989 1.316 . . . . 0.0 113.067 178.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 6.1 m -148.22 16.05 1.04 Allowed 'General case' 0 N--CA 1.441 -0.887 0 C-N-CA 125.307 1.443 . . . . 0.0 113.094 -154.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -65.84 -27.83 73.1 Favored Glycine 0 C--O 1.213 -1.173 0 O-C-N 120.19 -1.568 . . . . 0.0 114.658 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 41.6 p-80 -56.54 -25.18 51.19 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 120.666 2.233 . . . . 0.0 113.933 166.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.85 -34.57 30.06 Favored 'General case' 0 C--O 1.231 0.113 0 C-N-CA 123.837 0.855 . . . . 0.0 110.664 172.551 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 33.2 mt -70.43 -40.38 77.49 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.598 0 CA-C-O 118.72 -0.657 . . . . 0.0 109.711 177.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.54 -50.74 49.66 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 125.004 1.322 . . . . 0.0 111.912 -175.647 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.99 -37.47 66.6 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 121.152 -0.968 . . . . 0.0 113.006 173.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 14.5 t60 -72.45 -44.26 62.61 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.508 1.123 . . . . 0.0 113.901 174.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.86 -54.75 25.53 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.769 1.628 . . . . 0.0 110.956 175.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -72.18 -33.85 67.98 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 122.773 0.429 . . . . 0.0 111.692 -174.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 48.8 t -48.51 -60.45 2.68 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-O 118.505 -0.76 . . . . 0.0 112.3 162.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 78.3 mtm -52.66 -45.61 66.83 Favored 'General case' 0 N--CA 1.486 1.331 0 CA-C-N 120.027 1.285 . . . . 0.0 111.388 171.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 2.4 ttt85 -51.91 -39.03 58.42 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 114.378 1.251 . . . . 0.0 114.378 -175.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -47.33 -36.24 9.16 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.619 1.167 . . . . 0.0 113.25 172.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.7 mp -82.65 9.57 9.26 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 125.209 1.404 . . . . 0.0 111.658 -172.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.53 40.82 5.59 Favored Glycine 0 CA--C 1.532 1.138 0 C-N-CA 125.046 1.307 . . . . 0.0 113.274 177.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -112.28 143.65 43.01 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 121.507 -0.996 . . . . 0.0 112.273 -151.009 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? -92.54 79.87 4.86 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 125.8 1.64 . . . . 0.0 108.805 -173.306 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 39.2 mm . . . . . 0 CA--C 1.552 1.039 0 C-N-CA 128.81 2.844 . . . . 0.0 110.604 -161.487 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 28.5 m . . . . . 0 CA--C 1.55 0.949 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.12 -17.2 36.06 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.521 2.148 . . . . 0.0 112.47 -156.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -82.87 -38.78 22.47 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.575 1.55 . . . . 0.0 112.019 -178.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.2 p -71.06 -31.43 67.84 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 121.055 -1.028 . . . . 0.0 111.51 161.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 10.3 tmtt? -59.15 -47.54 84.9 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 120.096 1.316 . . . . 0.0 111.785 172.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 44.2 mttt -52.81 -51.94 58.88 Favored 'General case' 0 C--O 1.225 -0.217 0 C-N-CA 126.901 2.08 . . . . 0.0 111.823 171.179 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.08 -37.17 83.51 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -179.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 13.1 ttp85 -59.45 -55.33 36.06 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 124.709 1.203 . . . . 0.0 109.865 174.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -72.4 -29.41 63.71 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 115.414 -0.812 . . . . 0.0 112.41 -174.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.88 -44.65 96.38 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 120.795 -1.19 . . . . 0.0 112.039 165.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.0 t -55.96 -34.61 65.85 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 122.275 1.036 . . . . 0.0 111.678 173.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 66.6 mt -76.42 -32.46 21.73 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 125.274 1.43 . . . . 0.0 112.613 178.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 83.4 mt -66.59 -38.33 81.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 123.878 0.871 . . . . 0.0 110.868 167.273 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -72.03 -38.82 69.48 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 114.49 1.292 . . . . 0.0 114.49 -179.376 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.7 mppt? -137.77 -33.84 0.7 Allowed 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 115.993 1.849 . . . . 0.0 115.993 -177.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 101.79 156.7 26.44 Favored Glycine 0 CA--C 1.532 1.149 0 C-N-CA 124.605 1.098 . . . . 0.0 111.738 -157.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -69.96 -27.68 64.93 Favored 'General case' 0 N--CA 1.466 0.367 0 O-C-N 121.148 -1.207 . . . . 0.0 113.059 -166.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -56.12 -27.59 54.54 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 123.725 0.81 . . . . 0.0 112.843 176.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -96.3 8.72 43.21 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.368 1.067 . . . . 0.0 112.847 177.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 3.7 m -146.83 17.58 1.26 Allowed 'General case' 0 N--CA 1.443 -0.811 0 C-N-CA 125.547 1.539 . . . . 0.0 112.407 -155.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -68.77 -25.72 74.99 Favored Glycine 0 C--O 1.217 -0.935 0 CA-C-O 116.918 -2.046 . . . . 0.0 114.905 -177.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 38.9 p-80 -56.07 -28.52 57.91 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 120.016 1.908 . . . . 0.0 112.978 165.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.42 -34.8 35.9 Favored 'General case' 0 C--N 1.34 0.172 0 C-N-CA 123.856 0.862 . . . . 0.0 110.459 175.016 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 36.1 mt -69.76 -40.75 79.5 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.663 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 176.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -64.52 -52.43 57.82 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 125.625 1.57 . . . . 0.0 111.173 179.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.25 -40.04 58.0 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 113.453 0.909 . . . . 0.0 113.453 174.342 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 11.2 t60 -71.19 -42.79 68.57 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 114.193 1.182 . . . . 0.0 114.193 173.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.32 -52.5 65.11 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.737 1.215 . . . . 0.0 111.978 177.147 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -69.54 -33.94 73.5 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 123.145 0.578 . . . . 0.0 111.318 -176.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 48.7 t -49.35 -60.97 2.36 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-O 118.62 -0.705 . . . . 0.0 111.795 161.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 78.9 mtm -54.13 -45.14 71.86 Favored 'General case' 0 N--CA 1.483 1.217 0 CA-C-N 120.03 1.286 . . . . 0.0 112.712 175.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 47.8 mtt180 -52.18 -35.31 48.65 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 121.028 1.74 . . . . 0.0 113.976 -179.234 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -47.74 -40.12 19.61 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 113.908 1.077 . . . . 0.0 113.908 168.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 4.0 mp -82.75 10.2 8.13 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 126.458 1.903 . . . . 0.0 112.029 -172.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.84 30.83 13.73 Favored Glycine 0 CA--C 1.535 1.333 0 C-N-CA 124.732 1.158 . . . . 0.0 114.348 176.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.438 ' C ' ' HE3' ' A' ' 66' ' ' LYS . 0.3 OUTLIER -100.14 152.36 20.35 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.793 1.237 . . . . 0.0 114.105 -154.3 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.438 ' HE3' ' C ' ' A' ' 65' ' ' PHE . 0.4 OUTLIER -92.39 75.96 5.2 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 125.866 1.666 . . . . 0.0 108.955 -174.905 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 28.5 mm . . . . . 0 C--O 1.249 1.059 0 C-N-CA 127.798 2.439 . . . . 0.0 111.113 -158.321 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 56.9 m . . . . . 0 CA--C 1.544 0.743 0 N-CA-C 113.82 1.045 . . . . 0.0 113.82 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_endo -69.19 -22.67 34.37 Favored 'Trans proline' 0 CA--C 1.534 0.509 0 C-N-CA 123.425 2.75 . . . . 0.0 112.552 -157.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -63.1 -62.45 1.69 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.967 2.107 . . . . 0.0 112.812 171.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.8 p -61.12 -30.83 70.61 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 118.187 -0.911 . . . . 0.0 111.694 170.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 8.1 tmtt? -59.09 -49.68 76.95 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 120.052 1.296 . . . . 0.0 111.659 171.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 16.1 tttp -63.26 -43.06 99.04 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.783 0.833 . . . . 0.0 111.436 176.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.19 -39.37 92.5 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.49 0.716 . . . . 0.0 112.86 176.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 8.2 ttp85 -58.26 -54.62 44.98 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.551 1.54 . . . . 0.0 109.405 173.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 78.5 m-20 -68.78 -33.56 74.09 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.039 0.936 . . . . 0.0 113.442 -176.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.4 -37.32 82.92 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 120.588 -1.32 . . . . 0.0 112.854 171.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.1 t -57.19 -38.54 73.82 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.723 0.773 . . . . 0.0 111.225 168.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 67.0 mt -75.43 -30.17 22.01 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 C-N-CA 124.95 1.3 . . . . 0.0 112.27 -176.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 67.2 mt -58.18 -45.38 88.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 CA-C-N 119.028 0.831 . . . . 0.0 110.377 163.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.67 -37.35 79.53 Favored 'General case' 0 CA--C 1.552 1.05 0 N-CA-C 115.024 1.491 . . . . 0.0 115.024 -174.284 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.87 -8.63 0.41 Allowed 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 117.57 2.433 . . . . 0.0 117.57 -176.555 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 82.96 165.62 37.88 Favored Glycine 0 CA--C 1.536 1.358 0 CA-C-N 119.773 1.17 . . . . 0.0 112.531 -164.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -76.69 -30.92 56.91 Favored 'General case' 0 CA--C 1.516 -0.349 0 O-C-N 120.311 -1.699 . . . . 0.0 114.401 -164.735 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -58.94 -35.87 73.83 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 123.229 0.33 . . . . 0.0 111.462 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 -82.83 4.42 25.51 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.967 1.707 . . . . 0.0 112.986 177.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 1.8 m -139.3 18.0 2.58 Favored 'General case' 0 N--CA 1.442 -0.86 0 C-N-CA 127.794 2.438 . . . . 0.0 112.154 -168.125 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -69.93 -19.38 75.26 Favored Glycine 0 C--O 1.221 -0.658 0 O-C-N 119.751 -1.843 . . . . 0.0 115.56 -176.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 38.4 p-80 -58.24 -34.65 70.68 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 120.18 1.99 . . . . 0.0 112.352 162.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.65 -32.87 60.38 Favored 'General case' 0 CA--C 1.52 -0.201 0 C-N-CA 125.326 1.45 . . . . 0.0 110.774 174.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 5.1 mt -66.72 -39.28 83.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 118.843 -1.143 . . . . 0.0 110.748 167.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -74.63 -47.98 28.96 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 -170.352 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.79 -39.99 72.05 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 121.597 0.713 . . . . 0.0 112.138 170.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 18.5 t60 -65.36 -48.96 71.12 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.73 0.812 . . . . 0.0 112.913 174.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 52.7 mttm -48.13 -47.18 34.84 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 124.885 1.274 . . . . 0.0 112.168 177.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -75.79 -25.95 56.87 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 117.844 -1.074 . . . . 0.0 113.045 -177.286 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 37.6 t -58.55 -58.31 9.12 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-O 118.376 -0.821 . . . . 0.0 111.545 160.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 9.3 mmm -47.15 -45.23 22.52 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-N 120.341 1.428 . . . . 0.0 111.36 174.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 1.9 mtt85 -63.07 -32.42 73.79 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 117.028 -1.463 . . . . 0.0 114.134 -171.147 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -50.48 -36.83 35.44 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 118.985 0.811 . . . . 0.0 112.613 170.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 4.9 mp -82.52 8.04 12.81 Favored 'General case' 0 CA--C 1.554 1.098 0 C-N-CA 125.817 1.647 . . . . 0.0 112.003 -173.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.75 41.21 5.42 Favored Glycine 0 CA--C 1.534 1.266 0 C-N-CA 124.864 1.221 . . . . 0.0 114.788 171.153 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -119.75 145.83 46.2 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 120.725 -1.456 . . . . 0.0 114.031 -142.868 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -91.64 89.56 7.19 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.429 1.892 . . . . 0.0 109.158 -176.198 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 23.9 mm . . . . . 0 C--O 1.25 1.114 0 C-N-CA 126.707 2.003 . . . . 0.0 111.848 -158.143 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.6 m . . . . . 0 CA--C 1.549 0.919 0 N-CA-C 114.21 1.189 . . . . 0.0 114.21 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -65.3 -24.35 58.08 Favored 'Trans proline' 0 CA--C 1.538 0.701 0 C-N-CA 122.483 2.122 . . . . 0.0 112.328 -160.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -58.37 -52.01 67.39 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 127.065 2.146 . . . . 0.0 111.843 177.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.9 p -76.5 -38.26 55.5 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.289 1.436 . . . . 0.0 111.565 170.247 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 6.4 tmtt? -52.73 -46.87 67.62 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 120.102 1.319 . . . . 0.0 112.057 179.048 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.5 tmmm? -51.97 -55.0 23.09 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 126.959 2.104 . . . . 0.0 112.183 171.094 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.5 -35.02 79.23 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 114.393 -1.276 . . . . 0.0 112.634 -177.004 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 7.5 ttp85 -62.6 -54.98 31.51 Favored 'General case' 0 C--O 1.222 -0.368 0 C-N-CA 125.766 1.626 . . . . 0.0 109.444 174.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -71.45 -28.16 63.77 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -175.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.86 -41.22 87.68 Favored 'General case' 0 CA--C 1.544 0.75 0 O-C-N 120.549 -1.344 . . . . 0.0 112.965 167.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 6.2 t -55.5 -37.39 67.8 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 122.271 1.034 . . . . 0.0 111.044 169.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 73.5 mt -75.39 -31.27 23.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 O-C-N 121.052 -1.03 . . . . 0.0 111.949 -179.374 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 86.0 mt -64.11 -35.76 74.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 CA-C-N 118.825 0.738 . . . . 0.0 111.641 166.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 27.2 mt-10 -75.03 -36.66 61.87 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 178.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.68 -11.13 0.34 Allowed 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 118.083 2.623 . . . . 0.0 118.083 -173.666 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 86.78 166.7 42.82 Favored Glycine 0 CA--C 1.539 1.55 0 CA-C-N 120.035 1.289 . . . . 0.0 112.908 -163.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -76.44 -30.53 57.41 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 120.351 -1.676 . . . . 0.0 113.58 -168.388 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -58.25 -33.34 69.26 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 123.155 0.582 . . . . 0.0 112.258 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 -88.58 10.9 18.82 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.715 1.606 . . . . 0.0 112.591 178.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 2.7 m -141.2 14.91 2.23 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 126.294 1.838 . . . . 0.0 113.85 -162.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -60.29 -32.73 77.78 Favored Glycine 0 C--O 1.213 -1.189 0 O-C-N 120.152 -1.593 . . . . 0.0 115.264 -176.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 41.8 p-80 -55.37 -25.55 36.01 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 121.963 2.881 . . . . 0.0 114.439 169.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -79.89 -36.56 36.35 Favored 'General case' 0 C--N 1.339 0.119 0 C-N-CA 123.948 0.899 . . . . 0.0 111.379 170.066 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.402 HG22 ' HE2' ' A' ' 57' ' ' LYS . 42.6 mt -75.89 -33.52 25.64 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.391 0 CA-C-O 119.092 -0.48 . . . . 0.0 110.184 -177.673 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.436 ' HG3' ' HE3' ' A' ' 57' ' ' LYS . 1.5 mp0 -70.24 -53.23 17.88 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 125.48 1.512 . . . . 0.0 112.781 177.382 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -53.37 -35.11 59.94 Favored 'General case' 0 CA--C 1.545 0.752 0 O-C-N 121.267 -0.895 . . . . 0.0 113.028 173.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 19.2 t60 -73.9 -43.18 59.27 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.535 1.134 . . . . 0.0 113.931 174.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.436 ' HE3' ' HG3' ' A' ' 54' ' ' GLU . 26.3 mtmt -53.16 -52.21 59.51 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 125.275 1.43 . . . . 0.0 111.339 175.302 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -66.56 -37.58 85.27 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 122.99 0.516 . . . . 0.0 111.586 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 18.6 t -52.57 -59.64 4.21 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-O 117.805 -1.093 . . . . 0.0 112.162 167.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 92.9 mtp -47.6 -51.6 20.63 Favored 'General case' 0 N--CA 1.488 1.464 0 CA-C-N 120.69 1.586 . . . . 0.0 110.821 171.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.411 HH21 ' C ' ' A' ' 67' ' ' ILE . 37.5 mtt180 -54.91 -34.8 63.47 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 125.453 1.501 . . . . 0.0 114.0 -177.421 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -48.45 -39.09 21.61 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 119.203 0.91 . . . . 0.0 113.192 169.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.6 mp -81.0 8.86 7.47 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 124.84 1.256 . . . . 0.0 111.746 -173.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 86.65 18.81 57.82 Favored Glycine 0 CA--C 1.535 1.334 0 C-N-CA 125.278 1.418 . . . . 0.0 114.404 -178.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -72.59 170.67 13.95 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.538 1.535 . . . . 0.0 114.846 -166.039 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.31 88.93 3.01 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 125.103 1.361 . . . . 0.0 108.369 -177.158 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.411 ' C ' HH21 ' A' ' 61' ' ' ARG . 26.0 mm . . . . . 0 C--O 1.244 0.765 0 C-N-CA 130.69 3.596 . . . . 0.0 107.458 -162.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 56.7 m . . . . . 0 CA--C 1.547 0.852 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -69.65 -24.09 30.57 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 123.319 2.679 . . . . 0.0 112.776 -158.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.448 ' HG3' ' H ' ' A' ' 33' ' ' THR . 0.1 OUTLIER -53.48 -69.83 0.11 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 127.785 2.434 . . . . 0.0 113.76 164.177 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.448 ' H ' ' HG3' ' A' ' 32' ' ' GLU . 0.0 OUTLIER -60.84 -35.28 76.13 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 126.129 1.771 . . . . 0.0 110.96 176.554 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 9.2 tmtm? -53.41 -52.01 60.74 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.969 1.708 . . . . 0.0 112.264 169.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 50.4 tttm -58.5 -47.89 82.6 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.806 0.842 . . . . 0.0 111.984 175.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.14 -39.76 95.61 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 114.731 -1.122 . . . . 0.0 112.209 -178.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 11.8 ttp85 -61.48 -57.12 13.44 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 125.729 1.612 . . . . 0.0 109.918 174.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -66.35 -28.51 68.72 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.851 0.861 . . . . 0.0 112.92 -176.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.97 -42.39 80.92 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 120.216 -1.552 . . . . 0.0 112.646 169.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.7 t -55.43 -34.41 64.42 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 122.173 0.987 . . . . 0.0 111.545 171.386 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 61.8 mt -77.36 -33.55 19.89 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 C-N-CA 125.381 1.472 . . . . 0.0 112.428 178.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 73.2 mt -66.05 -34.06 67.69 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 123.883 0.873 . . . . 0.0 111.44 168.207 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -74.01 -36.3 64.45 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.013 1.325 . . . . 0.0 114.509 178.595 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.7 mppt? -138.43 -55.97 0.64 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.162 1.385 . . . . 0.0 113.646 175.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 136.75 163.54 9.82 Favored Glycine 0 CA--C 1.532 1.103 0 C-N-CA 126.32 1.914 . . . . 0.0 109.6 -159.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.1 -28.22 61.26 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 120.927 -1.337 . . . . 0.0 112.893 -169.091 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 -57.49 -32.49 67.06 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 178.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -84.79 5.22 29.46 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.941 1.296 . . . . 0.0 113.13 177.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 6.9 m -147.47 16.11 1.14 Allowed 'General case' 0 N--CA 1.441 -0.901 0 C-N-CA 125.067 1.347 . . . . 0.0 113.107 -154.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -65.76 -27.59 72.84 Favored Glycine 0 C--O 1.216 -0.983 0 O-C-N 120.115 -1.615 . . . . 0.0 114.964 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 40.8 p-80 -54.93 -25.58 30.34 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 120.973 2.386 . . . . 0.0 113.852 165.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.58 -34.04 31.24 Favored 'General case' 0 N--CA 1.462 0.135 0 C-N-CA 123.718 0.807 . . . . 0.0 110.956 173.081 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 35.9 mt -74.45 -38.57 46.77 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-O 119.202 -0.428 . . . . 0.0 110.626 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.68 -53.12 56.29 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 125.851 1.66 . . . . 0.0 111.404 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -56.37 -40.5 74.66 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.052 -1.03 . . . . 0.0 112.65 177.324 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 15.5 t60 -68.31 -48.12 65.75 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.937 1.295 . . . . 0.0 113.737 177.14 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 4.1 mtpp -48.97 -53.05 21.5 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 126.258 1.823 . . . . 0.0 111.498 174.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 34.8 mm-40 -72.9 -36.82 67.38 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.206 0.602 . . . . 0.0 111.564 -176.346 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 48.6 t -49.89 -56.49 10.31 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.594 0.757 . . . . 0.0 112.16 165.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 8.1 mtp -54.36 -53.59 51.96 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.89 1.276 . . . . 0.0 110.168 174.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 57.9 mtt180 -53.34 -30.93 41.93 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 126.137 1.775 . . . . 0.0 114.683 -176.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -47.56 -35.89 9.71 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.346 1.058 . . . . 0.0 112.911 169.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.3 mp -79.0 5.62 11.27 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.909 1.283 . . . . 0.0 112.381 -172.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.56 8.6 70.31 Favored Glycine 0 CA--C 1.535 1.291 0 C-N-CA 125.899 1.714 . . . . 0.0 113.049 -170.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -72.36 160.74 31.85 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 127.407 2.283 . . . . 0.0 112.74 -172.656 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.9 94.44 4.68 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.727 1.211 . . . . 0.0 108.131 -179.245 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.308 0 C-N-CA 127.469 2.308 . . . . 0.0 109.676 174.276 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 53.6 m . . . . . 0 CA--C 1.549 0.925 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -68.98 -7.93 22.17 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 123.906 3.071 . . . . 0.0 113.578 -158.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 36.2 mm-40 -96.37 -43.54 7.62 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 125.215 1.406 . . . . 0.0 110.685 -176.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.1 p -66.58 -27.26 67.59 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 117.948 -1.025 . . . . 0.0 111.99 161.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 9.8 tmtt? -58.32 -55.43 35.11 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 120.276 1.398 . . . . 0.0 111.457 169.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.6 mttp -55.16 -43.38 74.19 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 125.355 1.462 . . . . 0.0 112.458 172.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.61 -39.8 80.67 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 177.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 12.0 ttp85 -58.49 -53.25 60.44 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.514 1.125 . . . . 0.0 109.106 176.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -74.37 -30.11 61.84 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 115.124 -0.944 . . . . 0.0 112.817 -174.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.49 -43.32 99.08 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 120.772 -1.205 . . . . 0.0 111.794 166.148 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.8 t -56.27 -33.45 65.5 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.952 0.901 . . . . 0.0 111.741 173.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 67.0 mt -77.88 -35.46 20.84 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 124.769 1.228 . . . . 0.0 112.482 177.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 84.4 mt -64.46 -36.29 76.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 124.375 1.07 . . . . 0.0 111.379 168.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -71.98 -37.84 69.82 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.761 1.625 . . . . 0.0 113.983 178.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.9 mppt? -139.12 -59.23 0.59 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.582 1.553 . . . . 0.0 113.706 178.043 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 135.61 158.24 8.17 Favored Glycine 0 CA--C 1.531 1.033 0 C-N-CA 126.104 1.811 . . . . 0.0 109.714 -159.102 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.96 -27.48 61.85 Favored 'General case' 0 N--CA 1.465 0.28 0 O-C-N 120.746 -1.444 . . . . 0.0 113.011 -165.857 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -56.46 -36.18 68.77 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 122.76 0.424 . . . . 0.0 111.76 177.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -81.51 4.46 21.16 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.81 1.244 . . . . 0.0 113.1 177.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 6.0 m -147.81 15.84 1.09 Allowed 'General case' 0 N--CA 1.439 -0.994 0 C-N-CA 125.945 1.698 . . . . 0.0 112.473 -154.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -75.33 -13.16 83.08 Favored Glycine 0 C--O 1.222 -0.652 0 O-C-N 119.707 -1.87 . . . . 0.0 115.378 -178.061 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 35.2 p-80 -60.65 -33.82 73.38 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.889 1.844 . . . . 0.0 112.214 158.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.84 -37.85 67.28 Favored 'General case' 0 CA--C 1.516 -0.332 0 C-N-CA 124.132 0.973 . . . . 0.0 108.944 177.147 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 17.6 mt -71.23 -43.05 74.91 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.614 0 CA-C-O 118.853 -0.594 . . . . 0.0 109.673 177.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -60.93 -46.67 89.75 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 119.43 1.014 . . . . 0.0 112.267 179.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -61.54 -44.52 96.89 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.501 0.72 . . . . 0.0 112.865 175.339 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 14.2 t60 -63.33 -45.42 91.36 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 121.142 -0.973 . . . . 0.0 112.643 174.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.6 mtmt -54.76 -48.29 72.83 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.598 0.759 . . . . 0.0 111.235 173.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 87.3 mt-10 -70.94 -28.29 64.38 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 117.929 -1.034 . . . . 0.0 113.112 -178.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 48.9 t -57.02 -60.24 3.88 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 119.183 0.901 . . . . 0.0 111.212 160.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 76.0 mtm -54.05 -45.51 71.69 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 119.576 1.08 . . . . 0.0 113.355 178.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 47.7 mtt180 -50.71 -37.28 40.6 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 126.636 1.974 . . . . 0.0 113.292 -178.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -47.45 -39.08 14.9 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 169.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.7 mp -84.1 10.26 10.55 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 126.367 1.867 . . . . 0.0 111.571 -172.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.11 33.46 10.76 Favored Glycine 0 CA--C 1.534 1.247 0 O-C-N 120.623 -1.298 . . . . 0.0 113.685 -179.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -99.07 156.46 16.92 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.038 1.735 . . . . 0.0 112.749 -168.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 3.1 mppt? -116.37 73.11 0.84 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.0 1.72 . . . . 0.0 109.504 -160.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.028 0 C-N-CA 125.801 1.64 . . . . 0.0 111.759 -165.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 55.6 m . . . . . 0 CA--C 1.548 0.879 0 N-CA-C 113.777 1.028 . . . . 0.0 113.777 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -69.9 -18.22 36.48 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.642 2.228 . . . . 0.0 112.747 -156.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 27.5 mm-40 -85.37 -40.8 16.08 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.691 1.196 . . . . 0.0 112.295 -178.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.4 p -65.53 -30.28 71.01 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 120.725 -1.235 . . . . 0.0 111.328 161.134 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 9.6 tmtt? -60.85 -48.14 83.18 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 120.39 1.45 . . . . 0.0 111.836 171.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 42.4 mttt -55.04 -49.64 71.07 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 126.106 1.763 . . . . 0.0 111.694 171.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.17 -36.6 83.51 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 112.921 0.712 . . . . 0.0 112.921 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 8.3 ttp85 -58.87 -53.46 58.18 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.939 1.296 . . . . 0.0 109.6 174.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 60.6 m-20 -70.46 -30.39 67.2 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.78 0.832 . . . . 0.0 112.836 -176.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.42 -39.42 93.8 Favored 'General case' 0 CA--C 1.547 0.857 0 O-C-N 120.418 -1.426 . . . . 0.0 112.969 166.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.8 t -59.73 -32.38 70.49 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 122.773 1.273 . . . . 0.0 112.095 169.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 67.9 mt -75.57 -33.01 25.84 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 O-C-N 120.386 -1.446 . . . . 0.0 111.341 177.522 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 77.3 mt -62.48 -36.63 75.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.617 1.167 . . . . 0.0 112.173 166.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -64.88 -48.67 73.42 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 119.573 1.079 . . . . 0.0 113.269 175.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.4 pttm -155.5 -4.91 0.13 Allowed 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 116.407 2.003 . . . . 0.0 116.407 -160.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 83.71 158.42 26.76 Favored Glycine 0 CA--C 1.527 0.811 0 CA-C-N 119.057 0.844 . . . . 0.0 112.62 -167.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.09 -28.36 68.11 Favored 'General case' 0 C--N 1.334 -0.101 0 O-C-N 121.578 -0.954 . . . . 0.0 112.723 -169.782 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -59.69 -26.22 65.4 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-O 118.122 -0.942 . . . . 0.0 112.905 175.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 82.5 m-70 -98.72 15.33 25.64 Favored 'General case' 0 C--N 1.352 0.683 0 CA-C-N 120.61 1.55 . . . . 0.0 110.528 -179.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 1.8 m -147.79 14.74 1.07 Allowed 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 125.973 1.709 . . . . 0.0 113.503 -157.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -67.11 -17.63 68.15 Favored Glycine 0 C--O 1.215 -1.064 0 O-C-N 119.569 -1.957 . . . . 0.0 115.825 -175.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 35.2 p-80 -58.94 -33.69 70.89 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 121.572 2.686 . . . . 0.0 112.795 164.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.24 -34.64 61.43 Favored 'General case' 0 N--CA 1.462 0.175 0 C-N-CA 126.354 1.862 . . . . 0.0 111.453 173.737 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.5 mt -70.54 -43.44 77.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 118.911 -1.115 . . . . 0.0 110.914 171.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -63.02 -53.78 48.54 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.921 0.888 . . . . 0.0 112.278 -176.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -58.45 -32.69 68.95 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.34 -1.475 . . . . 0.0 113.646 178.082 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 10.7 t60 -74.02 -44.67 53.66 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.677 1.191 . . . . 0.0 113.043 175.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 35.0 mtpt -53.54 -53.1 56.46 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.162 1.385 . . . . 0.0 112.07 176.27 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -62.76 -40.62 97.83 Favored 'General case' 0 C--N 1.327 -0.405 0 O-C-N 123.318 0.386 . . . . 0.0 111.713 -176.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 44.0 t -51.5 -51.28 56.51 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 124.069 0.948 . . . . 0.0 112.844 169.269 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 72.8 mtm -62.06 -51.72 66.81 Favored 'General case' 0 N--CA 1.481 1.081 0 O-C-N 120.979 -1.076 . . . . 0.0 111.507 171.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 69.0 mtt180 -53.77 -32.37 52.1 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 126.981 2.112 . . . . 0.0 113.87 -175.44 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -44.86 -33.35 1.92 Allowed 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.047 1.339 . . . . 0.0 113.804 168.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.3 mp -82.19 5.63 19.2 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.195 0.998 . . . . 0.0 112.375 -173.286 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.29 17.9 75.3 Favored Glycine 0 CA--C 1.534 1.233 0 C-N-CA 125.039 1.304 . . . . 0.0 112.614 -166.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -70.49 144.24 51.45 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.999 1.72 . . . . 0.0 110.692 179.371 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? -106.34 101.72 11.17 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 125.084 1.354 . . . . 0.0 108.979 -175.124 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.252 1.207 0 C-N-CA 128.512 2.725 . . . . 0.0 109.191 -172.027 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 57.4 m . . . . . 0 CA--C 1.552 1.032 0 N-CA-C 114.1 1.148 . . . . 0.0 114.1 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -65.57 -30.84 51.43 Favored 'Trans proline' 0 CA--C 1.534 0.495 0 C-N-CA 123.729 2.953 . . . . 0.0 112.041 -166.092 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -41.5 -70.04 0.12 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 127.349 2.26 . . . . 0.0 115.31 158.365 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -65.25 -28.7 69.53 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.007 -1.058 . . . . 0.0 111.726 177.046 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 5.0 tmtt? -58.12 -46.69 85.15 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 120.359 1.436 . . . . 0.0 111.088 171.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 4.5 tmtm? -63.34 -45.06 92.98 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 123.721 0.808 . . . . 0.0 110.716 176.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.78 -42.4 97.46 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 176.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 11.4 ttp85 -59.45 -53.72 54.93 Favored 'General case' 0 C--O 1.221 -0.429 0 C-N-CA 126.148 1.779 . . . . 0.0 110.247 175.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 56.8 m-20 -66.19 -31.97 73.12 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.014 0.926 . . . . 0.0 113.137 179.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -69.22 -37.08 77.87 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 120.728 -1.232 . . . . 0.0 112.447 172.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 9.3 t -55.91 -43.21 77.08 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 121.949 0.88 . . . . 0.0 110.89 169.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 71.4 mt -69.16 -29.01 41.24 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 C-N-CA 124.319 1.048 . . . . 0.0 111.272 -179.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 89.3 mt -70.31 -35.15 61.41 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 C-N-CA 123.509 0.724 . . . . 0.0 112.092 169.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -76.41 -32.58 58.59 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 114.561 1.319 . . . . 0.0 114.561 178.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.2 -18.14 0.44 Allowed 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 117.238 2.31 . . . . 0.0 117.238 -175.413 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 91.33 174.66 43.47 Favored Glycine 0 CA--C 1.536 1.364 0 CA-C-N 118.868 0.758 . . . . 0.0 113.386 -167.179 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -79.6 -35.07 40.13 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 115.592 1.701 . . . . 0.0 115.592 -157.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -60.89 -34.38 74.56 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.086 0.954 . . . . 0.0 113.423 174.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 99.4 m-70 -81.92 9.16 8.7 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.574 1.15 . . . . 0.0 112.514 -178.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 9.8 m -140.03 12.56 2.43 Favored 'General case' 0 N--CA 1.441 -0.906 0 C-N-CA 125.805 1.642 . . . . 0.0 113.949 -162.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -63.96 -30.11 76.78 Favored Glycine 0 C--O 1.213 -1.182 0 O-C-N 120.126 -1.609 . . . . 0.0 114.973 179.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 40.6 p-80 -57.14 -28.17 62.51 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 121.537 2.668 . . . . 0.0 113.523 167.44 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.83 -36.38 56.9 Favored 'General case' 0 CA--C 1.522 -0.13 0 C-N-CA 123.721 0.808 . . . . 0.0 110.757 171.856 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.9 mt -72.04 -39.68 66.31 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 CA-C-O 119.321 -0.371 . . . . 0.0 110.64 179.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.15 -49.12 63.06 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 125.464 1.506 . . . . 0.0 111.594 -177.029 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -58.23 -45.23 88.08 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.912 0.885 . . . . 0.0 112.563 172.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 11.9 t60 -60.49 -45.66 92.93 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 122.184 0.992 . . . . 0.0 112.644 174.142 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 17.0 mtpp -55.34 -48.53 74.07 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.851 1.261 . . . . 0.0 111.283 174.027 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 60.3 mm-40 -60.15 -41.58 93.08 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 120.934 1.697 . . . . 0.0 111.244 177.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 41.8 t -55.88 -52.88 62.54 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.353 0.661 . . . . 0.0 111.582 178.173 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 71.4 mtm -60.32 -45.25 94.05 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.503 0.721 . . . . 0.0 111.116 172.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 25.2 mtm180 -54.67 -32.81 59.88 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 119.821 -1.799 . . . . 0.0 114.051 -178.101 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -44.63 -36.06 2.9 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.12 0.968 . . . . 0.0 113.445 169.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.8 mp -79.33 6.62 9.55 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 123.919 0.888 . . . . 0.0 112.644 -173.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 82.93 23.98 54.02 Favored Glycine 0 CA--C 1.534 1.241 0 C-N-CA 125.994 1.759 . . . . 0.0 112.399 -172.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -87.05 154.09 21.03 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.047 1.739 . . . . 0.0 113.052 -156.749 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.5 mmpt? -92.91 72.72 4.8 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.366 1.866 . . . . 0.0 110.543 -172.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 12.5 mm . . . . . 0 C--O 1.252 1.214 0 N-CA-C 114.966 1.469 . . . . 0.0 114.966 -151.781 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.2 m . . . . . 0 CA--C 1.549 0.91 0 N-CA-C 112.535 0.568 . . . . 0.0 112.535 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -67.36 -9.29 24.76 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 123.722 2.948 . . . . 0.0 112.944 -162.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 40.6 mm-40 -90.66 -48.69 6.91 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 126.589 1.956 . . . . 0.0 111.888 -178.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 9.1 p -65.79 -28.22 68.85 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 119.761 1.164 . . . . 0.0 111.862 163.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 24.3 tttt -57.94 -57.76 11.38 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.934 0.893 . . . . 0.0 110.476 169.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.0 mtmp? -58.73 -37.63 76.6 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.132 0.973 . . . . 0.0 112.718 176.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.86 -39.3 87.5 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 174.19 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 4.3 ttp180 -60.2 -53.05 62.37 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.388 1.075 . . . . 0.0 109.564 171.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -62.05 -37.91 86.74 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.46 1.504 . . . . 0.0 112.352 -177.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.29 -37.98 84.28 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 120.839 -1.163 . . . . 0.0 112.882 171.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.2 t -57.68 -36.14 71.53 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 122.298 1.047 . . . . 0.0 111.848 173.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 92.0 mt -70.82 -35.21 59.21 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 O-C-N 120.828 -1.17 . . . . 0.0 110.565 177.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 97.2 mt -64.59 -36.99 78.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 123.633 0.773 . . . . 0.0 112.189 169.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 67.2 mt-10 -65.37 -47.03 77.82 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 119.777 1.172 . . . . 0.0 113.276 177.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -151.99 -8.35 0.21 Allowed 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 -165.417 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 87.88 159.81 34.89 Favored Glycine 0 CA--C 1.524 0.619 0 CA-C-O 122.47 1.039 . . . . 0.0 111.799 -172.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -66.97 -28.53 68.34 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 -165.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -61.45 -25.55 67.3 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 113.828 1.048 . . . . 0.0 113.828 173.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 80.7 m-70 -96.71 18.06 15.17 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 120.646 1.567 . . . . 0.0 110.571 -177.116 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 5.9 m -146.99 14.27 1.15 Allowed 'General case' 0 N--CA 1.442 -0.863 0 N-CA-C 115.819 1.785 . . . . 0.0 115.819 -156.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -69.93 -27.44 73.09 Favored Glycine 0 N--CA 1.474 1.194 0 CA-C-N 122.12 2.236 . . . . 0.0 116.809 -174.012 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 43.4 p-80 -54.54 -26.18 30.35 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 120.811 2.305 . . . . 0.0 113.833 163.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.17 -35.52 36.38 Favored 'General case' 0 CA--C 1.518 -0.262 0 C-N-CA 123.476 0.711 . . . . 0.0 110.968 173.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 15.5 mt -71.69 -38.23 65.72 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 CA-C-O 119.42 -0.324 . . . . 0.0 110.697 177.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -73.53 -52.35 13.85 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 125.985 1.714 . . . . 0.0 114.619 -178.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -56.29 -35.68 67.76 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 122.005 0.907 . . . . 0.0 112.042 174.117 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 9.5 t60 -68.71 -48.41 63.91 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 113.589 0.959 . . . . 0.0 113.589 173.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.3 mtmt -46.99 -53.07 13.21 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.543 1.137 . . . . 0.0 111.395 172.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -65.15 -39.79 93.48 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.154 0.981 . . . . 0.0 112.101 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 18.8 t -54.21 -50.92 66.01 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 123.592 0.757 . . . . 0.0 112.149 172.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 71.0 mtm -60.15 -46.83 88.33 Favored 'General case' 0 N--CA 1.48 1.032 0 O-C-N 120.819 -1.176 . . . . 0.0 111.528 169.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 1.5 mtt180 -61.56 -25.82 67.56 Favored 'General case' 0 CA--C 1.53 0.197 0 O-C-N 119.943 -1.723 . . . . 0.0 113.641 -175.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -46.88 -33.0 4.16 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 124.724 1.21 . . . . 0.0 113.362 167.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.9 mp -81.74 9.65 7.54 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-O 121.64 0.733 . . . . 0.0 112.598 -174.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 71.2 25.89 74.69 Favored Glycine 0 CA--C 1.532 1.143 0 C-N-CA 125.947 1.737 . . . . 0.0 112.179 -169.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -74.47 147.12 42.21 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 126.034 1.733 . . . . 0.0 112.22 -162.388 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.35 77.94 3.11 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.991 1.316 . . . . 0.0 110.619 -175.794 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.107 0 C-N-CA 128.527 2.731 . . . . 0.0 108.042 179.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 33.5 m . . . . . 0 CA--C 1.549 0.937 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -63.9 -29.9 67.49 Favored 'Trans proline' 0 CA--C 1.537 0.669 0 C-N-CA 122.843 2.362 . . . . 0.0 111.745 -170.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.511 ' HG3' ' H ' ' A' ' 33' ' ' THR . 0.3 OUTLIER -39.81 -69.76 0.12 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 127.064 2.146 . . . . 0.0 114.842 161.413 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.511 ' H ' ' HG3' ' A' ' 32' ' ' GLU . 0.0 OUTLIER -74.43 -23.74 58.97 Favored 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 124.939 1.296 . . . . 0.0 111.464 -178.842 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 4.7 tmtt? -58.31 -49.62 76.52 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 119.797 1.18 . . . . 0.0 111.207 167.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.1 tmtp? -62.52 -43.66 98.27 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.454 0.702 . . . . 0.0 111.309 177.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.44 -42.23 95.66 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 113.182 0.808 . . . . 0.0 113.182 174.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 8.1 ttp85 -59.8 -52.79 63.97 Favored 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 125.639 1.576 . . . . 0.0 110.326 174.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 61.8 m-20 -65.06 -32.14 73.71 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.63 0.772 . . . . 0.0 112.862 179.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -65.85 -36.37 83.27 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 120.781 -1.199 . . . . 0.0 113.015 170.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 11.3 t -59.62 -44.04 93.59 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 121.921 0.867 . . . . 0.0 111.121 168.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 58.4 mt -68.91 -32.5 54.87 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 C-N-CA 124.263 1.025 . . . . 0.0 110.966 -178.604 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 35.4 mt -60.82 -39.71 82.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 124.1 0.96 . . . . 0.0 112.328 167.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -70.26 -44.5 68.32 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 177.061 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.37 -10.41 1.09 Allowed 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 117.133 2.271 . . . . 0.0 117.133 -165.477 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.25 175.96 49.35 Favored Glycine 0 CA--C 1.533 1.202 0 CA-C-N 119.203 0.911 . . . . 0.0 113.252 -165.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -83.81 -30.44 26.55 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 115.065 1.505 . . . . 0.0 115.065 -156.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -62.86 -32.61 73.88 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.079 0.952 . . . . 0.0 113.567 174.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -85.16 12.22 8.32 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.792 1.237 . . . . 0.0 112.595 -178.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 9.7 m -138.41 13.51 2.78 Favored 'General case' 0 N--CA 1.445 -0.701 0 C-N-CA 125.592 1.557 . . . . 0.0 114.354 -163.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -62.77 -33.37 86.67 Favored Glycine 0 C--O 1.216 -1.029 0 CA-C-O 117.844 -1.531 . . . . 0.0 115.728 -176.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 41.1 p-80 -55.95 -29.97 60.98 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 121.095 2.447 . . . . 0.0 113.415 168.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.35 -33.45 42.96 Favored 'General case' 0 CA--C 1.519 -0.219 0 C-N-CA 124.428 1.091 . . . . 0.0 110.76 173.505 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 37.1 mt -72.51 -37.74 57.88 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.564 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 177.354 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -72.37 -53.07 13.37 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.818 1.647 . . . . 0.0 114.239 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.08 -31.95 53.36 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 118.951 0.796 . . . . 0.0 112.834 174.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 10.5 t60 -74.12 -51.13 16.59 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.719 1.608 . . . . 0.0 113.986 170.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -48.52 -54.44 14.36 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 125.346 1.459 . . . . 0.0 110.378 176.17 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -61.22 -39.03 88.77 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.526 0.73 . . . . 0.0 112.204 -177.329 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 34.5 t -53.64 -48.43 69.37 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 124.231 1.013 . . . . 0.0 113.122 169.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 23.8 mtp -62.87 -53.06 59.99 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 125.468 1.507 . . . . 0.0 110.389 172.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 22.1 mtp85 -52.52 -33.91 47.35 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 127.977 2.511 . . . . 0.0 115.21 -176.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -42.88 -35.07 1.08 Allowed 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.841 1.257 . . . . 0.0 114.025 167.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.2 mp -81.14 5.48 16.65 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.383 1.073 . . . . 0.0 112.784 -173.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.73 15.58 70.25 Favored Glycine 0 CA--C 1.536 1.352 0 C-N-CA 125.94 1.733 . . . . 0.0 112.797 -169.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -75.09 142.92 43.61 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.946 2.098 . . . . 0.0 112.353 -168.591 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.1 mppt? -92.9 82.73 4.68 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.138 1.375 . . . . 0.0 108.909 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 4.3 mm . . . . . 0 C--O 1.254 1.328 0 C-N-CA 131.11 3.764 . . . . 0.0 107.801 -165.922 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 83.6 m . . . . . 0 CA--C 1.552 1.034 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -73.59 -5.47 17.14 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 123.169 2.579 . . . . 0.0 112.694 -162.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -101.37 -40.51 7.07 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 125.058 1.343 . . . . 0.0 112.521 -177.187 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.3 p -60.8 -34.62 74.78 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-O 117.765 -1.112 . . . . 0.0 110.278 157.664 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 2.0 ttmt -58.21 -54.86 42.26 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 119.598 1.09 . . . . 0.0 112.244 169.111 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.76 -49.22 58.64 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.819 0.847 . . . . 0.0 112.135 176.621 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.19 -37.05 84.66 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 114.674 -1.148 . . . . 0.0 113.268 176.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 3.4 ttp180 -58.1 -56.03 27.36 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.142 1.377 . . . . 0.0 109.126 173.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -65.41 -37.15 86.09 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.423 1.489 . . . . 0.0 111.265 -173.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.25 -43.4 98.11 Favored 'General case' 0 CA--C 1.545 0.788 0 O-C-N 120.983 -1.073 . . . . 0.0 113.255 170.381 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -58.74 -34.21 71.13 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.177 -0.952 . . . . 0.0 111.232 172.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 81.8 mt -75.55 -35.53 32.26 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 O-C-N 120.911 -1.118 . . . . 0.0 111.642 177.22 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 70.2 mt -62.29 -34.18 62.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 124.309 1.044 . . . . 0.0 111.587 169.325 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -70.87 -41.57 71.22 Favored 'General case' 0 CA--C 1.555 1.159 0 N-CA-C 114.183 1.179 . . . . 0.0 114.183 177.02 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.58 -11.59 0.24 Allowed 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 117.586 2.439 . . . . 0.0 117.586 -170.633 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 86.13 159.96 33.29 Favored Glycine 0 CA--C 1.534 1.266 0 CA-C-N 119.224 0.92 . . . . 0.0 112.525 -161.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -73.2 -33.97 65.7 Favored 'General case' 0 C--N 1.337 0.065 0 O-C-N 120.741 -1.446 . . . . 0.0 113.623 -166.397 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -53.82 -36.83 62.93 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.782 0.833 . . . . 0.0 112.534 176.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 79.8 m-70 -87.55 12.45 12.41 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.6 1.56 . . . . 0.0 112.937 178.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -146.38 5.08 0.93 Allowed 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.863 1.665 . . . . 0.0 113.831 -170.312 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -60.73 -14.55 37.15 Favored Glycine 0 N--CA 1.474 1.178 0 N-CA-C 118.69 2.236 . . . . 0.0 118.69 -160.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 30.2 p-80 -55.3 -36.27 66.01 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 121.08 2.44 . . . . 0.0 112.87 164.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.41 -42.24 96.18 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 125.157 1.383 . . . . 0.0 110.75 172.402 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 4.2 mp -72.9 -37.98 55.57 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.344 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.177 -178.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.461 ' HA ' ' HE3' ' A' ' 57' ' ' LYS . 3.5 mm-40 -64.85 -52.65 55.51 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 123.511 0.725 . . . . 0.0 112.557 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.76 -39.97 86.63 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.628 0.771 . . . . 0.0 112.61 177.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 16.1 t60 -65.81 -48.13 72.77 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 123.438 0.695 . . . . 0.0 112.576 174.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.461 ' HE3' ' HA ' ' A' ' 54' ' ' GLU . 1.6 mtmp? -52.56 -46.47 66.84 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-O 118.968 -0.539 . . . . 0.0 111.669 171.467 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -65.15 -37.6 87.91 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 123.895 0.878 . . . . 0.0 112.793 177.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 49.7 t -56.97 -52.82 63.7 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 118.795 0.725 . . . . 0.0 111.912 169.367 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 77.6 mtm -56.94 -48.93 77.15 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.32 1.048 . . . . 0.0 111.714 173.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.515 ' HE ' ' C ' ' A' ' 67' ' ' ILE . 11.5 mtt-85 -56.49 -30.3 62.81 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.26 1.824 . . . . 0.0 114.374 -176.474 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -46.26 -31.61 2.61 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.166 0.986 . . . . 0.0 113.284 167.518 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.2 mp -84.47 4.75 30.29 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 123.802 0.841 . . . . 0.0 112.364 -173.347 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.58 19.35 71.3 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 124.507 1.051 . . . . 0.0 112.547 -168.399 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -74.94 141.74 44.03 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 126.607 1.963 . . . . 0.0 110.601 178.197 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.5 mppt? -100.15 76.8 1.93 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 125.077 1.351 . . . . 0.0 109.593 -171.371 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.515 ' C ' ' HE ' ' A' ' 61' ' ' ARG . 0.2 OUTLIER . . . . . 0 C--O 1.248 0.99 0 CA-C-O 116.913 -1.518 . . . . 0.0 111.076 -171.28 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 3.4 m . . . . . 0 CA--C 1.545 0.774 0 CA-C-O 120.876 0.369 . . . . 0.0 110.441 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_endo -71.3 -18.17 30.34 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 122.634 2.223 . . . . 0.0 112.355 -170.268 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 36.9 mm-40 -81.57 -40.41 23.09 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.132 1.373 . . . . 0.0 112.554 -176.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.0 p -70.02 -30.45 67.75 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 120.879 -1.138 . . . . 0.0 111.741 161.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 10.1 tmtt? -58.85 -44.78 91.08 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 120.551 1.523 . . . . 0.0 112.201 170.486 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.1 mttt -52.95 -51.66 60.66 Favored 'General case' 0 C--O 1.223 -0.3 0 C-N-CA 127.52 2.328 . . . . 0.0 111.243 172.021 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.32 -37.77 80.91 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 178.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.402 HH12 ' CD ' ' A' ' 46' ' ' GLU . 6.5 ttp85 -57.95 -51.9 67.73 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.705 1.202 . . . . 0.0 109.566 174.83 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -73.25 -30.14 63.25 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.11 0.964 . . . . 0.0 113.14 -178.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.26 -39.27 92.35 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 120.644 -1.285 . . . . 0.0 111.946 167.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.8 t -60.35 -32.88 71.68 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 122.45 1.119 . . . . 0.0 112.322 172.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 70.4 mt -75.84 -33.83 26.55 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 124.528 1.131 . . . . 0.0 111.807 176.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 88.5 mt -66.34 -34.53 70.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 124.564 1.146 . . . . 0.0 111.724 168.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -71.18 -38.86 72.12 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 174.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.9 mppt? -140.87 -59.17 0.51 Allowed 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.384 1.473 . . . . 0.0 113.944 -177.027 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 137.54 160.73 8.66 Favored Glycine 0 CA--C 1.533 1.181 0 C-N-CA 126.144 1.83 . . . . 0.0 109.659 -158.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.402 ' CD ' HH12 ' A' ' 37' ' ' ARG . 0.3 OUTLIER -73.8 -29.51 62.21 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 119.219 1.51 . . . . 0.0 112.529 -168.77 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 22.9 pt-20 -58.36 -34.02 70.21 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 123.274 0.63 . . . . 0.0 112.204 179.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 98.5 m-70 -82.71 5.4 21.43 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.136 1.374 . . . . 0.0 113.148 177.764 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 4.3 m -145.52 20.28 1.51 Allowed 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 125.541 1.536 . . . . 0.0 112.258 -154.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -70.3 -17.0 73.81 Favored Glycine 0 C--O 1.219 -0.784 0 O-C-N 120.131 -1.606 . . . . 0.0 115.306 177.211 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 41.5 p-80 -61.17 -30.44 70.41 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 120.213 2.007 . . . . 0.0 112.35 161.196 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -80.29 -35.21 36.16 Favored 'General case' 0 C--O 1.232 0.177 0 C-N-CA 124.225 1.01 . . . . 0.0 111.073 174.637 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 10.4 mt -66.38 -42.47 90.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 CA-C-O 118.105 -0.95 . . . . 0.0 109.79 173.118 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.57 -53.96 49.41 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 118.526 0.603 . . . . 0.0 111.655 178.618 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.94 -39.27 68.7 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 120.952 -1.092 . . . . 0.0 113.271 179.459 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 13.5 t60 -69.49 -41.98 75.38 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 124.987 1.315 . . . . 0.0 114.253 173.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 39.5 mtpt -56.29 -52.7 63.55 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.49 1.116 . . . . 0.0 111.795 175.255 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -61.9 -39.62 92.61 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 123.093 0.557 . . . . 0.0 111.718 177.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 49.4 t -48.92 -59.74 3.34 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-O 118.709 -0.662 . . . . 0.0 111.503 170.28 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 74.2 mtm -56.43 -50.81 70.58 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.173 0.989 . . . . 0.0 111.763 174.663 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 74.3 mtt180 -54.04 -33.03 56.23 Favored 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 120.232 -1.542 . . . . 0.0 113.941 -174.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -44.19 -42.8 6.71 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.864 1.266 . . . . 0.0 113.837 166.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.4 mp -79.25 9.12 4.9 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.432 1.493 . . . . 0.0 111.777 -173.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 82.38 16.7 70.7 Favored Glycine 0 CA--C 1.532 1.135 0 C-N-CA 124.42 1.009 . . . . 0.0 113.636 -173.328 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -65.39 164.61 13.4 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 119.091 1.445 . . . . 0.0 112.385 -178.059 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.02 97.87 5.44 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 120.449 -1.407 . . . . 0.0 109.64 -177.838 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.15 0 C-N-CA 129.742 3.217 . . . . 0.0 107.735 -169.014 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 9.1 m . . . . . 0 CA--C 1.548 0.886 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -66.63 -19.62 53.87 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.792 2.328 . . . . 0.0 111.555 -165.231 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.6 mm-40 -75.12 -49.3 20.04 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 125.951 1.701 . . . . 0.0 112.369 -179.143 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.7 p -69.09 -26.21 64.81 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 118.334 -0.841 . . . . 0.0 112.034 166.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 10.3 tmtt? -61.51 -50.96 70.61 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 119.969 1.259 . . . . 0.0 111.405 170.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 25.6 ttpt -54.22 -48.2 71.31 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 127.666 2.386 . . . . 0.0 111.485 172.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.74 -41.49 98.03 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 176.275 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 4.1 ttp180 -58.85 -55.59 33.11 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.736 1.214 . . . . 0.0 109.385 174.344 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -61.19 -37.32 82.51 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.169 1.388 . . . . 0.0 112.858 -179.081 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.65 -35.77 79.5 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.081 -1.012 . . . . 0.0 112.89 172.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.9 t -59.16 -41.59 88.74 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.339 -0.85 . . . . 0.0 111.298 170.488 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 78.5 mt -70.27 -31.36 46.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 C-N-CA 124.899 1.28 . . . . 0.0 111.267 -178.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 60.7 mt -60.56 -44.34 96.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 CA-C-N 118.765 0.712 . . . . 0.0 111.185 165.653 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -71.3 -35.18 71.18 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 115.218 1.562 . . . . 0.0 115.218 -174.563 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.4 -10.49 0.48 Allowed 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 117.061 2.245 . . . . 0.0 117.061 -177.7 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 84.63 172.25 48.9 Favored Glycine 0 CA--C 1.531 1.087 0 CA-C-N 119.367 0.985 . . . . 0.0 112.052 -165.612 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -81.75 -35.54 29.54 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 114.981 1.475 . . . . 0.0 114.981 -159.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -55.05 -37.25 66.47 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 174.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -80.36 5.84 13.77 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.2 1.4 . . . . 0.0 113.008 -179.244 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 2.3 m -137.17 18.0 2.98 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 125.846 1.658 . . . . 0.0 113.589 -164.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . 0.4 ' HA2' ' CD1' ' A' ' 53' ' ' ILE . . . -75.99 -14.9 81.78 Favored Glycine 0 N--CA 1.467 0.742 0 O-C-N 119.706 -1.871 . . . . 0.0 117.52 -174.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 40.3 p-80 -59.3 -31.31 69.02 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.844 1.822 . . . . 0.0 112.321 157.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.19 -37.76 52.94 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 123.449 0.7 . . . . 0.0 109.923 177.162 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.4 ' CD1' ' HA2' ' A' ' 50' ' ' GLY . 14.7 mt -67.44 -40.73 85.12 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.358 0 CA-C-O 119.301 -0.381 . . . . 0.0 109.974 177.259 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -65.36 -54.33 30.38 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.209 1.004 . . . . 0.0 113.409 178.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -57.03 -35.6 69.47 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 119.008 0.822 . . . . 0.0 112.315 179.008 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 7.6 t60 -69.97 -47.36 62.6 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 173.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -50.32 -52.07 39.89 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 125.193 1.397 . . . . 0.0 112.051 177.331 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -66.4 -36.86 83.9 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.117 0.567 . . . . 0.0 111.964 -177.468 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 17.5 t -52.9 -56.02 18.96 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.522 0.729 . . . . 0.0 112.866 168.559 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 7.7 mtt -53.06 -52.2 59.32 Favored 'General case' 0 N--CA 1.487 1.387 0 CA-C-N 119.888 1.222 . . . . 0.0 110.983 170.438 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 30.3 mtt180 -55.42 -31.44 61.88 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 125.774 1.63 . . . . 0.0 114.69 -174.053 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -45.84 -36.29 5.13 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.338 1.055 . . . . 0.0 113.053 169.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.1 mp -80.5 4.26 18.88 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.559 1.143 . . . . 0.0 112.248 -172.311 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 94.62 4.39 62.14 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 125.546 1.546 . . . . 0.0 113.446 -171.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.44 ' C ' ' HE3' ' A' ' 66' ' ' LYS . 1.3 m-85 -70.64 150.41 46.04 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 126.353 1.861 . . . . 0.0 113.45 -171.833 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.44 ' HE3' ' C ' ' A' ' 65' ' ' PHE . 0.0 OUTLIER -114.32 76.67 1.0 Allowed 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.661 1.584 . . . . 0.0 108.893 -163.402 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.026 0 C-N-CA 127.395 2.278 . . . . 0.0 109.504 -173.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 42.6 m . . . . . 0 CA--C 1.554 1.109 0 N-CA-C 113.264 0.838 . . . . 0.0 113.264 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -64.93 -29.54 57.85 Favored 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 123.583 2.855 . . . . 0.0 112.432 -162.359 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -41.34 -69.4 0.14 Allowed 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 127.206 2.202 . . . . 0.0 115.275 158.202 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.5 p -69.11 -26.84 65.11 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 121.24 -0.913 . . . . 0.0 111.992 177.106 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 6.2 tmtt? -61.54 -51.01 70.38 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 119.54 1.064 . . . . 0.0 111.61 174.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 12.9 ttpt -62.26 -43.86 97.86 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.862 0.865 . . . . 0.0 111.385 176.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.34 -39.57 91.03 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 176.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 11.7 ttp85 -60.84 -54.24 47.51 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.733 1.213 . . . . 0.0 110.009 175.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 58.0 m-20 -71.73 -26.7 62.57 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 115.229 -0.896 . . . . 0.0 112.685 -175.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.22 -40.13 90.1 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 120.368 -1.458 . . . . 0.0 112.606 167.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 2.3 t -59.01 -33.83 71.17 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 122.695 1.236 . . . . 0.0 111.819 170.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 70.9 mt -76.53 -34.12 23.79 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 C-N-CA 124.619 1.168 . . . . 0.0 111.855 177.349 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 66.3 mt -64.63 -34.13 67.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 124.474 1.11 . . . . 0.0 111.734 167.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -70.79 -37.26 73.3 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 113.966 1.099 . . . . 0.0 113.966 174.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.2 mppt? -142.64 -60.65 0.44 Allowed 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 125.488 1.515 . . . . 0.0 113.488 -174.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 136.37 160.3 8.71 Favored Glycine 0 CA--C 1.531 1.072 0 C-N-CA 126.045 1.783 . . . . 0.0 109.374 -158.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.05 -29.53 63.04 Favored 'General case' 0 N--CA 1.466 0.325 0 O-C-N 120.786 -1.42 . . . . 0.0 112.934 -167.581 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.6 pt-20 -56.1 -31.45 63.27 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 123.2 0.6 . . . . 0.0 112.583 178.104 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -85.94 3.31 42.56 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.045 1.338 . . . . 0.0 113.188 177.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 4.6 m -147.08 17.84 1.22 Allowed 'General case' 0 N--CA 1.441 -0.903 0 C-N-CA 125.423 1.489 . . . . 0.0 112.881 -154.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -63.63 -30.95 79.15 Favored Glycine 0 C--O 1.215 -1.05 0 O-C-N 120.217 -1.552 . . . . 0.0 114.58 179.742 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 39.3 p-80 -53.36 -25.59 15.88 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 121.292 2.546 . . . . 0.0 113.944 168.38 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.85 -35.85 32.25 Favored 'General case' 0 C--N 1.341 0.196 0 C-N-CA 123.7 0.8 . . . . 0.0 111.138 172.266 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.417 HG22 ' HE2' ' A' ' 57' ' ' LYS . 34.4 mt -72.35 -37.43 58.15 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.444 0 CA-C-O 118.757 -0.64 . . . . 0.0 110.012 178.93 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.472 ' HG3' ' HE3' ' A' ' 57' ' ' LYS . 1.4 mp0 -67.17 -52.84 36.41 Favored 'General case' 0 N--CA 1.436 -1.157 0 C-N-CA 124.835 1.254 . . . . 0.0 112.818 176.665 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.41 -37.83 57.6 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 119.161 0.891 . . . . 0.0 112.95 174.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -72.52 -41.53 65.79 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 114.324 1.231 . . . . 0.0 114.324 173.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.472 ' HE3' ' HG3' ' A' ' 54' ' ' GLU . 23.7 mtmt -55.04 -52.62 62.61 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.942 1.297 . . . . 0.0 111.161 175.706 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -64.88 -38.44 90.97 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.408 0.683 . . . . 0.0 111.65 178.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 36.2 t -52.07 -60.69 2.9 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 118.284 -0.865 . . . . 0.0 111.741 169.458 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 79.3 mtm -49.64 -50.16 44.22 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 124.832 1.253 . . . . 0.0 111.474 172.437 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 22.3 mtt180 -53.11 -35.8 60.04 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 120.353 1.433 . . . . 0.0 114.133 -177.333 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -48.95 -37.03 18.86 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 119.272 0.942 . . . . 0.0 113.331 170.019 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 4.9 mp -82.87 8.74 11.62 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 125.154 1.381 . . . . 0.0 112.051 -172.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.53 22.55 43.19 Favored Glycine 0 CA--C 1.535 1.311 0 C-N-CA 124.931 1.253 . . . . 0.0 114.025 -179.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.508 ' C ' ' HE3' ' A' ' 66' ' ' LYS . 0.8 OUTLIER -84.49 153.67 23.19 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.494 1.518 . . . . 0.0 114.75 -163.265 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.508 ' HE3' ' C ' ' A' ' 65' ' ' PHE . 0.1 OUTLIER -94.97 81.34 3.71 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 126.441 1.897 . . . . 0.0 107.906 -174.32 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 29.4 mm . . . . . 0 C--O 1.245 0.862 0 C-N-CA 128.85 2.86 . . . . 0.0 108.896 -165.011 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 13.7 m . . . . . 0 CA--C 1.55 0.965 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -68.7 -17.64 42.51 Favored 'Trans proline' 0 CA--C 1.536 0.577 0 C-N-CA 123.13 2.554 . . . . 0.0 113.176 -161.395 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -88.17 -41.09 13.22 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.93 1.292 . . . . 0.0 112.493 -174.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.7 p -64.01 -33.22 75.26 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 120.89 -1.131 . . . . 0.0 110.833 158.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 5.1 tmtt? -59.04 -47.89 83.59 Favored 'General case' 0 N--CA 1.478 0.962 0 CA-C-N 120.727 1.603 . . . . 0.0 111.691 173.284 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 26.9 mttt -54.29 -49.97 68.4 Favored 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 126.022 1.729 . . . . 0.0 111.772 173.27 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.83 -35.05 76.5 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.452 0.701 . . . . 0.0 112.756 179.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 3.1 ttp180 -57.96 -55.5 34.15 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 124.728 1.211 . . . . 0.0 109.914 172.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -62.46 -39.45 93.42 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.444 1.098 . . . . 0.0 111.98 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.1 -41.8 97.33 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 113.207 0.818 . . . . 0.0 113.207 172.031 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.9 t -59.38 -36.16 75.26 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 122.496 1.141 . . . . 0.0 111.584 174.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 68.6 mt -73.09 -29.53 28.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 O-C-N 120.657 -1.277 . . . . 0.0 111.279 177.793 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 96.8 mt -69.29 -36.36 72.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.435 1.094 . . . . 0.0 112.005 168.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -67.49 -42.1 83.46 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 124.507 1.123 . . . . 0.0 113.716 178.29 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.85 -17.42 0.31 Allowed 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 116.923 2.194 . . . . 0.0 116.923 -171.504 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 95.74 164.65 34.26 Favored Glycine 0 CA--C 1.535 1.318 0 C-N-CA 123.933 0.778 . . . . 0.0 112.815 -167.685 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -69.23 -39.67 78.41 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 -165.287 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -55.73 -34.44 65.16 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.513 1.525 . . . . 0.0 113.769 175.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 78.0 m-70 -91.13 15.11 12.37 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.823 1.249 . . . . 0.0 112.306 -176.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 1.2 m -143.2 1.22 1.22 Allowed 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 115.73 1.752 . . . . 0.0 115.73 -166.034 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -51.46 -27.35 17.29 Favored Glycine 0 N--CA 1.473 1.11 0 CA-C-O 115.979 -2.567 . . . . 0.0 118.068 -163.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 34.3 p-80 -51.77 -35.12 42.52 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 121.798 2.799 . . . . 0.0 113.255 170.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.59 -40.48 76.65 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 125.722 1.609 . . . . 0.0 112.056 171.283 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.3 mp -70.74 -36.32 64.37 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 C-N-CA 120.488 -0.485 . . . . 0.0 110.497 178.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -73.53 -51.19 17.87 Favored 'General case' 0 N--CA 1.444 -0.759 0 C-N-CA 126.741 2.016 . . . . 0.0 112.32 -174.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -56.89 -37.93 72.08 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 121.453 0.644 . . . . 0.0 112.294 172.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 20.9 t60 -69.02 -49.87 53.81 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 113.113 0.782 . . . . 0.0 113.113 175.244 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 13.7 mtpp -46.43 -49.94 17.46 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 125.736 1.614 . . . . 0.0 111.378 170.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 60.4 mm-40 -58.29 -48.32 80.83 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 119.433 1.015 . . . . 0.0 112.357 174.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 24.5 t -55.33 -47.84 75.07 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 123.558 0.743 . . . . 0.0 112.682 178.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 12.4 mtp -62.54 -49.68 74.37 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.535 1.134 . . . . 0.0 110.532 169.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 18.1 mtp180 -56.3 -30.6 62.73 Favored 'General case' 0 C--N 1.34 0.164 0 O-C-N 119.601 -1.937 . . . . 0.0 114.139 -175.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -42.31 -35.43 0.99 Allowed 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.319 1.447 . . . . 0.0 113.9 168.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.0 mp -79.52 3.69 17.97 Favored 'General case' 0 CA--C 1.548 0.894 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 -171.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.95 20.82 38.12 Favored Glycine 0 CA--C 1.536 1.346 0 C-N-CA 125.598 1.57 . . . . 0.0 112.381 -168.208 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.452 ' C ' ' HE3' ' A' ' 66' ' ' LYS . 0.0 OUTLIER -94.85 158.93 15.27 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 126.482 1.913 . . . . 0.0 112.815 -161.368 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.452 ' HE3' ' C ' ' A' ' 65' ' ' PHE . 0.1 OUTLIER -116.0 106.52 13.87 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 125.925 1.69 . . . . 0.0 107.477 -174.41 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.246 0.889 0 C-N-CA 125.198 1.399 . . . . 0.0 111.046 -170.126 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 33.5 m . . . . . 0 CA--C 1.546 0.816 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -69.16 -18.67 39.71 Favored 'Trans proline' 0 N--CA 1.459 -0.526 0 C-N-CA 122.38 2.054 . . . . 0.0 111.499 -161.462 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -76.46 -47.7 22.12 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.821 1.248 . . . . 0.0 111.726 -179.515 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.7 p -65.82 -31.62 72.69 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 117.841 -1.076 . . . . 0.0 111.612 165.704 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.2 tmtp? -58.76 -50.83 72.49 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 120.509 1.504 . . . . 0.0 112.112 171.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 23.6 ttpt -54.72 -47.42 73.77 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 126.898 2.079 . . . . 0.0 112.12 175.025 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.77 -39.02 90.6 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 114.398 -1.274 . . . . 0.0 113.591 174.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 14.4 ttp85 -60.73 -53.29 59.21 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.625 1.57 . . . . 0.0 110.124 177.293 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -74.76 -30.65 61.55 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 115.364 -0.834 . . . . 0.0 111.836 -175.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.89 -39.38 81.25 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 120.531 -1.356 . . . . 0.0 112.698 165.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.9 t -59.41 -37.89 79.19 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.744 0.818 . . . . 0.0 111.825 175.083 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 72.3 mt -71.35 -35.52 57.77 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 C-N-CA 124.946 1.298 . . . . 0.0 111.145 176.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 86.0 mt -67.04 -31.54 53.84 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 C-N-CA 124.451 1.1 . . . . 0.0 112.127 171.09 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -78.84 -35.62 43.72 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.285 1.434 . . . . 0.0 114.486 178.107 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.2 mppt? -134.62 -59.8 0.8 Allowed 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 125.078 1.351 . . . . 0.0 112.788 176.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 139.08 173.94 13.26 Favored Glycine 0 CA--C 1.531 1.091 0 C-N-CA 126.09 1.805 . . . . 0.0 110.281 -160.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -78.94 -32.54 45.53 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 114.601 1.334 . . . . 0.0 114.601 -162.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -58.73 -34.7 71.65 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.834 1.254 . . . . 0.0 113.742 173.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -81.08 6.9 12.26 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.183 0.993 . . . . 0.0 112.942 -176.652 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 21.7 m -145.57 13.25 1.36 Allowed 'General case' 0 N--CA 1.437 -1.093 0 C-N-CA 124.053 0.941 . . . . 0.0 113.413 -154.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -67.88 -29.48 73.68 Favored Glycine 0 N--CA 1.469 0.864 0 O-C-N 119.791 -1.818 . . . . 0.0 115.605 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 29.6 p-80 -56.82 -30.58 63.88 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 120.208 2.004 . . . . 0.0 112.582 165.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.06 -34.96 59.6 Favored 'General case' 0 CA--C 1.522 -0.119 0 C-N-CA 124.054 0.942 . . . . 0.0 109.698 174.661 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 44.4 mt -72.99 -27.44 24.63 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 N-CA-C 110.554 -0.165 . . . . 0.0 110.554 177.567 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 67.3 mt-10 -89.1 -47.16 8.29 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 -169.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.42 -37.89 57.75 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-O 121.737 0.78 . . . . 0.0 112.124 165.208 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 14.1 t60 -68.43 -46.36 70.09 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 173.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 19.8 mtmt -51.75 -52.74 46.46 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.906 1.283 . . . . 0.0 110.918 177.047 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -61.47 -41.59 97.48 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.023 0.529 . . . . 0.0 112.333 178.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 23.7 t -54.59 -50.39 68.13 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 123.438 0.695 . . . . 0.0 112.83 173.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -58.03 -53.4 58.69 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 125.535 1.534 . . . . 0.0 110.34 170.259 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 74.6 mtt180 -55.32 -31.42 61.66 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 126.579 1.952 . . . . 0.0 114.39 -175.046 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -45.78 -34.74 3.86 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.791 1.237 . . . . 0.0 113.497 169.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.9 mp -81.22 3.8 22.54 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.733 1.213 . . . . 0.0 112.244 -173.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.94 11.81 67.14 Favored Glycine 0 CA--C 1.535 1.305 0 C-N-CA 125.22 1.39 . . . . 0.0 113.286 -169.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.4 ' C ' ' HE3' ' A' ' 66' ' ' LYS . 0.9 OUTLIER -70.16 151.51 45.33 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 126.317 1.847 . . . . 0.0 113.506 -176.659 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.4 ' HE3' ' C ' ' A' ' 65' ' ' PHE . 0.0 OUTLIER -111.39 93.66 4.58 Favored 'General case' 0 C--N 1.341 0.198 0 C-N-CA 126.366 1.866 . . . . 0.0 109.502 -170.488 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.247 0.923 0 C-N-CA 127.471 2.308 . . . . 0.0 109.602 -173.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 54.6 m . . . . . 0 CA--C 1.553 1.087 0 N-CA-C 113.704 1.001 . . . . 0.0 113.704 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -66.2 -31.9 43.7 Favored 'Trans proline' 0 CA--C 1.537 0.634 0 C-N-CA 123.696 2.931 . . . . 0.0 112.649 -168.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -39.98 -69.59 0.13 Allowed 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.598 1.959 . . . . 0.0 114.633 158.094 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.1 p -66.86 -28.55 68.43 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-O 117.636 -1.173 . . . . 0.0 111.935 176.184 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 12.1 tmtt? -57.25 -47.82 80.4 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 120.738 1.608 . . . . 0.0 112.163 176.001 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.5 mttp -83.86 -26.26 29.61 Favored 'General case' 0 CA--C 1.516 -0.34 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 -179.327 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.29 -41.46 97.0 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 123.343 0.402 . . . . 0.0 111.923 163.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 7.5 ttp85 -57.93 -53.53 57.18 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 125.505 1.522 . . . . 0.0 109.981 173.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 82.7 m-20 -69.32 -30.18 68.18 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 115.042 -0.981 . . . . 0.0 113.496 -175.093 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.53 -45.63 92.08 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 120.351 1.432 . . . . 0.0 111.96 168.495 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.3 t -55.75 -34.11 64.9 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.058 0.943 . . . . 0.0 111.296 171.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 69.2 mt -77.3 -35.89 23.15 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 O-C-N 120.404 -1.435 . . . . 0.0 112.068 178.743 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 87.5 mt -59.92 -36.5 67.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 124.315 1.046 . . . . 0.0 111.385 167.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -70.35 -45.74 65.52 Favored 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 124.352 1.061 . . . . 0.0 113.718 178.473 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.58 -13.81 0.67 Allowed 'General case' 0 N--CA 1.483 1.224 0 N-CA-C 116.936 2.198 . . . . 0.0 116.936 -169.689 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 89.39 165.95 41.48 Favored Glycine 0 CA--C 1.536 1.395 0 C-N-CA 124.893 1.235 . . . . 0.0 112.476 -163.064 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.4 -34.66 63.34 Favored 'General case' 0 N--CA 1.466 0.326 0 O-C-N 120.553 -1.557 . . . . 0.0 113.259 -168.727 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -55.94 -35.21 66.39 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 123.118 0.567 . . . . 0.0 112.414 -179.629 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 84.5 m-70 -86.3 9.47 17.72 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.732 1.613 . . . . 0.0 112.961 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 1.3 m -143.0 9.19 1.7 Allowed 'General case' 0 N--CA 1.443 -0.825 0 C-N-CA 124.95 1.3 . . . . 0.0 113.895 -166.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -55.26 -22.21 28.95 Favored Glycine 0 C--O 1.215 -1.054 0 CA-C-O 117.041 -1.977 . . . . 0.0 117.656 -169.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 33.4 p-80 -54.46 -36.71 64.38 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 121.952 2.876 . . . . 0.0 113.145 167.207 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -70.73 -37.33 73.49 Favored 'General case' 0 N--CA 1.462 0.127 0 C-N-CA 125.332 1.453 . . . . 0.0 111.627 172.319 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 2.6 mp -71.12 -38.23 70.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 CA-C-N 118.912 0.778 . . . . 0.0 110.427 177.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.65 -53.66 21.12 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 125.393 1.477 . . . . 0.0 111.787 -173.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -57.88 -36.24 72.1 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-O 121.799 0.809 . . . . 0.0 112.755 175.7 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 15.4 t60 -68.48 -47.44 67.07 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.865 0.866 . . . . 0.0 112.775 175.028 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 31.1 mtpt -51.46 -49.14 62.34 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.53 1.132 . . . . 0.0 111.58 172.067 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -61.57 -46.5 89.62 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 124.215 1.006 . . . . 0.0 112.491 175.361 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 42.4 t -51.58 -52.65 45.61 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.073 0.949 . . . . 0.0 112.08 175.347 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 76.2 mtm -57.89 -48.93 78.41 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.913 0.885 . . . . 0.0 111.457 170.5 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.2 mtt-85 -58.47 -29.17 65.99 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 120.518 1.508 . . . . 0.0 114.205 -171.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -45.94 -35.22 4.47 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.22 1.008 . . . . 0.0 113.61 167.685 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.6 mp -81.95 6.65 15.31 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.221 1.008 . . . . 0.0 112.945 -170.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.07 27.07 42.01 Favored Glycine 0 CA--C 1.533 1.207 0 C-N-CA 124.722 1.153 . . . . 0.0 112.29 -169.084 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -89.35 167.59 12.91 Favored 'General case' 0 N--CA 1.461 0.109 0 CA-C-O 123.694 1.711 . . . . 0.0 113.426 -171.623 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 16.0 ptpt -128.96 44.35 2.99 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 113.468 -1.696 . . . . 0.0 112.725 -136.04 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.917 0 C-N-CA 130.413 3.485 . . . . 0.0 109.593 -163.216 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 43.5 m . . . . . 0 CA--C 1.549 0.927 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -74.83 -22.41 15.25 Favored 'Trans proline' 0 CA--C 1.54 0.785 0 C-N-CA 122.778 2.318 . . . . 0.0 112.446 -171.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -66.41 -52.86 42.18 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.209 1.404 . . . . 0.0 112.767 174.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.1 p -65.4 -30.33 71.13 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 120.967 -1.083 . . . . 0.0 111.375 170.025 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 8.2 tmtt? -57.66 -49.02 77.87 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 120.378 1.445 . . . . 0.0 112.426 169.716 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 48.1 tttt -54.5 -50.58 67.48 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 125.922 1.689 . . . . 0.0 111.159 174.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.97 -42.05 97.37 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 114.853 -1.067 . . . . 0.0 112.962 179.727 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 9.1 ttp85 -60.12 -51.97 67.33 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 125.102 1.361 . . . . 0.0 110.371 177.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 25.0 m-20 -72.31 -29.99 64.36 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 115.771 -0.65 . . . . 0.0 112.553 -175.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.91 -37.0 85.77 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 120.821 -1.175 . . . . 0.0 113.131 167.124 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.8 t -60.39 -39.76 88.49 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 121.053 -1.029 . . . . 0.0 111.651 168.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 73.7 mt -72.02 -29.95 34.82 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 O-C-N 121.001 -1.062 . . . . 0.0 111.468 -177.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 60.1 mt -58.01 -43.05 84.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 123.38 0.672 . . . . 0.0 111.489 163.591 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.9 -41.97 97.57 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.069 1.137 . . . . 0.0 114.069 -178.207 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -153.48 -9.34 0.16 Allowed 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 116.992 2.219 . . . . 0.0 116.992 -166.487 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 83.58 159.57 28.55 Favored Glycine 0 CA--C 1.53 1.017 0 CA-C-N 119.179 0.9 . . . . 0.0 112.895 -164.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.53 -28.72 68.05 Favored 'General case' 0 N--CA 1.463 0.181 0 O-C-N 121.147 -1.207 . . . . 0.0 112.728 -169.564 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -58.41 -24.42 59.99 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.911 0.885 . . . . 0.0 113.258 177.018 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -104.21 11.97 34.33 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 120.345 1.429 . . . . 0.0 111.117 178.137 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 1.7 m -139.67 18.09 2.52 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 126.768 2.027 . . . . 0.0 113.051 -162.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -63.81 -29.69 75.52 Favored Glycine 0 C--O 1.216 -1.001 0 CA-C-O 116.622 -2.21 . . . . 0.0 114.883 -175.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 41.0 p-80 -56.42 -24.75 47.26 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 120.358 2.079 . . . . 0.0 113.632 168.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -82.72 -33.63 27.47 Favored 'General case' 0 C--N 1.341 0.203 0 O-C-N 121.515 -0.74 . . . . 0.0 110.78 171.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 51.5 mt -75.11 -35.22 33.94 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-O 119.196 -0.43 . . . . 0.0 110.628 -179.18 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -67.84 -55.49 12.76 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 127.119 2.168 . . . . 0.0 110.94 -177.301 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.74 -40.76 72.96 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 173.138 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 13.6 t60 -66.3 -46.48 76.8 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 120.992 -1.067 . . . . 0.0 113.089 175.38 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 21.4 mtpp -54.06 -49.0 69.99 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.146 0.978 . . . . 0.0 111.269 172.658 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -61.74 -43.39 98.95 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 118.155 -0.926 . . . . 0.0 112.435 175.322 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 42.8 t -50.74 -58.2 6.47 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 119.016 0.825 . . . . 0.0 111.11 173.002 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 75.6 mtm -55.93 -45.89 78.62 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.203 0.601 . . . . 0.0 110.486 174.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 8.8 mtt-85 -58.91 -29.25 66.92 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 120.77 1.623 . . . . 0.0 115.232 -177.035 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -50.25 -31.32 13.79 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 118.9 0.773 . . . . 0.0 112.668 169.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.9 mp -85.21 26.74 0.85 Allowed 'General case' 0 CA--C 1.546 0.81 0 CA-C-O 122.732 1.253 . . . . 0.0 112.327 -172.195 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 68.09 30.1 73.75 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 127.156 2.312 . . . . 0.0 113.034 -174.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -102.35 170.35 8.12 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-O 124.03 1.871 . . . . 0.0 115.959 -148.578 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 13.0 ptpt -119.81 69.53 0.84 Allowed 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 124.1 1.905 . . . . 0.0 111.625 -152.273 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 17.8 mm . . . . . 0 C--O 1.254 1.313 0 CA-C-N 108.472 -3.967 . . . . 0.0 112.16 -147.72 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 64.9 m . . . . . 0 CA--C 1.55 0.962 0 N-CA-C 113.928 1.085 . . . . 0.0 113.928 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -63.68 -29.08 69.16 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 123.873 3.049 . . . . 0.0 112.63 -168.036 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -39.37 -72.19 0.07 Allowed 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.688 2.395 . . . . 0.0 115.753 156.299 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -68.72 -24.77 64.51 Favored 'General case' 0 N--CA 1.475 0.815 0 O-C-N 121.029 -1.044 . . . . 0.0 112.169 176.222 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 8.8 tmtt? -60.37 -43.74 96.28 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 120.419 1.463 . . . . 0.0 111.124 172.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 62.5 tttt -58.84 -49.74 76.58 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.858 1.263 . . . . 0.0 111.677 173.169 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.56 -37.17 86.29 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.332 -0.849 . . . . 0.0 112.739 178.131 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 6.6 ttp85 -59.35 -56.48 21.56 Favored 'General case' 0 C--O 1.223 -0.299 0 C-N-CA 125.619 1.568 . . . . 0.0 109.842 175.15 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -69.61 -27.4 65.05 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 115.315 -0.857 . . . . 0.0 112.572 -176.4 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.35 -44.31 91.85 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 120.768 -1.207 . . . . 0.0 112.971 166.356 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -57.76 -31.7 66.75 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 122.454 1.121 . . . . 0.0 111.57 171.964 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 72.3 mt -77.27 -34.33 21.07 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 O-C-N 120.524 -1.36 . . . . 0.0 111.726 177.259 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 70.2 mt -61.92 -34.72 64.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.2 1.0 . . . . 0.0 111.659 167.193 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -70.13 -43.03 71.79 Favored 'General case' 0 CA--C 1.556 1.181 0 N-CA-C 114.12 1.155 . . . . 0.0 114.12 177.104 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.87 -11.71 0.28 Allowed 'General case' 0 N--CA 1.485 1.297 0 N-CA-C 117.828 2.529 . . . . 0.0 117.828 -171.049 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 90.03 162.34 38.25 Favored Glycine 0 CA--C 1.536 1.36 0 CA-C-N 119.612 1.096 . . . . 0.0 112.663 -163.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.43 -34.99 68.22 Favored 'General case' 0 N--CA 1.465 0.3 0 O-C-N 120.707 -1.467 . . . . 0.0 113.422 -168.687 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -56.15 -34.9 66.56 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.765 0.826 . . . . 0.0 112.612 178.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 79.5 m-70 -90.21 12.15 18.93 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.698 1.599 . . . . 0.0 112.686 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -145.72 11.67 1.27 Allowed 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 124.954 1.302 . . . . 0.0 114.11 -169.286 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -53.73 -26.18 31.64 Favored Glycine 0 N--CA 1.472 1.038 0 CA-C-O 116.354 -2.359 . . . . 0.0 116.879 -169.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 37.1 p-80 -52.56 -33.67 46.79 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 120.997 2.399 . . . . 0.0 113.143 170.147 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -74.16 -38.5 63.69 Favored 'General case' 0 CA--C 1.522 -0.114 0 C-N-CA 125.117 1.367 . . . . 0.0 112.364 171.521 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 2.8 mp -67.91 -34.53 67.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 119.964 -0.695 . . . . 0.0 110.906 175.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -74.38 -53.63 9.23 Favored 'General case' 0 N--CA 1.44 -0.957 0 C-N-CA 125.28 1.432 . . . . 0.0 111.557 -176.211 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.23 -38.39 65.68 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.541 -0.724 . . . . 0.0 112.383 175.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 17.1 t60 -67.25 -49.81 62.97 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.593 1.157 . . . . 0.0 113.504 173.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -48.19 -49.78 31.51 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.632 1.573 . . . . 0.0 112.405 177.326 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -69.36 -39.81 77.86 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.366 0.666 . . . . 0.0 112.053 -176.214 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 48.8 t -50.13 -51.58 42.15 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 123.528 0.731 . . . . 0.0 112.493 167.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 36.0 mtp -57.95 -51.79 68.2 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.118 1.367 . . . . 0.0 110.787 172.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 45.9 mtt180 -54.9 -29.84 56.92 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 126.097 1.759 . . . . 0.0 114.392 -177.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -48.06 -22.06 0.56 Allowed 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 114.793 1.405 . . . . 0.0 114.793 168.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.8 mp -95.85 1.89 53.37 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.662 1.585 . . . . 0.0 112.186 -173.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 86.76 15.04 64.08 Favored Glycine 0 CA--C 1.535 1.33 0 C-N-CA 124.744 1.164 . . . . 0.0 113.07 -169.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -71.73 141.06 49.79 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 126.576 1.95 . . . . 0.0 111.524 -179.167 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -101.2 93.71 5.59 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.332 1.453 . . . . 0.0 108.344 -178.31 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.126 0 C-N-CA 127.544 2.338 . . . . 0.0 109.313 -177.683 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 21.3 m . . . . . 0 CA--C 1.549 0.92 0 N-CA-C 114.227 1.195 . . . . 0.0 114.227 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -66.9 -11.47 32.27 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 123.149 2.566 . . . . 0.0 112.695 -166.24 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 38.0 mm-40 -88.02 -41.56 13.02 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.468 1.507 . . . . 0.0 112.44 -177.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -64.0 -35.31 80.28 Favored 'General case' 0 N--CA 1.48 1.049 0 O-C-N 120.635 -1.291 . . . . 0.0 110.674 158.297 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.443 ' HE2' ' OD2' ' A' ' 38' ' ' ASP . 17.3 tttt -59.82 -42.6 93.88 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 119.484 1.038 . . . . 0.0 112.656 175.475 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.4 mttt -55.43 -50.01 70.93 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 125.513 1.525 . . . . 0.0 110.552 176.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.46 -34.34 76.97 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.83 0.852 . . . . 0.0 113.018 174.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 4.3 ttp180 -59.48 -54.89 41.42 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.892 1.277 . . . . 0.0 109.943 176.568 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.443 ' OD2' ' HE2' ' A' ' 34' ' ' LYS . 84.2 m-20 -74.46 -28.69 61.14 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.526 1.13 . . . . 0.0 111.596 -175.4 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.01 -39.95 94.01 Favored 'General case' 0 CA--C 1.547 0.834 0 O-C-N 120.637 -1.289 . . . . 0.0 113.356 163.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.6 t -59.64 -34.07 72.33 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.007 -1.058 . . . . 0.0 111.435 173.467 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 91.4 mt -71.85 -35.14 53.71 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 O-C-N 120.62 -1.3 . . . . 0.0 111.183 176.172 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 87.6 mt -63.79 -35.45 73.14 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 124.05 0.94 . . . . 0.0 111.985 169.503 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -69.95 -43.62 71.2 Favored 'General case' 0 CA--C 1.556 1.21 0 N-CA-C 114.053 1.131 . . . . 0.0 114.053 177.611 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.51 -15.26 0.38 Allowed 'General case' 0 N--CA 1.485 1.31 0 N-CA-C 116.874 2.176 . . . . 0.0 116.874 -170.147 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 92.55 164.31 38.05 Favored Glycine 0 CA--C 1.536 1.36 0 CA-C-O 122.153 0.863 . . . . 0.0 113.148 -165.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -68.89 -41.99 77.56 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 -164.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -55.7 -34.83 65.44 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.771 1.228 . . . . 0.0 113.804 175.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 68.8 m-70 -87.64 12.23 13.13 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.561 1.145 . . . . 0.0 112.342 -176.592 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 1.2 m -141.41 2.59 1.66 Allowed 'General case' 0 N--CA 1.438 -1.064 0 C-N-CA 124.739 1.216 . . . . 0.0 114.163 -167.315 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -54.23 -21.16 17.94 Favored Glycine 0 N--CA 1.474 1.181 0 N-CA-C 118.136 2.014 . . . . 0.0 118.136 -167.427 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 30.1 p-80 -55.32 -36.79 66.6 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 121.72 2.76 . . . . 0.0 113.41 166.5 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.2 -41.6 85.54 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 125.377 1.471 . . . . 0.0 111.072 170.699 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 2.8 mp -70.04 -39.44 77.29 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 CA-C-N 118.73 0.695 . . . . 0.0 109.708 -178.683 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.08 -51.73 50.75 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 125.461 1.504 . . . . 0.0 112.62 -177.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.55 -38.58 84.95 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.479 0.657 . . . . 0.0 112.413 176.588 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 21.0 t60 -65.31 -48.29 73.59 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.648 0.779 . . . . 0.0 112.759 173.638 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 35.2 mtpt -52.11 -47.69 65.17 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.607 1.163 . . . . 0.0 112.617 171.833 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -57.74 -44.77 86.26 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.461 1.028 . . . . 0.0 112.375 172.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 38.1 t -56.09 -50.07 72.06 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 118.681 0.673 . . . . 0.0 112.299 175.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 71.8 mtm -59.06 -50.92 72.24 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 121.291 -0.88 . . . . 0.0 111.013 171.358 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 15.9 mtt180 -55.82 -30.89 62.12 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 126.068 1.747 . . . . 0.0 113.743 -174.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -44.66 -34.84 2.35 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.702 1.201 . . . . 0.0 113.749 168.304 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.1 mp -81.26 8.86 7.99 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 123.992 0.917 . . . . 0.0 112.744 -173.177 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 75.87 22.06 75.22 Favored Glycine 0 CA--C 1.533 1.194 0 C-N-CA 125.54 1.543 . . . . 0.0 112.408 -167.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -78.06 129.25 35.0 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 126.354 1.862 . . . . 0.0 110.974 -172.427 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.4 mppt? -82.6 78.92 9.16 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.476 1.51 . . . . 0.0 109.391 -178.089 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.247 0.934 0 C-N-CA 125.898 1.679 . . . . 0.0 109.731 -176.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.414 0 N-CA-C 107.573 -2.211 . . . . 0.0 107.573 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.2 m 52.37 -157.78 0.14 Allowed 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 118.932 1.366 . . . . 0.0 110.622 -153.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -51.04 132.72 27.71 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 119.714 1.143 . . . . 0.0 111.002 170.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 4.5 m -146.17 148.25 32.36 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.108 0.963 . . . . 0.0 109.3 -174.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 29.7 tpp -126.18 73.63 72.13 Favored Pre-proline 0 N--CA 1.471 0.583 0 C-N-CA 124.497 1.119 . . . . 0.0 110.744 176.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_endo -72.57 27.18 0.28 Allowed 'Trans proline' 0 CA--C 1.549 1.26 0 C-N-CA 124.273 3.315 . . . . 0.0 114.414 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -114.8 -64.75 0.41 Allowed Glycine 0 CA--C 1.531 1.091 0 CA-C-N 118.906 0.775 . . . . 0.0 113.618 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.3 mm? 53.75 -174.38 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.876 1.27 . . . . 0.0 113.513 -169.303 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 14.3 p -159.02 117.77 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 C-N-CA 125.369 1.468 . . . . 0.0 109.839 174.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -155.82 176.03 13.16 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 126.831 2.052 . . . . 0.0 111.081 -173.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 57.7 m -80.42 161.76 24.78 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.925 0.89 . . . . 0.0 112.935 176.27 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 21.0 p-10 -129.96 74.43 80.58 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 126.472 1.909 . . . . 0.0 110.742 -173.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_endo -81.57 -174.15 2.07 Favored 'Trans proline' 0 CA--C 1.543 0.943 0 C-N-CA 124.419 3.413 . . . . 0.0 113.04 -173.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -147.49 154.6 45.2 Favored Pre-proline 0 CA--C 1.549 0.937 0 C-N-CA 125.096 1.359 . . . . 0.0 112.112 174.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -64.1 162.49 29.37 Favored 'Trans proline' 0 CA--C 1.554 1.48 0 C-N-CA 124.538 3.492 . . . . 0.0 117.79 -171.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -88.21 -170.3 0.52 Allowed 'Trans proline' 0 CA--C 1.546 1.107 1 C-N-CA 126.161 4.574 . . . . 0.0 115.607 -177.152 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -46.75 105.88 0.07 Allowed 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.128 0.971 . . . . 0.0 112.064 157.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 35.7 m -173.77 103.76 0.12 Allowed 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 126.403 1.881 . . . . 0.0 113.24 163.166 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.32 39.62 0.83 Allowed 'General case' 0 CA--C 1.545 0.771 0 CA-C-O 122.149 0.976 . . . . 0.0 108.613 148.3 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -156.64 -162.85 1.32 Allowed 'General case' 0 CA--C 1.54 0.562 0 O-C-N 120.607 -1.308 . . . . 0.0 111.891 -146.164 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 7.3 mmtt -140.25 -0.88 1.58 Allowed 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 118.557 2.799 . . . . 0.0 118.557 -174.314 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.7 mtpm? -51.37 163.52 0.56 Allowed Pre-proline 0 N--CA 1.474 0.742 0 C-N-CA 128.462 2.705 . . . . 0.0 114.51 170.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -76.23 177.69 8.46 Favored 'Trans proline' 0 N--CA 1.453 -0.892 0 C-N-CA 122.258 1.972 . . . . 0.0 110.993 166.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.472 ' CD2' ' H ' ' A' ' 25' ' ' LYS . 0.5 OUTLIER -132.94 165.17 25.31 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 114.715 -1.13 . . . . 0.0 111.369 174.658 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.472 ' H ' ' CD2' ' A' ' 24' ' ' LEU . 0.6 OUTLIER -114.88 138.3 23.29 Favored Pre-proline 0 N--CA 1.47 0.565 0 C-N-CA 127.451 2.301 . . . . 0.0 107.223 -172.318 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo -79.16 -14.5 13.35 Favored 'Trans proline' 0 CA--C 1.548 1.211 0 C-N-CA 122.774 2.316 . . . . 0.0 112.449 -171.184 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 20.1 p -74.76 -21.6 59.25 Favored 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 126.42 1.888 . . . . 0.0 112.713 165.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 50.0 m -115.18 -31.16 6.1 Favored 'General case' 0 CA--C 1.554 1.113 0 N-CA-C 116.069 1.877 . . . . 0.0 116.069 -172.004 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.88 160.52 23.15 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.057 -1.027 . . . . 0.0 110.55 -178.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 38.7 m 42.4 50.37 5.2 Favored Pre-proline 0 CA--C 1.553 1.085 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 -178.064 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.6 -24.67 30.16 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.429 2.752 . . . . 0.0 112.309 -158.331 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -63.07 -48.3 79.25 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.458 1.903 . . . . 0.0 113.789 169.219 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.48 -34.27 74.1 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 119.483 1.038 . . . . 0.0 111.732 168.707 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 7.0 tmtt? -58.8 -45.49 89.79 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.895 1.278 . . . . 0.0 112.211 173.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 72.6 tttt -55.51 -51.22 67.73 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 126.427 1.891 . . . . 0.0 111.422 172.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.05 -37.97 89.36 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 114.796 -1.093 . . . . 0.0 112.641 178.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 10.2 ttp85 -59.94 -57.25 13.66 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.767 1.227 . . . . 0.0 110.178 174.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 62.0 m-20 -69.18 -29.74 67.79 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.163 0.985 . . . . 0.0 112.67 -175.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.61 -41.41 96.22 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 120.542 -1.349 . . . . 0.0 112.35 168.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.8 t -57.67 -34.53 69.49 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 122.21 1.005 . . . . 0.0 111.76 172.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 64.3 mt -77.11 -33.76 20.75 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 C-N-CA 125.182 1.393 . . . . 0.0 112.257 178.429 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 74.0 mt -64.99 -34.97 74.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 124.052 0.941 . . . . 0.0 111.395 168.365 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -72.92 -36.03 67.17 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 114.54 1.311 . . . . 0.0 114.54 177.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -139.24 -58.64 0.59 Allowed 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 125.078 1.351 . . . . 0.0 113.788 175.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 139.79 161.93 8.91 Favored Glycine 0 CA--C 1.53 1.003 0 C-N-CA 126.278 1.894 . . . . 0.0 109.558 -159.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -73.45 -28.49 61.99 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 120.993 -1.298 . . . . 0.0 112.928 -169.102 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -55.98 -33.67 65.03 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 123.501 0.72 . . . . 0.0 112.444 177.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -85.81 5.82 30.89 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.989 1.316 . . . . 0.0 113.067 178.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 6.1 m -148.22 16.05 1.04 Allowed 'General case' 0 N--CA 1.441 -0.887 0 C-N-CA 125.307 1.443 . . . . 0.0 113.094 -154.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -65.84 -27.83 73.1 Favored Glycine 0 C--O 1.213 -1.173 0 O-C-N 120.19 -1.568 . . . . 0.0 114.658 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 41.6 p-80 -56.54 -25.18 51.19 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 120.666 2.233 . . . . 0.0 113.933 166.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.85 -34.57 30.06 Favored 'General case' 0 C--O 1.231 0.113 0 C-N-CA 123.837 0.855 . . . . 0.0 110.664 172.551 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 33.2 mt -70.43 -40.38 77.49 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.598 0 CA-C-O 118.72 -0.657 . . . . 0.0 109.711 177.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.54 -50.74 49.66 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 125.004 1.322 . . . . 0.0 111.912 -175.647 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.99 -37.47 66.6 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 121.152 -0.968 . . . . 0.0 113.006 173.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 14.5 t60 -72.45 -44.26 62.61 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.508 1.123 . . . . 0.0 113.901 174.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.86 -54.75 25.53 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.769 1.628 . . . . 0.0 110.956 175.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -72.18 -33.85 67.98 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 122.773 0.429 . . . . 0.0 111.692 -174.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 48.8 t -48.51 -60.45 2.68 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-O 118.505 -0.76 . . . . 0.0 112.3 162.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 78.3 mtm -52.66 -45.61 66.83 Favored 'General case' 0 N--CA 1.486 1.331 0 CA-C-N 120.027 1.285 . . . . 0.0 111.388 171.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 2.4 ttt85 -51.91 -39.03 58.42 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 114.378 1.251 . . . . 0.0 114.378 -175.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -47.33 -36.24 9.16 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.619 1.167 . . . . 0.0 113.25 172.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.7 mp -82.65 9.57 9.26 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 125.209 1.404 . . . . 0.0 111.658 -172.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.53 40.82 5.59 Favored Glycine 0 CA--C 1.532 1.138 0 C-N-CA 125.046 1.307 . . . . 0.0 113.274 177.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -112.28 143.65 43.01 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 121.507 -0.996 . . . . 0.0 112.273 -151.009 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? -92.54 79.87 4.86 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 125.8 1.64 . . . . 0.0 108.805 -173.306 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 39.2 mm . . . . . 0 CA--C 1.552 1.039 0 C-N-CA 128.81 2.844 . . . . 0.0 110.604 -161.487 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.26 0 N-CA-C 107.886 -2.085 . . . . 0.0 107.886 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.6 m -148.96 162.45 39.86 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 118.154 0.977 . . . . 0.0 110.875 -163.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 22.4 t80 -148.77 171.38 16.34 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.126 0.97 . . . . 0.0 110.458 169.704 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 15.3 m 64.95 -31.36 0.13 Allowed 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 127.411 2.284 . . . . 0.0 116.099 179.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 4.0 mpp? 38.02 54.42 3.95 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 127.398 2.279 . . . . 0.0 114.879 179.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -74.39 29.73 0.34 Allowed 'Trans proline' 0 CA--C 1.549 1.264 0 C-N-CA 124.153 3.235 . . . . 0.0 114.134 -176.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 171.08 -34.46 0.16 Allowed Glycine 0 CA--C 1.531 1.081 0 O-C-N 120.928 -1.107 . . . . 0.0 114.584 174.42 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . 0.259 0.9 OUTLIER 38.05 32.12 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 118.513 2.783 . . . . 0.0 118.513 172.497 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 97.8 t -40.96 133.23 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 126.172 1.789 . . . . 0.0 111.0 163.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . 0.284 1.1 m-20 43.85 25.95 0.12 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 127.885 2.474 . . . . 0.0 116.777 -178.673 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 28.2 t -53.83 -32.65 53.64 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.635 1.174 . . . . 0.0 112.789 160.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -164.41 68.92 1.51 Allowed Pre-proline 0 CA--C 1.556 1.174 0 C-N-CA 125.13 1.372 . . . . 0.0 112.137 -172.64 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -77.44 -177.97 4.24 Favored 'Trans proline' 0 CA--C 1.542 0.916 0 C-N-CA 124.503 3.469 . . . . 0.0 111.89 178.191 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -140.65 159.38 63.02 Favored Pre-proline 0 CA--C 1.545 0.776 0 C-N-CA 124.937 1.295 . . . . 0.0 112.679 -174.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -69.1 157.69 60.71 Favored 'Trans proline' 0 CA--C 1.546 1.107 0 C-N-CA 123.002 2.468 . . . . 0.0 112.972 171.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -77.23 177.83 8.39 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 123.672 2.915 . . . . 0.0 112.799 171.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.0 tp10 -84.0 152.47 24.42 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 122.134 0.969 . . . . 0.0 111.86 168.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 21.9 m -177.18 -38.15 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 129.986 3.314 . . . . 0.0 109.479 159.387 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 51.07 159.44 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 131.24 3.816 . . . . 0.0 117.785 170.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.469 ' CD ' ' HZ2' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -65.17 -175.18 0.2 Allowed 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 123.933 1.825 . . . . 0.0 111.458 158.5 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 34.8 mmtm -137.85 74.05 1.46 Allowed 'General case' 0 N--CA 1.438 -1.065 0 C-N-CA 128.591 2.757 . . . . 0.0 106.851 -171.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.469 ' HZ2' ' CD ' ' A' ' 20' ' ' GLU . 31.3 mmtm -149.04 164.78 19.71 Favored Pre-proline 0 N--CA 1.475 0.793 0 C-N-CA 126.3 1.84 . . . . 0.0 113.21 -158.38 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -70.45 175.37 8.76 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 121.513 1.475 . . . . 0.0 111.747 166.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.408 ' CD2' ' H ' ' A' ' 25' ' ' LYS . 0.6 OUTLIER -139.42 160.12 40.57 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.941 0.897 . . . . 0.0 112.325 178.223 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.408 ' H ' ' CD2' ' A' ' 24' ' ' LEU . 0.3 OUTLIER -108.07 142.72 25.88 Favored Pre-proline 0 C--O 1.224 -0.276 0 C-N-CA 126.424 1.89 . . . . 0.0 107.314 -175.572 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_endo -77.87 -11.07 16.77 Favored 'Trans proline' 0 CA--C 1.55 1.306 0 C-N-CA 122.227 1.951 . . . . 0.0 112.413 -172.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 29.5 p -90.53 -18.0 26.05 Favored 'General case' 0 CA--C 1.556 1.199 0 C-N-CA 125.992 1.717 . . . . 0.0 112.047 171.355 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.403 ' SG ' ' NZ ' ' A' ' 25' ' ' LYS . 76.3 m -105.82 -31.54 8.79 Favored 'General case' 0 CA--C 1.556 1.191 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 177.505 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.11 162.68 21.78 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.997 1.319 . . . . 0.0 110.173 178.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 28.5 m 38.77 50.97 2.82 Favored Pre-proline 0 CA--C 1.55 0.949 0 C-N-CA 124.02 0.928 . . . . 0.0 112.926 178.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.12 -17.2 36.06 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.521 2.148 . . . . 0.0 112.47 -156.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -82.87 -38.78 22.47 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.575 1.55 . . . . 0.0 112.019 -178.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.2 p -71.06 -31.43 67.84 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 121.055 -1.028 . . . . 0.0 111.51 161.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 10.3 tmtt? -59.15 -47.54 84.9 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 120.096 1.316 . . . . 0.0 111.785 172.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 44.2 mttt -52.81 -51.94 58.88 Favored 'General case' 0 C--O 1.225 -0.217 0 C-N-CA 126.901 2.08 . . . . 0.0 111.823 171.179 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.08 -37.17 83.51 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -179.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 13.1 ttp85 -59.45 -55.33 36.06 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 124.709 1.203 . . . . 0.0 109.865 174.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -72.4 -29.41 63.71 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 115.414 -0.812 . . . . 0.0 112.41 -174.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.88 -44.65 96.38 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 120.795 -1.19 . . . . 0.0 112.039 165.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.0 t -55.96 -34.61 65.85 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 122.275 1.036 . . . . 0.0 111.678 173.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 66.6 mt -76.42 -32.46 21.73 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 125.274 1.43 . . . . 0.0 112.613 178.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 83.4 mt -66.59 -38.33 81.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 123.878 0.871 . . . . 0.0 110.868 167.273 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -72.03 -38.82 69.48 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 114.49 1.292 . . . . 0.0 114.49 -179.376 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.7 mppt? -137.77 -33.84 0.7 Allowed 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 115.993 1.849 . . . . 0.0 115.993 -177.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 101.79 156.7 26.44 Favored Glycine 0 CA--C 1.532 1.149 0 C-N-CA 124.605 1.098 . . . . 0.0 111.738 -157.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -69.96 -27.68 64.93 Favored 'General case' 0 N--CA 1.466 0.367 0 O-C-N 121.148 -1.207 . . . . 0.0 113.059 -166.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -56.12 -27.59 54.54 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 123.725 0.81 . . . . 0.0 112.843 176.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -96.3 8.72 43.21 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.368 1.067 . . . . 0.0 112.847 177.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 3.7 m -146.83 17.58 1.26 Allowed 'General case' 0 N--CA 1.443 -0.811 0 C-N-CA 125.547 1.539 . . . . 0.0 112.407 -155.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -68.77 -25.72 74.99 Favored Glycine 0 C--O 1.217 -0.935 0 CA-C-O 116.918 -2.046 . . . . 0.0 114.905 -177.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 38.9 p-80 -56.07 -28.52 57.91 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 120.016 1.908 . . . . 0.0 112.978 165.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.42 -34.8 35.9 Favored 'General case' 0 C--N 1.34 0.172 0 C-N-CA 123.856 0.862 . . . . 0.0 110.459 175.016 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 36.1 mt -69.76 -40.75 79.5 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.663 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 176.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -64.52 -52.43 57.82 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 125.625 1.57 . . . . 0.0 111.173 179.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.25 -40.04 58.0 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 113.453 0.909 . . . . 0.0 113.453 174.342 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 11.2 t60 -71.19 -42.79 68.57 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 114.193 1.182 . . . . 0.0 114.193 173.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.32 -52.5 65.11 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.737 1.215 . . . . 0.0 111.978 177.147 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -69.54 -33.94 73.5 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 123.145 0.578 . . . . 0.0 111.318 -176.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 48.7 t -49.35 -60.97 2.36 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-O 118.62 -0.705 . . . . 0.0 111.795 161.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 78.9 mtm -54.13 -45.14 71.86 Favored 'General case' 0 N--CA 1.483 1.217 0 CA-C-N 120.03 1.286 . . . . 0.0 112.712 175.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 47.8 mtt180 -52.18 -35.31 48.65 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 121.028 1.74 . . . . 0.0 113.976 -179.234 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -47.74 -40.12 19.61 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 113.908 1.077 . . . . 0.0 113.908 168.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 4.0 mp -82.75 10.2 8.13 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 126.458 1.903 . . . . 0.0 112.029 -172.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.84 30.83 13.73 Favored Glycine 0 CA--C 1.535 1.333 0 C-N-CA 124.732 1.158 . . . . 0.0 114.348 176.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.438 ' C ' ' HE3' ' A' ' 66' ' ' LYS . 0.3 OUTLIER -100.14 152.36 20.35 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.793 1.237 . . . . 0.0 114.105 -154.3 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.438 ' HE3' ' C ' ' A' ' 65' ' ' PHE . 0.4 OUTLIER -92.39 75.96 5.2 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 125.866 1.666 . . . . 0.0 108.955 -174.905 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 28.5 mm . . . . . 0 C--O 1.249 1.059 0 C-N-CA 127.798 2.439 . . . . 0.0 111.113 -158.321 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.28 0 N-CA-C 108.778 -1.729 . . . . 0.0 108.778 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.2 t -148.02 179.3 7.84 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 125.793 1.637 . . . . 0.0 108.034 165.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 43.7 m-85 -133.2 147.63 52.02 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.235 1.014 . . . . 0.0 110.595 -169.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 3.0 m -148.35 -40.11 0.17 Allowed 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.262 0.625 . . . . 0.0 112.673 -176.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 1.3 mpt? 31.13 51.71 0.55 Allowed Pre-proline 0 CA--C 1.555 1.166 0 C-N-CA 128.318 2.647 . . . . 0.0 116.96 170.439 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -69.99 13.07 0.32 Allowed 'Trans proline' 0 CA--C 1.548 1.185 0 C-N-CA 124.895 3.73 . . . . 0.0 116.195 -167.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -175.83 21.08 0.05 OUTLIER Glycine 0 CA--C 1.536 1.344 0 C-N-CA 127.287 2.375 . . . . 0.0 112.803 176.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -158.37 34.23 0.24 Allowed 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 -168.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 78.1 t -43.07 131.21 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 125.819 1.647 . . . . 0.0 112.328 172.071 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -59.44 66.31 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 129.872 3.269 . . . . 0.0 115.898 -170.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.8 t -147.92 126.81 12.71 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 120.125 -1.609 . . . . 0.0 111.587 178.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -146.64 59.54 5.27 Favored Pre-proline 0 CA--C 1.55 0.973 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 178.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -71.34 168.83 22.34 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 123.745 2.963 . . . . 0.0 110.386 164.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -156.55 157.47 30.97 Favored Pre-proline 0 CA--C 1.546 0.795 0 C-N-CA 124.643 1.177 . . . . 0.0 111.48 172.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -72.79 170.75 18.84 Favored 'Trans proline' 0 CA--C 1.547 1.135 0 C-N-CA 123.143 2.562 . . . . 0.0 110.733 158.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -69.44 173.35 10.82 Favored 'Trans proline' 0 CA--C 1.538 0.685 0 C-N-CA 121.961 1.774 . . . . 0.0 111.518 163.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.433 ' H ' ' CD ' ' A' ' 17' ' ' GLU . 2.8 mp0 -52.06 -41.14 62.1 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 126.923 2.089 . . . . 0.0 113.31 -168.046 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.4 m 54.54 28.68 10.1 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 126.298 1.839 . . . . 0.0 114.29 173.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -124.39 24.51 7.96 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 114.861 1.43 . . . . 0.0 114.861 -160.297 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.427 ' CD ' ' H ' ' A' ' 21' ' ' LYS . 1.5 tm-20 -55.71 150.28 12.89 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-O 123.818 1.771 . . . . 0.0 111.082 172.771 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.427 ' H ' ' CD ' ' A' ' 20' ' ' GLU . 0.1 OUTLIER 45.49 31.13 0.85 Allowed 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 128.11 2.564 . . . . 0.0 114.856 -171.764 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -124.2 158.93 59.22 Favored Pre-proline 0 N--CA 1.48 1.046 0 C-N-CA 126.477 1.911 . . . . 0.0 110.968 171.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -76.96 161.63 32.81 Favored 'Trans proline' 0 CA--C 1.535 0.571 0 C-N-CA 122.76 2.307 . . . . 0.0 112.331 166.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.572 ' CD1' ' H ' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -75.31 175.18 8.61 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-O 122.433 1.111 . . . . 0.0 112.487 170.06 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.572 ' H ' ' CD1' ' A' ' 24' ' ' LEU . 13.5 pttp -154.09 139.23 11.83 Favored Pre-proline 0 N--CA 1.468 0.46 0 C-N-CA 128.725 2.81 . . . . 0.0 107.503 -175.618 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_endo -76.74 -8.84 18.24 Favored 'Trans proline' 0 CA--C 1.544 0.983 0 C-N-CA 124.024 3.149 . . . . 0.0 113.601 -160.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 9.0 p -73.77 -22.2 59.92 Favored 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 127.247 2.219 . . . . 0.0 112.433 166.029 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.46 ' SG ' ' NZ ' ' A' ' 25' ' ' LYS . 69.7 m -113.31 -28.06 7.73 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 116.041 1.867 . . . . 0.0 116.041 -172.268 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.32 158.44 14.39 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-N 118.99 0.813 . . . . 0.0 111.916 -173.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 56.9 m 40.22 59.3 7.35 Favored Pre-proline 0 CA--C 1.544 0.743 0 C-N-CA 124.862 1.265 . . . . 0.0 113.82 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_endo -69.19 -22.67 34.37 Favored 'Trans proline' 0 CA--C 1.534 0.509 0 C-N-CA 123.425 2.75 . . . . 0.0 112.552 -157.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -63.1 -62.45 1.69 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.967 2.107 . . . . 0.0 112.812 171.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.8 p -61.12 -30.83 70.61 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 118.187 -0.911 . . . . 0.0 111.694 170.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 8.1 tmtt? -59.09 -49.68 76.95 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 120.052 1.296 . . . . 0.0 111.659 171.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 16.1 tttp -63.26 -43.06 99.04 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.783 0.833 . . . . 0.0 111.436 176.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.19 -39.37 92.5 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.49 0.716 . . . . 0.0 112.86 176.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 8.2 ttp85 -58.26 -54.62 44.98 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.551 1.54 . . . . 0.0 109.405 173.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 78.5 m-20 -68.78 -33.56 74.09 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.039 0.936 . . . . 0.0 113.442 -176.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.4 -37.32 82.92 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 120.588 -1.32 . . . . 0.0 112.854 171.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.1 t -57.19 -38.54 73.82 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.723 0.773 . . . . 0.0 111.225 168.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 67.0 mt -75.43 -30.17 22.01 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 C-N-CA 124.95 1.3 . . . . 0.0 112.27 -176.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 67.2 mt -58.18 -45.38 88.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 CA-C-N 119.028 0.831 . . . . 0.0 110.377 163.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.67 -37.35 79.53 Favored 'General case' 0 CA--C 1.552 1.05 0 N-CA-C 115.024 1.491 . . . . 0.0 115.024 -174.284 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.87 -8.63 0.41 Allowed 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 117.57 2.433 . . . . 0.0 117.57 -176.555 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 82.96 165.62 37.88 Favored Glycine 0 CA--C 1.536 1.358 0 CA-C-N 119.773 1.17 . . . . 0.0 112.531 -164.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -76.69 -30.92 56.91 Favored 'General case' 0 CA--C 1.516 -0.349 0 O-C-N 120.311 -1.699 . . . . 0.0 114.401 -164.735 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -58.94 -35.87 73.83 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 123.229 0.33 . . . . 0.0 111.462 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 -82.83 4.42 25.51 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.967 1.707 . . . . 0.0 112.986 177.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 1.8 m -139.3 18.0 2.58 Favored 'General case' 0 N--CA 1.442 -0.86 0 C-N-CA 127.794 2.438 . . . . 0.0 112.154 -168.125 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -69.93 -19.38 75.26 Favored Glycine 0 C--O 1.221 -0.658 0 O-C-N 119.751 -1.843 . . . . 0.0 115.56 -176.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 38.4 p-80 -58.24 -34.65 70.68 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 120.18 1.99 . . . . 0.0 112.352 162.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.65 -32.87 60.38 Favored 'General case' 0 CA--C 1.52 -0.201 0 C-N-CA 125.326 1.45 . . . . 0.0 110.774 174.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 5.1 mt -66.72 -39.28 83.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 118.843 -1.143 . . . . 0.0 110.748 167.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -74.63 -47.98 28.96 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 -170.352 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.79 -39.99 72.05 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 121.597 0.713 . . . . 0.0 112.138 170.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 18.5 t60 -65.36 -48.96 71.12 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.73 0.812 . . . . 0.0 112.913 174.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 52.7 mttm -48.13 -47.18 34.84 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 124.885 1.274 . . . . 0.0 112.168 177.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -75.79 -25.95 56.87 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 117.844 -1.074 . . . . 0.0 113.045 -177.286 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 37.6 t -58.55 -58.31 9.12 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-O 118.376 -0.821 . . . . 0.0 111.545 160.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 9.3 mmm -47.15 -45.23 22.52 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-N 120.341 1.428 . . . . 0.0 111.36 174.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 1.9 mtt85 -63.07 -32.42 73.79 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 117.028 -1.463 . . . . 0.0 114.134 -171.147 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -50.48 -36.83 35.44 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 118.985 0.811 . . . . 0.0 112.613 170.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 4.9 mp -82.52 8.04 12.81 Favored 'General case' 0 CA--C 1.554 1.098 0 C-N-CA 125.817 1.647 . . . . 0.0 112.003 -173.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.75 41.21 5.42 Favored Glycine 0 CA--C 1.534 1.266 0 C-N-CA 124.864 1.221 . . . . 0.0 114.788 171.153 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -119.75 145.83 46.2 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 120.725 -1.456 . . . . 0.0 114.031 -142.868 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -91.64 89.56 7.19 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.429 1.892 . . . . 0.0 109.158 -176.198 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 23.9 mm . . . . . 0 C--O 1.25 1.114 0 C-N-CA 126.707 2.003 . . . . 0.0 111.848 -158.143 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.475 0 N-CA-C 109.279 -1.528 . . . . 0.0 109.279 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 77.8 p -160.84 178.73 9.13 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.258 1.423 . . . . 0.0 110.014 -176.012 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -62.31 161.29 11.68 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-O 121.052 0.453 . . . . 0.0 111.463 160.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 5.7 m -160.37 159.26 30.92 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 126.381 1.872 . . . . 0.0 108.327 171.02 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 8.3 ttt -130.9 72.88 81.62 Favored Pre-proline 0 CA--C 1.542 0.655 0 C-N-CA 124.188 0.995 . . . . 0.0 109.837 172.036 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -73.15 4.14 4.02 Favored 'Trans proline' 0 CA--C 1.543 0.952 0 C-N-CA 123.76 2.974 . . . . 0.0 115.104 -172.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -160.16 137.64 5.14 Favored Glycine 0 CA--C 1.527 0.797 0 C-N-CA 124.4 1.0 . . . . 0.0 110.62 173.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -170.7 144.28 2.29 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 127.269 2.227 . . . . 0.0 109.741 -176.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 23.2 t 60.86 156.16 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 O-C-N 125.739 1.9 . . . . 0.0 112.587 -165.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -137.52 -18.38 1.26 Allowed 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 115.525 1.676 . . . . 0.0 115.525 -165.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 97.2 p -160.87 172.28 17.26 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 -156.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 34.4 p-10 -139.51 60.25 16.09 Favored Pre-proline 0 CA--C 1.553 1.085 0 C-N-CA 126.425 1.89 . . . . 0.0 111.439 177.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.08 102.24 1.05 Allowed 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 123.834 3.023 . . . . 0.0 114.246 -160.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.95 153.17 56.35 Favored Pre-proline 0 CA--C 1.55 0.961 0 CA-C-N 113.743 -1.571 . . . . 0.0 114.334 -177.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -62.38 -177.82 0.32 Allowed 'Trans proline' 0 CA--C 1.549 1.263 0 C-N-CA 125.265 3.977 . . . . 0.0 113.581 172.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -73.43 -179.66 4.66 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 122.447 2.098 . . . . 0.0 111.595 158.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.98 168.48 19.4 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.032 1.333 . . . . 0.0 111.866 164.557 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 79.4 p -163.72 15.99 0.06 Allowed 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 116.946 2.202 . . . . 0.0 116.946 -176.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -108.67 -10.26 15.2 Favored 'General case' 0 N--CA 1.446 -0.644 0 O-C-N 119.008 -2.308 . . . . 0.0 113.86 -171.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -86.31 166.56 15.53 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 125.03 2.348 . . . . 0.0 114.049 163.725 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.19 76.83 1.6 Allowed 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 129.101 2.961 . . . . 0.0 108.682 -174.046 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.11 161.92 59.86 Favored Pre-proline 0 N--CA 1.473 0.699 0 C-N-CA 129.471 3.108 . . . . 0.0 108.126 177.296 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -68.8 144.11 58.06 Favored 'Trans proline' 0 N--CA 1.455 -0.774 0 C-N-CA 120.874 1.05 . . . . 0.0 110.894 164.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.551 ' CD1' ' H ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -77.24 162.29 27.47 Favored 'General case' 0 CA--C 1.552 1.024 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.23 163.355 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.551 ' H ' ' CD1' ' A' ' 24' ' ' LEU . 11.0 ptmm? -135.37 128.67 18.37 Favored Pre-proline 0 N--CA 1.466 0.336 0 C-N-CA 129.762 3.225 . . . . 0.0 106.156 -177.363 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_endo -68.27 -19.22 44.4 Favored 'Trans proline' 0 CA--C 1.542 0.909 0 C-N-CA 123.419 2.746 . . . . 0.0 114.207 -155.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 29.9 p -68.49 -21.46 64.6 Favored 'General case' 0 CA--C 1.559 1.315 0 C-N-CA 125.852 1.661 . . . . 0.0 113.132 171.119 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 83.2 m -105.97 -17.52 14.32 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 126.214 1.806 . . . . 0.0 114.645 -176.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.32 157.22 34.49 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.54 -0.725 . . . . 0.0 112.441 -167.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.6 m 40.91 58.03 8.4 Favored Pre-proline 0 CA--C 1.549 0.919 0 N-CA-C 114.21 1.189 . . . . 0.0 114.21 176.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -65.3 -24.35 58.08 Favored 'Trans proline' 0 CA--C 1.538 0.701 0 C-N-CA 122.483 2.122 . . . . 0.0 112.328 -160.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -58.37 -52.01 67.39 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 127.065 2.146 . . . . 0.0 111.843 177.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.9 p -76.5 -38.26 55.5 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.289 1.436 . . . . 0.0 111.565 170.247 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 6.4 tmtt? -52.73 -46.87 67.62 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 120.102 1.319 . . . . 0.0 112.057 179.048 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.5 tmmm? -51.97 -55.0 23.09 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 126.959 2.104 . . . . 0.0 112.183 171.094 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.5 -35.02 79.23 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 114.393 -1.276 . . . . 0.0 112.634 -177.004 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 7.5 ttp85 -62.6 -54.98 31.51 Favored 'General case' 0 C--O 1.222 -0.368 0 C-N-CA 125.766 1.626 . . . . 0.0 109.444 174.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -71.45 -28.16 63.77 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -175.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.86 -41.22 87.68 Favored 'General case' 0 CA--C 1.544 0.75 0 O-C-N 120.549 -1.344 . . . . 0.0 112.965 167.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 6.2 t -55.5 -37.39 67.8 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 122.271 1.034 . . . . 0.0 111.044 169.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 73.5 mt -75.39 -31.27 23.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 O-C-N 121.052 -1.03 . . . . 0.0 111.949 -179.374 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 86.0 mt -64.11 -35.76 74.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 CA-C-N 118.825 0.738 . . . . 0.0 111.641 166.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 27.2 mt-10 -75.03 -36.66 61.87 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 178.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.68 -11.13 0.34 Allowed 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 118.083 2.623 . . . . 0.0 118.083 -173.666 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 86.78 166.7 42.82 Favored Glycine 0 CA--C 1.539 1.55 0 CA-C-N 120.035 1.289 . . . . 0.0 112.908 -163.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -76.44 -30.53 57.41 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 120.351 -1.676 . . . . 0.0 113.58 -168.388 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -58.25 -33.34 69.26 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 123.155 0.582 . . . . 0.0 112.258 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 -88.58 10.9 18.82 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.715 1.606 . . . . 0.0 112.591 178.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 2.7 m -141.2 14.91 2.23 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 126.294 1.838 . . . . 0.0 113.85 -162.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -60.29 -32.73 77.78 Favored Glycine 0 C--O 1.213 -1.189 0 O-C-N 120.152 -1.593 . . . . 0.0 115.264 -176.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 41.8 p-80 -55.37 -25.55 36.01 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 121.963 2.881 . . . . 0.0 114.439 169.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -79.89 -36.56 36.35 Favored 'General case' 0 C--N 1.339 0.119 0 C-N-CA 123.948 0.899 . . . . 0.0 111.379 170.066 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.402 HG22 ' HE2' ' A' ' 57' ' ' LYS . 42.6 mt -75.89 -33.52 25.64 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.391 0 CA-C-O 119.092 -0.48 . . . . 0.0 110.184 -177.673 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.436 ' HG3' ' HE3' ' A' ' 57' ' ' LYS . 1.5 mp0 -70.24 -53.23 17.88 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 125.48 1.512 . . . . 0.0 112.781 177.382 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -53.37 -35.11 59.94 Favored 'General case' 0 CA--C 1.545 0.752 0 O-C-N 121.267 -0.895 . . . . 0.0 113.028 173.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 19.2 t60 -73.9 -43.18 59.27 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.535 1.134 . . . . 0.0 113.931 174.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.436 ' HE3' ' HG3' ' A' ' 54' ' ' GLU . 26.3 mtmt -53.16 -52.21 59.51 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 125.275 1.43 . . . . 0.0 111.339 175.302 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -66.56 -37.58 85.27 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 122.99 0.516 . . . . 0.0 111.586 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 18.6 t -52.57 -59.64 4.21 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-O 117.805 -1.093 . . . . 0.0 112.162 167.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 92.9 mtp -47.6 -51.6 20.63 Favored 'General case' 0 N--CA 1.488 1.464 0 CA-C-N 120.69 1.586 . . . . 0.0 110.821 171.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.411 HH21 ' C ' ' A' ' 67' ' ' ILE . 37.5 mtt180 -54.91 -34.8 63.47 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 125.453 1.501 . . . . 0.0 114.0 -177.421 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -48.45 -39.09 21.61 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 119.203 0.91 . . . . 0.0 113.192 169.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.6 mp -81.0 8.86 7.47 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 124.84 1.256 . . . . 0.0 111.746 -173.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 86.65 18.81 57.82 Favored Glycine 0 CA--C 1.535 1.334 0 C-N-CA 125.278 1.418 . . . . 0.0 114.404 -178.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -72.59 170.67 13.95 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.538 1.535 . . . . 0.0 114.846 -166.039 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.31 88.93 3.01 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 125.103 1.361 . . . . 0.0 108.369 -177.158 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.411 ' C ' HH21 ' A' ' 61' ' ' ARG . 26.0 mm . . . . . 0 C--O 1.244 0.765 0 C-N-CA 130.69 3.596 . . . . 0.0 107.458 -162.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.574 0 N-CA-C 109.313 -1.515 . . . . 0.0 109.313 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.9 m -64.57 -10.13 24.02 Favored 'General case' 0 N--CA 1.479 0.984 0 N-CA-C 117.784 2.512 . . . . 0.0 117.784 -162.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 8.7 t80 42.35 34.29 0.5 Allowed 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 126.951 2.1 . . . . 0.0 115.42 176.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.2 m -90.99 141.0 29.31 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 120.833 -1.167 . . . . 0.0 111.16 -167.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 8.0 tpt -122.21 76.2 42.01 Favored Pre-proline 0 CA--C 1.542 0.656 0 C-N-CA 124.397 1.079 . . . . 0.0 110.536 175.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -73.58 6.83 2.55 Favored 'Trans proline' 0 CA--C 1.543 0.956 0 C-N-CA 123.541 2.828 . . . . 0.0 114.349 177.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -79.62 34.25 2.07 Favored Glycine 0 CA--C 1.533 1.183 0 O-C-N 120.852 -1.155 . . . . 0.0 114.407 -176.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.7 mp -114.15 113.52 24.8 Favored 'General case' 0 C--O 1.224 -0.281 0 C-N-CA 125.919 1.688 . . . . 0.0 109.041 -171.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 63.0 t 50.66 95.31 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 126.455 1.902 . . . . 0.0 114.195 177.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -59.95 109.09 0.87 Allowed 'General case' 0 CA--C 1.54 0.567 0 O-C-N 121.414 -0.804 . . . . 0.0 110.815 159.425 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 31.5 p -67.37 130.67 43.81 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 121.977 0.894 . . . . 0.0 110.346 169.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -152.99 57.81 2.16 Favored Pre-proline 0 CA--C 1.544 0.721 0 N-CA-C 114.436 1.273 . . . . 0.0 114.436 -178.281 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -68.06 172.33 11.09 Favored 'Trans proline' 0 N--CA 1.451 -1.028 0 C-N-CA 124.255 3.303 . . . . 0.0 111.98 176.378 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -72.27 157.76 88.69 Favored Pre-proline 0 CA--C 1.546 0.793 0 CA-C-N 113.69 -1.595 . . . . 0.0 111.166 165.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -68.16 160.84 47.05 Favored 'Trans proline' 0 CA--C 1.545 1.025 0 C-N-CA 122.834 2.356 . . . . 0.0 110.967 163.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -71.17 174.41 10.75 Favored 'Trans proline' 0 CA--C 1.535 0.574 0 C-N-CA 122.697 2.265 . . . . 0.0 112.506 176.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -140.76 167.59 21.81 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.183 1.393 . . . . 0.0 111.258 -167.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.1 p -155.45 57.58 0.63 Allowed 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.857 1.263 . . . . 0.0 112.52 178.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -146.1 161.52 39.99 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.397 -0.814 . . . . 0.0 109.07 174.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -59.54 154.72 16.78 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 122.937 1.351 . . . . 0.0 112.61 163.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -163.71 146.96 10.0 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 127.489 2.316 . . . . 0.0 107.911 175.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 64.6 mttt -63.14 142.58 97.74 Favored Pre-proline 0 N--CA 1.474 0.769 0 O-C-N 121.324 -0.86 . . . . 0.0 110.604 170.042 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -79.65 163.25 24.08 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 121.891 1.728 . . . . 0.0 113.674 -160.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.75 158.96 32.62 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 113.439 -1.71 . . . . 0.0 113.12 169.595 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.05 147.64 37.63 Favored Pre-proline 0 N--CA 1.463 0.205 0 C-N-CA 124.734 1.213 . . . . 0.0 108.297 166.854 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -67.2 -35.42 24.73 Favored 'Trans proline' 0 CA--C 1.535 0.559 0 C-N-CA 121.625 1.55 . . . . 0.0 111.461 -178.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 29.7 p -77.69 -23.64 49.48 Favored 'General case' 0 CA--C 1.557 1.241 0 C-N-CA 125.507 1.523 . . . . 0.0 113.658 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 82.2 m -98.21 -17.43 18.99 Favored 'General case' 0 CA--C 1.553 1.094 0 N-CA-C 114.511 1.301 . . . . 0.0 114.511 -179.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.35 163.7 8.18 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.182 0.993 . . . . 0.0 112.87 -178.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 56.7 m 42.21 54.54 9.1 Favored Pre-proline 0 CA--C 1.547 0.852 0 C-N-CA 124.815 1.246 . . . . 0.0 113.328 -174.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -69.65 -24.09 30.57 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 123.319 2.679 . . . . 0.0 112.776 -158.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.448 ' HG3' ' H ' ' A' ' 33' ' ' THR . 0.1 OUTLIER -53.48 -69.83 0.11 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 127.785 2.434 . . . . 0.0 113.76 164.177 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.448 ' H ' ' HG3' ' A' ' 32' ' ' GLU . 0.0 OUTLIER -60.84 -35.28 76.13 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 126.129 1.771 . . . . 0.0 110.96 176.554 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 9.2 tmtm? -53.41 -52.01 60.74 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.969 1.708 . . . . 0.0 112.264 169.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 50.4 tttm -58.5 -47.89 82.6 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.806 0.842 . . . . 0.0 111.984 175.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.14 -39.76 95.61 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 114.731 -1.122 . . . . 0.0 112.209 -178.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 11.8 ttp85 -61.48 -57.12 13.44 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 125.729 1.612 . . . . 0.0 109.918 174.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -66.35 -28.51 68.72 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.851 0.861 . . . . 0.0 112.92 -176.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.97 -42.39 80.92 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 120.216 -1.552 . . . . 0.0 112.646 169.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.7 t -55.43 -34.41 64.42 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 122.173 0.987 . . . . 0.0 111.545 171.386 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 61.8 mt -77.36 -33.55 19.89 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 C-N-CA 125.381 1.472 . . . . 0.0 112.428 178.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 73.2 mt -66.05 -34.06 67.69 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 123.883 0.873 . . . . 0.0 111.44 168.207 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -74.01 -36.3 64.45 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.013 1.325 . . . . 0.0 114.509 178.595 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.7 mppt? -138.43 -55.97 0.64 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.162 1.385 . . . . 0.0 113.646 175.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 136.75 163.54 9.82 Favored Glycine 0 CA--C 1.532 1.103 0 C-N-CA 126.32 1.914 . . . . 0.0 109.6 -159.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.1 -28.22 61.26 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 120.927 -1.337 . . . . 0.0 112.893 -169.091 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 -57.49 -32.49 67.06 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 178.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -84.79 5.22 29.46 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.941 1.296 . . . . 0.0 113.13 177.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 6.9 m -147.47 16.11 1.14 Allowed 'General case' 0 N--CA 1.441 -0.901 0 C-N-CA 125.067 1.347 . . . . 0.0 113.107 -154.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -65.76 -27.59 72.84 Favored Glycine 0 C--O 1.216 -0.983 0 O-C-N 120.115 -1.615 . . . . 0.0 114.964 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 40.8 p-80 -54.93 -25.58 30.34 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 120.973 2.386 . . . . 0.0 113.852 165.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.58 -34.04 31.24 Favored 'General case' 0 N--CA 1.462 0.135 0 C-N-CA 123.718 0.807 . . . . 0.0 110.956 173.081 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 35.9 mt -74.45 -38.57 46.77 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-O 119.202 -0.428 . . . . 0.0 110.626 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.68 -53.12 56.29 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 125.851 1.66 . . . . 0.0 111.404 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -56.37 -40.5 74.66 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.052 -1.03 . . . . 0.0 112.65 177.324 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 15.5 t60 -68.31 -48.12 65.75 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.937 1.295 . . . . 0.0 113.737 177.14 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 4.1 mtpp -48.97 -53.05 21.5 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 126.258 1.823 . . . . 0.0 111.498 174.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 34.8 mm-40 -72.9 -36.82 67.38 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.206 0.602 . . . . 0.0 111.564 -176.346 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 48.6 t -49.89 -56.49 10.31 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.594 0.757 . . . . 0.0 112.16 165.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 8.1 mtp -54.36 -53.59 51.96 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.89 1.276 . . . . 0.0 110.168 174.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 57.9 mtt180 -53.34 -30.93 41.93 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 126.137 1.775 . . . . 0.0 114.683 -176.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -47.56 -35.89 9.71 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.346 1.058 . . . . 0.0 112.911 169.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.3 mp -79.0 5.62 11.27 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.909 1.283 . . . . 0.0 112.381 -172.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.56 8.6 70.31 Favored Glycine 0 CA--C 1.535 1.291 0 C-N-CA 125.899 1.714 . . . . 0.0 113.049 -170.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -72.36 160.74 31.85 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 127.407 2.283 . . . . 0.0 112.74 -172.656 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.9 94.44 4.68 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.727 1.211 . . . . 0.0 108.131 -179.245 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.308 0 C-N-CA 127.469 2.308 . . . . 0.0 109.676 174.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.394 0 N-CA-C 108.321 -1.911 . . . . 0.0 108.321 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.1 m -148.21 161.88 40.59 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 118.238 1.019 . . . . 0.0 110.979 -167.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 85.2 t80 -149.76 157.75 43.51 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.322 1.449 . . . . 0.0 109.765 176.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.7 m -158.54 -50.33 0.06 Allowed 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 171.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 18.4 ttt 31.87 54.23 0.9 Allowed Pre-proline 0 N--CA 1.482 1.143 0 C-N-CA 126.932 2.093 . . . . 0.0 116.103 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -74.5 1.38 7.5 Favored 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 122.588 2.192 . . . . 0.0 115.903 -163.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 126.65 87.72 0.64 Allowed Glycine 0 N--CA 1.47 0.957 0 CA-C-N 118.928 0.786 . . . . 0.0 111.709 -176.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -159.2 148.58 18.59 Favored 'General case' 0 N--CA 1.463 0.176 0 C-N-CA 124.364 1.066 . . . . 0.0 112.175 -171.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 41.9 t 67.74 145.81 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 C-N-CA 128.191 2.596 . . . . 0.0 114.452 175.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -130.0 -37.4 1.5 Allowed 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 125.836 1.654 . . . . 0.0 113.768 -172.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.0 t 46.11 22.82 0.15 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 128.362 2.665 . . . . 0.0 115.831 -171.411 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 -148.78 61.08 5.3 Favored Pre-proline 0 CA--C 1.555 1.135 0 C-N-CA 126.432 1.893 . . . . 0.0 112.253 -172.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -65.86 162.8 33.39 Favored 'Trans proline' 0 N--CA 1.45 -1.072 0 C-N-CA 124.013 3.142 . . . . 0.0 110.51 166.011 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -75.6 148.94 83.27 Favored Pre-proline 0 CA--C 1.547 0.849 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -67.51 169.08 16.45 Favored 'Trans proline' 0 CA--C 1.546 1.118 0 C-N-CA 124.205 3.27 . . . . 0.0 112.404 167.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.81 176.51 8.85 Favored 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 123.252 2.635 . . . . 0.0 112.869 172.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -97.41 139.89 32.68 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 114.912 -1.04 . . . . 0.0 112.432 175.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.0 m -67.22 14.24 0.05 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 126.981 2.112 . . . . 0.0 115.787 -178.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 18.5 tp60 -66.02 -32.85 74.56 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.651 1.18 . . . . 0.0 113.735 -171.117 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -169.17 -159.69 0.24 Allowed 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.884 1.674 . . . . 0.0 109.554 174.787 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 40.1 mmtm -55.27 33.62 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 129.876 3.27 . . . . 0.0 117.123 173.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 44.7 mttt -57.97 153.24 34.85 Favored Pre-proline 0 N--CA 1.472 0.663 0 O-C-N 120.197 -1.564 . . . . 0.0 112.472 176.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -73.5 166.59 29.46 Favored 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 122.34 2.027 . . . . 0.0 112.635 -177.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.2 mt -122.6 167.09 13.83 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.762 1.225 . . . . 0.0 112.439 175.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 4.6 mttp -129.44 150.62 76.1 Favored Pre-proline 0 N--CA 1.472 0.664 0 C-N-CA 126.467 1.907 . . . . 0.0 107.772 174.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -78.41 -19.0 12.0 Favored 'Trans proline' 0 CA--C 1.55 1.297 0 C-N-CA 122.246 1.964 . . . . 0.0 112.425 -179.036 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 26.8 p -73.9 -14.6 61.09 Favored 'General case' 0 CA--C 1.557 1.217 0 C-N-CA 125.726 1.61 . . . . 0.0 112.629 165.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 64.6 m -111.77 -36.22 5.5 Favored 'General case' 0 CA--C 1.547 0.858 0 N-CA-C 114.622 1.342 . . . . 0.0 114.622 -177.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.26 157.15 23.46 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.901 0.88 . . . . 0.0 110.003 -179.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 53.6 m 43.55 55.16 11.62 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 123.567 0.747 . . . . 0.0 113.004 -179.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -68.98 -7.93 22.17 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 123.906 3.071 . . . . 0.0 113.578 -158.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 36.2 mm-40 -96.37 -43.54 7.62 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 125.215 1.406 . . . . 0.0 110.685 -176.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.1 p -66.58 -27.26 67.59 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 117.948 -1.025 . . . . 0.0 111.99 161.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 9.8 tmtt? -58.32 -55.43 35.11 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 120.276 1.398 . . . . 0.0 111.457 169.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.6 mttp -55.16 -43.38 74.19 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 125.355 1.462 . . . . 0.0 112.458 172.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.61 -39.8 80.67 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 177.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 12.0 ttp85 -58.49 -53.25 60.44 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.514 1.125 . . . . 0.0 109.106 176.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -74.37 -30.11 61.84 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 115.124 -0.944 . . . . 0.0 112.817 -174.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.49 -43.32 99.08 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 120.772 -1.205 . . . . 0.0 111.794 166.148 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.8 t -56.27 -33.45 65.5 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.952 0.901 . . . . 0.0 111.741 173.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 67.0 mt -77.88 -35.46 20.84 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 124.769 1.228 . . . . 0.0 112.482 177.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 84.4 mt -64.46 -36.29 76.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 124.375 1.07 . . . . 0.0 111.379 168.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -71.98 -37.84 69.82 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.761 1.625 . . . . 0.0 113.983 178.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.9 mppt? -139.12 -59.23 0.59 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.582 1.553 . . . . 0.0 113.706 178.043 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 135.61 158.24 8.17 Favored Glycine 0 CA--C 1.531 1.033 0 C-N-CA 126.104 1.811 . . . . 0.0 109.714 -159.102 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.96 -27.48 61.85 Favored 'General case' 0 N--CA 1.465 0.28 0 O-C-N 120.746 -1.444 . . . . 0.0 113.011 -165.857 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -56.46 -36.18 68.77 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 122.76 0.424 . . . . 0.0 111.76 177.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -81.51 4.46 21.16 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.81 1.244 . . . . 0.0 113.1 177.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 6.0 m -147.81 15.84 1.09 Allowed 'General case' 0 N--CA 1.439 -0.994 0 C-N-CA 125.945 1.698 . . . . 0.0 112.473 -154.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -75.33 -13.16 83.08 Favored Glycine 0 C--O 1.222 -0.652 0 O-C-N 119.707 -1.87 . . . . 0.0 115.378 -178.061 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 35.2 p-80 -60.65 -33.82 73.38 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.889 1.844 . . . . 0.0 112.214 158.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.84 -37.85 67.28 Favored 'General case' 0 CA--C 1.516 -0.332 0 C-N-CA 124.132 0.973 . . . . 0.0 108.944 177.147 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 17.6 mt -71.23 -43.05 74.91 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.614 0 CA-C-O 118.853 -0.594 . . . . 0.0 109.673 177.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -60.93 -46.67 89.75 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 119.43 1.014 . . . . 0.0 112.267 179.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -61.54 -44.52 96.89 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.501 0.72 . . . . 0.0 112.865 175.339 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 14.2 t60 -63.33 -45.42 91.36 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 121.142 -0.973 . . . . 0.0 112.643 174.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.6 mtmt -54.76 -48.29 72.83 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.598 0.759 . . . . 0.0 111.235 173.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 87.3 mt-10 -70.94 -28.29 64.38 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 117.929 -1.034 . . . . 0.0 113.112 -178.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 48.9 t -57.02 -60.24 3.88 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 119.183 0.901 . . . . 0.0 111.212 160.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 76.0 mtm -54.05 -45.51 71.69 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 119.576 1.08 . . . . 0.0 113.355 178.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 47.7 mtt180 -50.71 -37.28 40.6 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 126.636 1.974 . . . . 0.0 113.292 -178.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -47.45 -39.08 14.9 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 169.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.7 mp -84.1 10.26 10.55 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 126.367 1.867 . . . . 0.0 111.571 -172.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.11 33.46 10.76 Favored Glycine 0 CA--C 1.534 1.247 0 O-C-N 120.623 -1.298 . . . . 0.0 113.685 -179.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -99.07 156.46 16.92 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.038 1.735 . . . . 0.0 112.749 -168.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 3.1 mppt? -116.37 73.11 0.84 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.0 1.72 . . . . 0.0 109.504 -160.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.028 0 C-N-CA 125.801 1.64 . . . . 0.0 111.759 -165.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.5 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 7.8 t -157.8 -176.72 6.09 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.069 1.348 . . . . 0.0 109.541 173.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 24.9 p90 -141.05 172.4 12.73 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.718 1.607 . . . . 0.0 110.357 174.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 3.4 m -158.45 158.35 33.97 Favored 'General case' 0 N--CA 1.478 0.949 0 O-C-N 120.821 -1.175 . . . . 0.0 110.187 178.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.3 tpt -127.13 73.83 77.0 Favored Pre-proline 0 N--CA 1.471 0.593 0 C-N-CA 125.117 1.367 . . . . 0.0 108.947 167.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -68.1 0.74 4.11 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 123.768 2.979 . . . . 0.0 115.21 -169.167 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -104.46 -18.65 12.62 Favored Glycine 0 CA--C 1.533 1.206 0 CA-C-O 118.902 -0.943 . . . . 0.0 114.665 173.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 46.83 -165.73 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.821 1.249 . . . . 0.0 113.135 -165.388 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.4 p -158.69 147.5 8.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 O-C-N 121.159 -0.963 . . . . 0.0 112.673 179.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -137.05 162.54 33.06 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 127.531 2.332 . . . . 0.0 107.055 151.172 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 24.9 m -158.62 56.34 0.44 Allowed 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.697 1.199 . . . . 0.0 110.551 163.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -121.13 63.69 12.45 Favored Pre-proline 0 CA--C 1.552 1.041 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -176.37 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_endo -81.49 -169.99 0.89 Allowed 'Trans proline' 0 CA--C 1.544 0.994 0 C-N-CA 124.774 3.65 . . . . 0.0 111.515 170.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -127.29 156.37 74.92 Favored Pre-proline 0 CA--C 1.544 0.712 0 C-N-CA 124.339 1.056 . . . . 0.0 111.423 167.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -70.07 156.8 61.66 Favored 'Trans proline' 0 CA--C 1.543 0.956 0 C-N-CA 122.888 2.392 . . . . 0.0 112.706 171.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -75.28 175.52 11.16 Favored 'Trans proline' 0 CA--C 1.537 0.638 0 C-N-CA 123.031 2.487 . . . . 0.0 112.333 166.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -82.46 156.54 24.03 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.468 1.107 . . . . 0.0 113.519 -176.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 10.1 m -65.34 15.99 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 127.968 2.507 . . . . 0.0 116.858 -176.569 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -36.85 -52.33 0.92 Allowed 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 127.885 2.474 . . . . 0.0 114.344 -168.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -162.74 167.82 22.43 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.618 1.167 . . . . 0.0 108.281 148.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.28 51.75 0.17 Allowed 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 127.742 2.417 . . . . 0.0 111.894 175.286 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 41.1 mmtm -72.82 158.4 87.3 Favored Pre-proline 0 N--CA 1.474 0.745 0 C-N-CA 125.49 1.516 . . . . 0.0 113.083 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -83.13 171.51 11.43 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 123.372 2.715 . . . . 0.0 111.652 168.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.707 ' CD1' ' H ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -98.7 165.1 11.96 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-O 122.503 1.144 . . . . 0.0 111.246 172.244 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.707 ' H ' ' CD1' ' A' ' 24' ' ' LEU . 0.1 OUTLIER -147.46 120.51 4.81 Favored Pre-proline 0 CA--C 1.538 0.485 0 C-N-CA 131.505 3.922 . . . . 0.0 105.41 -168.497 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -62.18 -32.88 82.84 Favored 'Trans proline' 0 CA--C 1.536 0.6 0 C-N-CA 124.047 3.165 . . . . 0.0 114.401 -148.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 29.6 p -64.46 -19.4 65.54 Favored 'General case' 0 CA--C 1.555 1.169 0 C-N-CA 125.379 1.472 . . . . 0.0 113.81 179.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 61.5 m -110.01 -4.75 15.71 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.897 1.679 . . . . 0.0 114.457 -177.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.74 154.55 38.7 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.133 -0.979 . . . . 0.0 110.261 -177.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 55.6 m 42.31 59.75 10.0 Favored Pre-proline 0 CA--C 1.548 0.879 0 N-CA-C 113.777 1.028 . . . . 0.0 113.777 179.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -69.9 -18.22 36.48 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.642 2.228 . . . . 0.0 112.747 -156.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 27.5 mm-40 -85.37 -40.8 16.08 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.691 1.196 . . . . 0.0 112.295 -178.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.4 p -65.53 -30.28 71.01 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 120.725 -1.235 . . . . 0.0 111.328 161.134 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 9.6 tmtt? -60.85 -48.14 83.18 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 120.39 1.45 . . . . 0.0 111.836 171.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 42.4 mttt -55.04 -49.64 71.07 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 126.106 1.763 . . . . 0.0 111.694 171.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.17 -36.6 83.51 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 112.921 0.712 . . . . 0.0 112.921 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 8.3 ttp85 -58.87 -53.46 58.18 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.939 1.296 . . . . 0.0 109.6 174.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 60.6 m-20 -70.46 -30.39 67.2 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.78 0.832 . . . . 0.0 112.836 -176.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.42 -39.42 93.8 Favored 'General case' 0 CA--C 1.547 0.857 0 O-C-N 120.418 -1.426 . . . . 0.0 112.969 166.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.8 t -59.73 -32.38 70.49 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 122.773 1.273 . . . . 0.0 112.095 169.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 67.9 mt -75.57 -33.01 25.84 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 O-C-N 120.386 -1.446 . . . . 0.0 111.341 177.522 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 77.3 mt -62.48 -36.63 75.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.617 1.167 . . . . 0.0 112.173 166.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -64.88 -48.67 73.42 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 119.573 1.079 . . . . 0.0 113.269 175.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.4 pttm -155.5 -4.91 0.13 Allowed 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 116.407 2.003 . . . . 0.0 116.407 -160.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 83.71 158.42 26.76 Favored Glycine 0 CA--C 1.527 0.811 0 CA-C-N 119.057 0.844 . . . . 0.0 112.62 -167.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.09 -28.36 68.11 Favored 'General case' 0 C--N 1.334 -0.101 0 O-C-N 121.578 -0.954 . . . . 0.0 112.723 -169.782 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -59.69 -26.22 65.4 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-O 118.122 -0.942 . . . . 0.0 112.905 175.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 82.5 m-70 -98.72 15.33 25.64 Favored 'General case' 0 C--N 1.352 0.683 0 CA-C-N 120.61 1.55 . . . . 0.0 110.528 -179.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 1.8 m -147.79 14.74 1.07 Allowed 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 125.973 1.709 . . . . 0.0 113.503 -157.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -67.11 -17.63 68.15 Favored Glycine 0 C--O 1.215 -1.064 0 O-C-N 119.569 -1.957 . . . . 0.0 115.825 -175.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 35.2 p-80 -58.94 -33.69 70.89 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 121.572 2.686 . . . . 0.0 112.795 164.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.24 -34.64 61.43 Favored 'General case' 0 N--CA 1.462 0.175 0 C-N-CA 126.354 1.862 . . . . 0.0 111.453 173.737 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.5 mt -70.54 -43.44 77.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 118.911 -1.115 . . . . 0.0 110.914 171.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -63.02 -53.78 48.54 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.921 0.888 . . . . 0.0 112.278 -176.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -58.45 -32.69 68.95 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.34 -1.475 . . . . 0.0 113.646 178.082 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 10.7 t60 -74.02 -44.67 53.66 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.677 1.191 . . . . 0.0 113.043 175.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 35.0 mtpt -53.54 -53.1 56.46 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.162 1.385 . . . . 0.0 112.07 176.27 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -62.76 -40.62 97.83 Favored 'General case' 0 C--N 1.327 -0.405 0 O-C-N 123.318 0.386 . . . . 0.0 111.713 -176.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 44.0 t -51.5 -51.28 56.51 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 124.069 0.948 . . . . 0.0 112.844 169.269 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 72.8 mtm -62.06 -51.72 66.81 Favored 'General case' 0 N--CA 1.481 1.081 0 O-C-N 120.979 -1.076 . . . . 0.0 111.507 171.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 69.0 mtt180 -53.77 -32.37 52.1 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 126.981 2.112 . . . . 0.0 113.87 -175.44 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -44.86 -33.35 1.92 Allowed 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.047 1.339 . . . . 0.0 113.804 168.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.3 mp -82.19 5.63 19.2 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.195 0.998 . . . . 0.0 112.375 -173.286 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.29 17.9 75.3 Favored Glycine 0 CA--C 1.534 1.233 0 C-N-CA 125.039 1.304 . . . . 0.0 112.614 -166.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -70.49 144.24 51.45 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.999 1.72 . . . . 0.0 110.692 179.371 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? -106.34 101.72 11.17 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 125.084 1.354 . . . . 0.0 108.979 -175.124 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.252 1.207 0 C-N-CA 128.512 2.725 . . . . 0.0 109.191 -172.027 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.357 0 N-CA-C 108.251 -1.94 . . . . 0.0 108.251 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 12.8 m -147.61 158.79 44.16 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 118.391 1.096 . . . . 0.0 111.272 -164.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -56.22 137.4 52.05 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 160.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.9 m -147.66 141.09 25.34 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.55 1.14 . . . . 0.0 108.544 -178.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . 0.25 12.6 ptt? -134.0 65.58 69.99 Favored Pre-proline 0 CA--C 1.545 0.779 0 N-CA-C 113.577 0.955 . . . . 0.0 113.577 -173.707 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -73.62 -3.92 14.55 Favored 'Trans proline' 0 CA--C 1.546 1.103 0 C-N-CA 123.1 2.534 . . . . 0.0 115.464 -178.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -94.95 45.9 2.09 Favored Glycine 0 N--CA 1.473 1.146 0 C-N-CA 125.219 1.39 . . . . 0.0 113.883 -174.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 5.4 mp -112.17 138.6 48.62 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 125.335 1.454 . . . . 0.0 111.373 -172.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 24.8 t 46.49 65.45 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 C-N-CA 126.071 1.748 . . . . 0.0 112.093 161.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 14.2 t0 -123.22 164.91 17.82 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -153.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 61.6 m -67.13 126.04 27.94 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.444 1.098 . . . . 0.0 112.778 -179.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -126.92 79.9 71.97 Favored Pre-proline 0 CA--C 1.542 0.67 0 C-N-CA 125.56 1.544 . . . . 0.0 108.307 174.64 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -78.95 179.69 6.25 Favored 'Trans proline' 0 N--CA 1.454 -0.82 0 C-N-CA 123.938 3.092 . . . . 0.0 111.962 -175.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.27 153.53 75.01 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 123.739 0.816 . . . . 0.0 112.923 172.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -69.63 165.53 30.49 Favored 'Trans proline' 0 CA--C 1.545 1.029 0 C-N-CA 123.294 2.662 . . . . 0.0 111.884 166.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -70.72 176.08 7.99 Favored 'Trans proline' 0 CA--C 1.537 0.657 0 C-N-CA 122.847 2.365 . . . . 0.0 112.313 169.17 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -74.81 154.75 38.16 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.302 1.041 . . . . 0.0 113.207 -178.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.7 p -155.37 -3.24 0.14 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 126.946 2.098 . . . . 0.0 114.944 -179.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -142.61 170.29 15.99 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 119.42 1.009 . . . . 0.0 109.937 -174.805 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -56.97 137.13 56.0 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 120.09 -1.631 . . . . 0.0 111.492 157.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -134.86 -175.64 3.97 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 130.141 3.376 . . . . 0.0 109.839 171.124 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 35.4 mmtm -129.38 150.54 75.84 Favored Pre-proline 0 N--CA 1.474 0.734 0 O-C-N 121.197 -0.939 . . . . 0.0 110.184 162.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -82.57 166.49 15.58 Favored 'Trans proline' 0 CA--C 1.534 0.494 0 C-N-CA 122.356 2.037 . . . . 0.0 113.5 -162.399 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.604 ' CD1' ' H ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -135.96 163.8 29.44 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.153 1.381 . . . . 0.0 109.353 171.271 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.604 ' H ' ' CD1' ' A' ' 24' ' ' LEU . 12.4 ptmm? -139.01 130.71 15.3 Favored Pre-proline 0 CA--C 1.536 0.429 0 C-N-CA 129.781 3.232 . . . . 0.0 106.342 -176.665 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -61.43 -28.9 84.39 Favored 'Trans proline' 0 CA--C 1.541 0.836 0 C-N-CA 123.939 3.092 . . . . 0.0 114.714 -154.46 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 29.3 p -71.95 -21.36 61.61 Favored 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 125.461 1.504 . . . . 0.0 113.961 177.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 99.2 m -100.68 -12.57 19.05 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.737 1.615 . . . . 0.0 114.085 -178.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.31 151.74 43.02 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.267 0.627 . . . . 0.0 110.666 -174.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 57.4 m 42.04 58.4 10.12 Favored Pre-proline 0 CA--C 1.552 1.032 0 N-CA-C 114.1 1.148 . . . . 0.0 114.1 -176.377 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -65.57 -30.84 51.43 Favored 'Trans proline' 0 CA--C 1.534 0.495 0 C-N-CA 123.729 2.953 . . . . 0.0 112.041 -166.092 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -41.5 -70.04 0.12 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 127.349 2.26 . . . . 0.0 115.31 158.365 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -65.25 -28.7 69.53 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.007 -1.058 . . . . 0.0 111.726 177.046 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 5.0 tmtt? -58.12 -46.69 85.15 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 120.359 1.436 . . . . 0.0 111.088 171.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 4.5 tmtm? -63.34 -45.06 92.98 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 123.721 0.808 . . . . 0.0 110.716 176.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.78 -42.4 97.46 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 176.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 11.4 ttp85 -59.45 -53.72 54.93 Favored 'General case' 0 C--O 1.221 -0.429 0 C-N-CA 126.148 1.779 . . . . 0.0 110.247 175.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 56.8 m-20 -66.19 -31.97 73.12 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.014 0.926 . . . . 0.0 113.137 179.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -69.22 -37.08 77.87 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 120.728 -1.232 . . . . 0.0 112.447 172.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 9.3 t -55.91 -43.21 77.08 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 121.949 0.88 . . . . 0.0 110.89 169.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 71.4 mt -69.16 -29.01 41.24 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 C-N-CA 124.319 1.048 . . . . 0.0 111.272 -179.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 89.3 mt -70.31 -35.15 61.41 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 C-N-CA 123.509 0.724 . . . . 0.0 112.092 169.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -76.41 -32.58 58.59 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 114.561 1.319 . . . . 0.0 114.561 178.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.2 -18.14 0.44 Allowed 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 117.238 2.31 . . . . 0.0 117.238 -175.413 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 91.33 174.66 43.47 Favored Glycine 0 CA--C 1.536 1.364 0 CA-C-N 118.868 0.758 . . . . 0.0 113.386 -167.179 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -79.6 -35.07 40.13 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 115.592 1.701 . . . . 0.0 115.592 -157.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -60.89 -34.38 74.56 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.086 0.954 . . . . 0.0 113.423 174.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 99.4 m-70 -81.92 9.16 8.7 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.574 1.15 . . . . 0.0 112.514 -178.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 9.8 m -140.03 12.56 2.43 Favored 'General case' 0 N--CA 1.441 -0.906 0 C-N-CA 125.805 1.642 . . . . 0.0 113.949 -162.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -63.96 -30.11 76.78 Favored Glycine 0 C--O 1.213 -1.182 0 O-C-N 120.126 -1.609 . . . . 0.0 114.973 179.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 40.6 p-80 -57.14 -28.17 62.51 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 121.537 2.668 . . . . 0.0 113.523 167.44 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.83 -36.38 56.9 Favored 'General case' 0 CA--C 1.522 -0.13 0 C-N-CA 123.721 0.808 . . . . 0.0 110.757 171.856 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.9 mt -72.04 -39.68 66.31 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 CA-C-O 119.321 -0.371 . . . . 0.0 110.64 179.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.15 -49.12 63.06 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 125.464 1.506 . . . . 0.0 111.594 -177.029 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -58.23 -45.23 88.08 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.912 0.885 . . . . 0.0 112.563 172.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 11.9 t60 -60.49 -45.66 92.93 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 122.184 0.992 . . . . 0.0 112.644 174.142 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 17.0 mtpp -55.34 -48.53 74.07 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.851 1.261 . . . . 0.0 111.283 174.027 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 60.3 mm-40 -60.15 -41.58 93.08 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 120.934 1.697 . . . . 0.0 111.244 177.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 41.8 t -55.88 -52.88 62.54 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.353 0.661 . . . . 0.0 111.582 178.173 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 71.4 mtm -60.32 -45.25 94.05 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.503 0.721 . . . . 0.0 111.116 172.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 25.2 mtm180 -54.67 -32.81 59.88 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 119.821 -1.799 . . . . 0.0 114.051 -178.101 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -44.63 -36.06 2.9 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.12 0.968 . . . . 0.0 113.445 169.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.8 mp -79.33 6.62 9.55 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 123.919 0.888 . . . . 0.0 112.644 -173.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 82.93 23.98 54.02 Favored Glycine 0 CA--C 1.534 1.241 0 C-N-CA 125.994 1.759 . . . . 0.0 112.399 -172.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -87.05 154.09 21.03 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.047 1.739 . . . . 0.0 113.052 -156.749 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.5 mmpt? -92.91 72.72 4.8 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.366 1.866 . . . . 0.0 110.543 -172.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 12.5 mm . . . . . 0 C--O 1.252 1.214 0 N-CA-C 114.966 1.469 . . . . 0.0 114.966 -151.781 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.148 0 N-CA-C 106.284 -2.727 . . . . 0.0 106.284 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 30.4 m -76.92 -71.8 0.38 Allowed 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 106.127 -1.805 . . . . 0.0 106.127 136.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 33.8 p90 -44.15 129.05 6.16 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.055 1.342 . . . . 0.0 112.156 158.31 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 25.1 m -152.03 140.71 20.83 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.999 1.32 . . . . 0.0 108.511 -175.138 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.61 57.92 4.54 Favored Pre-proline 0 CA--C 1.549 0.921 0 N-CA-C 113.843 1.053 . . . . 0.0 113.843 -163.929 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -78.23 -4.62 14.45 Favored 'Trans proline' 0 CA--C 1.545 1.052 0 C-N-CA 122.498 2.132 . . . . 0.0 114.088 177.044 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -122.32 83.63 0.36 Allowed Glycine 0 N--CA 1.469 0.85 0 C-N-CA 125.537 1.542 . . . . 0.0 111.309 -174.147 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -118.2 139.71 50.88 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 124.842 1.257 . . . . 0.0 112.962 -170.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 93.5 t 57.09 88.4 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 C-N-CA 126.83 2.052 . . . . 0.0 111.862 169.477 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -147.53 160.58 42.46 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 126.085 1.754 . . . . 0.0 110.716 -172.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 33.4 m -158.27 55.86 0.46 Allowed 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.847 1.659 . . . . 0.0 108.669 176.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -123.35 85.84 52.01 Favored Pre-proline 0 CA--C 1.548 0.866 0 C-N-CA 125.438 1.495 . . . . 0.0 107.117 -163.788 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_endo -87.53 177.55 3.68 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 124.281 3.32 . . . . 0.0 112.614 -167.384 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -98.69 157.03 34.95 Favored Pre-proline 0 CA--C 1.545 0.776 0 C-N-CA 124.858 1.263 . . . . 0.0 110.838 167.244 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -68.72 162.22 42.1 Favored 'Trans proline' 0 CA--C 1.545 1.048 0 C-N-CA 122.876 2.384 . . . . 0.0 112.323 169.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -72.5 179.37 5.19 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 123.291 2.66 . . . . 0.0 112.228 166.258 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -104.96 161.18 14.42 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.97 0.908 . . . . 0.0 111.369 174.254 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.4 m -66.54 154.23 40.91 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 116.642 2.09 . . . . 0.0 116.642 -161.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -69.87 62.66 0.19 Allowed 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 125.579 1.552 . . . . 0.0 112.007 153.322 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -130.76 161.54 31.49 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 120.829 -1.169 . . . . 0.0 111.212 175.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 22.5 tptt -81.76 41.41 0.65 Allowed 'General case' 0 CA--C 1.545 0.761 0 O-C-N 120.683 -1.261 . . . . 0.0 112.917 -178.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 36.4 mtpt -111.46 164.94 13.79 Favored Pre-proline 0 N--CA 1.478 0.958 0 C-N-CA 125.736 1.615 . . . . 0.0 112.988 -164.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -85.38 156.46 10.84 Favored 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 122.407 2.071 . . . . 0.0 112.413 -176.802 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.611 HD11 ' H ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -64.38 156.35 29.54 Favored 'General case' 0 CA--C 1.556 1.18 0 CA-C-N 114.108 -1.405 . . . . 0.0 110.828 164.454 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.611 ' H ' HD11 ' A' ' 24' ' ' LEU . 23.5 pttm -121.4 130.15 24.93 Favored Pre-proline 0 CA--C 1.539 0.551 0 C-N-CA 128.785 2.834 . . . . 0.0 108.011 173.927 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -60.82 -27.83 85.43 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 124.264 3.31 . . . . 0.0 114.636 -156.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 31.8 p -66.47 -20.76 66.13 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 126.126 1.77 . . . . 0.0 113.501 176.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 57.9 m -114.52 1.93 14.45 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.401 1.481 . . . . 0.0 114.422 -179.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.25 150.59 45.64 Favored 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 121.83 -0.544 . . . . 0.0 110.952 -178.168 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.2 m 44.52 61.53 11.19 Favored Pre-proline 0 CA--C 1.549 0.91 0 N-CA-C 112.535 0.568 . . . . 0.0 112.535 -175.377 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -67.36 -9.29 24.76 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 123.722 2.948 . . . . 0.0 112.944 -162.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 40.6 mm-40 -90.66 -48.69 6.91 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 126.589 1.956 . . . . 0.0 111.888 -178.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 9.1 p -65.79 -28.22 68.85 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 119.761 1.164 . . . . 0.0 111.862 163.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 24.3 tttt -57.94 -57.76 11.38 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.934 0.893 . . . . 0.0 110.476 169.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.0 mtmp? -58.73 -37.63 76.6 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.132 0.973 . . . . 0.0 112.718 176.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.86 -39.3 87.5 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 174.19 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 4.3 ttp180 -60.2 -53.05 62.37 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.388 1.075 . . . . 0.0 109.564 171.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -62.05 -37.91 86.74 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.46 1.504 . . . . 0.0 112.352 -177.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.29 -37.98 84.28 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 120.839 -1.163 . . . . 0.0 112.882 171.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.2 t -57.68 -36.14 71.53 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 122.298 1.047 . . . . 0.0 111.848 173.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 92.0 mt -70.82 -35.21 59.21 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 O-C-N 120.828 -1.17 . . . . 0.0 110.565 177.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 97.2 mt -64.59 -36.99 78.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 123.633 0.773 . . . . 0.0 112.189 169.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 67.2 mt-10 -65.37 -47.03 77.82 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 119.777 1.172 . . . . 0.0 113.276 177.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -151.99 -8.35 0.21 Allowed 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 -165.417 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 87.88 159.81 34.89 Favored Glycine 0 CA--C 1.524 0.619 0 CA-C-O 122.47 1.039 . . . . 0.0 111.799 -172.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -66.97 -28.53 68.34 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 -165.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -61.45 -25.55 67.3 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 113.828 1.048 . . . . 0.0 113.828 173.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 80.7 m-70 -96.71 18.06 15.17 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 120.646 1.567 . . . . 0.0 110.571 -177.116 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 5.9 m -146.99 14.27 1.15 Allowed 'General case' 0 N--CA 1.442 -0.863 0 N-CA-C 115.819 1.785 . . . . 0.0 115.819 -156.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -69.93 -27.44 73.09 Favored Glycine 0 N--CA 1.474 1.194 0 CA-C-N 122.12 2.236 . . . . 0.0 116.809 -174.012 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 43.4 p-80 -54.54 -26.18 30.35 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 120.811 2.305 . . . . 0.0 113.833 163.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.17 -35.52 36.38 Favored 'General case' 0 CA--C 1.518 -0.262 0 C-N-CA 123.476 0.711 . . . . 0.0 110.968 173.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 15.5 mt -71.69 -38.23 65.72 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 CA-C-O 119.42 -0.324 . . . . 0.0 110.697 177.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -73.53 -52.35 13.85 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 125.985 1.714 . . . . 0.0 114.619 -178.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -56.29 -35.68 67.76 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 122.005 0.907 . . . . 0.0 112.042 174.117 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 9.5 t60 -68.71 -48.41 63.91 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 113.589 0.959 . . . . 0.0 113.589 173.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.3 mtmt -46.99 -53.07 13.21 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.543 1.137 . . . . 0.0 111.395 172.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -65.15 -39.79 93.48 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.154 0.981 . . . . 0.0 112.101 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 18.8 t -54.21 -50.92 66.01 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 123.592 0.757 . . . . 0.0 112.149 172.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 71.0 mtm -60.15 -46.83 88.33 Favored 'General case' 0 N--CA 1.48 1.032 0 O-C-N 120.819 -1.176 . . . . 0.0 111.528 169.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 1.5 mtt180 -61.56 -25.82 67.56 Favored 'General case' 0 CA--C 1.53 0.197 0 O-C-N 119.943 -1.723 . . . . 0.0 113.641 -175.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -46.88 -33.0 4.16 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 124.724 1.21 . . . . 0.0 113.362 167.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.9 mp -81.74 9.65 7.54 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-O 121.64 0.733 . . . . 0.0 112.598 -174.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 71.2 25.89 74.69 Favored Glycine 0 CA--C 1.532 1.143 0 C-N-CA 125.947 1.737 . . . . 0.0 112.179 -169.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -74.47 147.12 42.21 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 126.034 1.733 . . . . 0.0 112.22 -162.388 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.35 77.94 3.11 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.991 1.316 . . . . 0.0 110.619 -175.794 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.107 0 C-N-CA 128.527 2.731 . . . . 0.0 108.042 179.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.329 0 N-CA-C 107.908 -2.077 . . . . 0.0 107.908 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.3 m -56.39 157.24 5.16 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 118.503 1.151 . . . . 0.0 111.917 165.154 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -155.11 171.37 19.89 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.929 1.291 . . . . 0.0 110.219 173.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 6.6 m 66.48 171.6 0.24 Allowed 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 125.647 1.579 . . . . 0.0 112.052 -175.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 22.3 ptm -132.9 58.37 35.08 Favored Pre-proline 0 CA--C 1.547 0.845 0 C-N-CA 125.032 1.333 . . . . 0.0 112.181 -178.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -77.33 -5.47 15.68 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 123.427 2.751 . . . . 0.0 114.471 -177.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -77.56 42.6 2.0 Favored Glycine 0 N--CA 1.474 1.226 0 C-N-CA 124.854 1.216 . . . . 0.0 114.368 -176.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 8.3 mp -123.89 136.18 54.18 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 126.312 1.845 . . . . 0.0 109.385 -172.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 18.9 t 40.78 77.06 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 126.062 1.745 . . . . 0.0 114.763 158.136 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -51.51 150.62 3.58 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.941 1.696 . . . . 0.0 114.683 175.207 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.8 p -50.39 53.41 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 130.981 3.712 . . . . 0.0 115.126 157.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -128.55 73.27 80.69 Favored Pre-proline 0 CA--C 1.539 0.543 0 O-C-N 120.448 -1.407 . . . . 0.0 110.53 -159.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_endo -76.65 -160.37 0.11 Allowed 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 125.008 3.805 . . . . 0.0 112.607 -173.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -137.95 159.74 67.31 Favored Pre-proline 0 CA--C 1.547 0.834 0 C-N-CA 126.83 2.052 . . . . 0.0 109.687 165.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -68.52 164.74 31.7 Favored 'Trans proline' 0 CA--C 1.545 1.04 0 C-N-CA 122.27 1.98 . . . . 0.0 111.739 167.089 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -68.27 -176.91 1.21 Allowed 'Trans proline' 0 CA--C 1.537 0.637 0 C-N-CA 122.688 2.259 . . . . 0.0 111.487 160.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -58.13 146.25 33.98 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 122.665 1.221 . . . . 0.0 113.25 165.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 18.4 m 179.34 165.95 1.02 Allowed 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 128.778 2.831 . . . . 0.0 108.715 -178.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -154.09 143.18 21.23 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.167 -0.958 . . . . 0.0 112.108 178.048 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.469 ' CD ' ' HZ3' ' A' ' 22' ' ' LYS . 36.4 mt-10 -138.22 149.39 45.74 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 124.641 1.176 . . . . 0.0 110.281 158.019 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -78.58 28.97 0.2 Allowed 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.654 1.582 . . . . 0.0 113.107 -179.872 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.469 ' HZ3' ' CD ' ' A' ' 20' ' ' GLU . 29.5 mttt -70.39 168.41 19.42 Favored Pre-proline 0 N--CA 1.472 0.643 0 C-N-CA 127.967 2.507 . . . . 0.0 114.281 -172.07 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -82.38 162.9 17.21 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.806 2.338 . . . . 0.0 111.285 163.093 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.583 ' CD1' ' H ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -77.25 163.69 26.27 Favored 'General case' 0 CA--C 1.552 1.047 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.835 167.347 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.583 ' H ' ' CD1' ' A' ' 24' ' ' LEU . 12.5 ptmm? -139.53 128.77 13.87 Favored Pre-proline 0 CA--C 1.536 0.429 0 C-N-CA 130.293 3.437 . . . . 0.0 105.846 178.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -57.93 -40.09 80.97 Favored 'Trans proline' 0 CA--C 1.538 0.704 0 C-N-CA 123.864 3.043 . . . . 0.0 114.288 -152.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 28.7 p -60.62 -25.92 66.62 Favored 'General case' 0 CA--C 1.557 1.249 0 C-N-CA 125.754 1.621 . . . . 0.0 113.91 178.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.406 ' SG ' ' NZ ' ' A' ' 25' ' ' LYS . 90.2 m -95.82 -7.44 36.98 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 126.0 1.72 . . . . 0.0 114.079 179.109 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.19 147.74 52.87 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 121.467 -0.771 . . . . 0.0 110.436 -175.288 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 33.5 m 42.66 59.78 10.47 Favored Pre-proline 0 CA--C 1.549 0.937 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -171.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -63.9 -29.9 67.49 Favored 'Trans proline' 0 CA--C 1.537 0.669 0 C-N-CA 122.843 2.362 . . . . 0.0 111.745 -170.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.511 ' HG3' ' H ' ' A' ' 33' ' ' THR . 0.3 OUTLIER -39.81 -69.76 0.12 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 127.064 2.146 . . . . 0.0 114.842 161.413 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.511 ' H ' ' HG3' ' A' ' 32' ' ' GLU . 0.0 OUTLIER -74.43 -23.74 58.97 Favored 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 124.939 1.296 . . . . 0.0 111.464 -178.842 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 4.7 tmtt? -58.31 -49.62 76.52 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 119.797 1.18 . . . . 0.0 111.207 167.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.1 tmtp? -62.52 -43.66 98.27 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.454 0.702 . . . . 0.0 111.309 177.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.44 -42.23 95.66 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 113.182 0.808 . . . . 0.0 113.182 174.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 8.1 ttp85 -59.8 -52.79 63.97 Favored 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 125.639 1.576 . . . . 0.0 110.326 174.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 61.8 m-20 -65.06 -32.14 73.71 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.63 0.772 . . . . 0.0 112.862 179.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -65.85 -36.37 83.27 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 120.781 -1.199 . . . . 0.0 113.015 170.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 11.3 t -59.62 -44.04 93.59 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 121.921 0.867 . . . . 0.0 111.121 168.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 58.4 mt -68.91 -32.5 54.87 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 C-N-CA 124.263 1.025 . . . . 0.0 110.966 -178.604 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 35.4 mt -60.82 -39.71 82.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 124.1 0.96 . . . . 0.0 112.328 167.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -70.26 -44.5 68.32 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 177.061 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.37 -10.41 1.09 Allowed 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 117.133 2.271 . . . . 0.0 117.133 -165.477 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.25 175.96 49.35 Favored Glycine 0 CA--C 1.533 1.202 0 CA-C-N 119.203 0.911 . . . . 0.0 113.252 -165.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -83.81 -30.44 26.55 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 115.065 1.505 . . . . 0.0 115.065 -156.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -62.86 -32.61 73.88 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.079 0.952 . . . . 0.0 113.567 174.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -85.16 12.22 8.32 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.792 1.237 . . . . 0.0 112.595 -178.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 9.7 m -138.41 13.51 2.78 Favored 'General case' 0 N--CA 1.445 -0.701 0 C-N-CA 125.592 1.557 . . . . 0.0 114.354 -163.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -62.77 -33.37 86.67 Favored Glycine 0 C--O 1.216 -1.029 0 CA-C-O 117.844 -1.531 . . . . 0.0 115.728 -176.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 41.1 p-80 -55.95 -29.97 60.98 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 121.095 2.447 . . . . 0.0 113.415 168.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.35 -33.45 42.96 Favored 'General case' 0 CA--C 1.519 -0.219 0 C-N-CA 124.428 1.091 . . . . 0.0 110.76 173.505 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 37.1 mt -72.51 -37.74 57.88 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.564 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 177.354 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -72.37 -53.07 13.37 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.818 1.647 . . . . 0.0 114.239 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.08 -31.95 53.36 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 118.951 0.796 . . . . 0.0 112.834 174.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 10.5 t60 -74.12 -51.13 16.59 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.719 1.608 . . . . 0.0 113.986 170.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -48.52 -54.44 14.36 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 125.346 1.459 . . . . 0.0 110.378 176.17 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -61.22 -39.03 88.77 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.526 0.73 . . . . 0.0 112.204 -177.329 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 34.5 t -53.64 -48.43 69.37 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 124.231 1.013 . . . . 0.0 113.122 169.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 23.8 mtp -62.87 -53.06 59.99 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 125.468 1.507 . . . . 0.0 110.389 172.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 22.1 mtp85 -52.52 -33.91 47.35 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 127.977 2.511 . . . . 0.0 115.21 -176.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -42.88 -35.07 1.08 Allowed 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.841 1.257 . . . . 0.0 114.025 167.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.2 mp -81.14 5.48 16.65 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.383 1.073 . . . . 0.0 112.784 -173.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.73 15.58 70.25 Favored Glycine 0 CA--C 1.536 1.352 0 C-N-CA 125.94 1.733 . . . . 0.0 112.797 -169.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -75.09 142.92 43.61 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.946 2.098 . . . . 0.0 112.353 -168.591 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.1 mppt? -92.9 82.73 4.68 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.138 1.375 . . . . 0.0 108.909 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 4.3 mm . . . . . 0 C--O 1.254 1.328 0 C-N-CA 131.11 3.764 . . . . 0.0 107.801 -165.922 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.407 0 N-CA-C 109.476 -1.45 . . . . 0.0 109.476 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 24.2 p -155.78 -42.34 0.08 Allowed 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.146 0.979 . . . . 0.0 112.148 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 -130.54 171.91 12.5 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 125.828 1.651 . . . . 0.0 109.875 179.367 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 8.5 m -153.55 -45.71 0.09 Allowed 'General case' 0 N--CA 1.483 1.22 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 174.584 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 25.0 tpp 33.08 68.58 0.96 Allowed Pre-proline 0 N--CA 1.483 1.213 0 C-N-CA 125.531 1.532 . . . . 0.0 114.684 -172.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -80.39 42.43 1.32 Allowed 'Trans proline' 0 CA--C 1.548 1.22 0 C-N-CA 122.273 1.982 . . . . 0.0 112.296 176.381 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -130.78 -64.91 0.1 OUTLIER Glycine 0 N--CA 1.472 1.085 0 C-N-CA 124.261 0.934 . . . . 0.0 112.319 176.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.3 mt 57.19 -144.85 0.63 Allowed 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.338 1.055 . . . . 0.0 112.338 173.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 25.6 t 70.82 -14.41 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 127.79 2.436 . . . . 0.0 116.689 165.46 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 26.95 46.26 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.955 1 C-N-CA 131.778 4.031 . . . . 0.0 116.67 158.417 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 4.7 t -161.33 -152.23 0.25 Allowed 'General case' 0 CA--C 1.543 0.675 0 O-C-N 120.596 -1.315 . . . . 0.0 112.314 -169.177 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 63.85 64.3 1.33 Allowed Pre-proline 0 CA--C 1.548 0.879 0 C-N-CA 127.08 2.152 . . . . 0.0 112.027 -171.731 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_endo -73.38 -179.75 4.73 Favored 'Trans proline' 0 CA--C 1.543 0.943 0 C-N-CA 123.851 3.034 . . . . 0.0 111.684 176.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -145.38 162.09 38.54 Favored Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 125.659 1.583 . . . . 0.0 111.35 -176.207 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -68.93 154.69 70.45 Favored 'Trans proline' 0 CA--C 1.547 1.146 0 C-N-CA 122.807 2.338 . . . . 0.0 112.418 169.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -81.82 -179.37 4.77 Favored 'Trans proline' 0 CA--C 1.542 0.916 0 C-N-CA 124.113 3.209 . . . . 0.0 113.703 175.279 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -74.78 -172.07 1.47 Allowed 'General case' 0 CA--C 1.557 1.236 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.514 155.356 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.2 m -51.51 159.83 0.68 Allowed 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 115.381 1.622 . . . . 0.0 115.381 176.179 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -126.73 -3.33 6.58 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 115.343 -0.844 . . . . 0.0 113.121 166.64 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -60.21 -179.02 0.09 Allowed 'General case' 0 CA--C 1.54 0.592 0 O-C-N 120.646 -1.284 . . . . 0.0 112.155 162.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -74.44 52.5 0.49 Allowed 'General case' 0 CA--C 1.542 0.654 0 O-C-N 120.21 -1.556 . . . . 0.0 113.706 171.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 10.8 mptt -65.43 166.25 14.85 Favored Pre-proline 0 CA--C 1.545 0.781 0 C-N-CA 125.522 1.529 . . . . 0.0 111.17 160.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -79.94 -174.93 2.46 Favored 'Trans proline' 0 N--CA 1.459 -0.511 0 C-N-CA 123.051 2.5 . . . . 0.0 111.299 160.12 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -127.33 156.74 41.5 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.567 170.149 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.2 mtmm -93.49 143.04 25.99 Favored Pre-proline 0 CA--C 1.535 0.393 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 177.655 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_endo -71.88 -9.99 25.58 Favored 'Trans proline' 0 CA--C 1.535 0.571 0 C-N-CA 123.492 2.795 . . . . 0.0 113.165 -175.36 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . 0.251 22.2 p -101.03 -40.7 7.1 Favored 'General case' 0 N--CA 1.44 -0.956 0 C-N-CA 127.722 2.409 . . . . 0.0 111.063 179.735 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 64.4 m -97.7 -10.88 24.18 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 115.979 1.844 . . . . 0.0 115.979 -173.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.88 149.47 14.9 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 119.716 1.144 . . . . 0.0 110.047 162.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 83.6 m 52.4 54.27 13.51 Favored Pre-proline 0 CA--C 1.552 1.034 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -178.134 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -73.59 -5.47 17.14 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 123.169 2.579 . . . . 0.0 112.694 -162.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -101.37 -40.51 7.07 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 125.058 1.343 . . . . 0.0 112.521 -177.187 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.3 p -60.8 -34.62 74.78 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-O 117.765 -1.112 . . . . 0.0 110.278 157.664 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 2.0 ttmt -58.21 -54.86 42.26 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 119.598 1.09 . . . . 0.0 112.244 169.111 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.76 -49.22 58.64 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.819 0.847 . . . . 0.0 112.135 176.621 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.19 -37.05 84.66 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 114.674 -1.148 . . . . 0.0 113.268 176.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 3.4 ttp180 -58.1 -56.03 27.36 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.142 1.377 . . . . 0.0 109.126 173.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -65.41 -37.15 86.09 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.423 1.489 . . . . 0.0 111.265 -173.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.25 -43.4 98.11 Favored 'General case' 0 CA--C 1.545 0.788 0 O-C-N 120.983 -1.073 . . . . 0.0 113.255 170.381 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -58.74 -34.21 71.13 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.177 -0.952 . . . . 0.0 111.232 172.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 81.8 mt -75.55 -35.53 32.26 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 O-C-N 120.911 -1.118 . . . . 0.0 111.642 177.22 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 70.2 mt -62.29 -34.18 62.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 124.309 1.044 . . . . 0.0 111.587 169.325 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -70.87 -41.57 71.22 Favored 'General case' 0 CA--C 1.555 1.159 0 N-CA-C 114.183 1.179 . . . . 0.0 114.183 177.02 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.58 -11.59 0.24 Allowed 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 117.586 2.439 . . . . 0.0 117.586 -170.633 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 86.13 159.96 33.29 Favored Glycine 0 CA--C 1.534 1.266 0 CA-C-N 119.224 0.92 . . . . 0.0 112.525 -161.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -73.2 -33.97 65.7 Favored 'General case' 0 C--N 1.337 0.065 0 O-C-N 120.741 -1.446 . . . . 0.0 113.623 -166.397 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -53.82 -36.83 62.93 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.782 0.833 . . . . 0.0 112.534 176.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 79.8 m-70 -87.55 12.45 12.41 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.6 1.56 . . . . 0.0 112.937 178.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -146.38 5.08 0.93 Allowed 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.863 1.665 . . . . 0.0 113.831 -170.312 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -60.73 -14.55 37.15 Favored Glycine 0 N--CA 1.474 1.178 0 N-CA-C 118.69 2.236 . . . . 0.0 118.69 -160.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 30.2 p-80 -55.3 -36.27 66.01 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 121.08 2.44 . . . . 0.0 112.87 164.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.41 -42.24 96.18 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 125.157 1.383 . . . . 0.0 110.75 172.402 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 4.2 mp -72.9 -37.98 55.57 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.344 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.177 -178.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.461 ' HA ' ' HE3' ' A' ' 57' ' ' LYS . 3.5 mm-40 -64.85 -52.65 55.51 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 123.511 0.725 . . . . 0.0 112.557 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.76 -39.97 86.63 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.628 0.771 . . . . 0.0 112.61 177.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 16.1 t60 -65.81 -48.13 72.77 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 123.438 0.695 . . . . 0.0 112.576 174.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.461 ' HE3' ' HA ' ' A' ' 54' ' ' GLU . 1.6 mtmp? -52.56 -46.47 66.84 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-O 118.968 -0.539 . . . . 0.0 111.669 171.467 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -65.15 -37.6 87.91 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 123.895 0.878 . . . . 0.0 112.793 177.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 49.7 t -56.97 -52.82 63.7 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 118.795 0.725 . . . . 0.0 111.912 169.367 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 77.6 mtm -56.94 -48.93 77.15 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.32 1.048 . . . . 0.0 111.714 173.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.515 ' HE ' ' C ' ' A' ' 67' ' ' ILE . 11.5 mtt-85 -56.49 -30.3 62.81 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.26 1.824 . . . . 0.0 114.374 -176.474 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -46.26 -31.61 2.61 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.166 0.986 . . . . 0.0 113.284 167.518 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.2 mp -84.47 4.75 30.29 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 123.802 0.841 . . . . 0.0 112.364 -173.347 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.58 19.35 71.3 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 124.507 1.051 . . . . 0.0 112.547 -168.399 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -74.94 141.74 44.03 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 126.607 1.963 . . . . 0.0 110.601 178.197 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.5 mppt? -100.15 76.8 1.93 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 125.077 1.351 . . . . 0.0 109.593 -171.371 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.515 ' C ' ' HE ' ' A' ' 61' ' ' ARG . 0.2 OUTLIER . . . . . 0 C--O 1.248 0.99 0 CA-C-O 116.913 -1.518 . . . . 0.0 111.076 -171.28 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.385 0 N-CA-C 108.614 -1.794 . . . . 0.0 108.614 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.6 m -141.24 138.71 33.45 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.308 1.043 . . . . 0.0 108.746 -173.208 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 45.8 m-85 -142.26 35.74 1.52 Allowed 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.235 0.614 . . . . 0.0 111.748 -159.415 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -139.05 143.28 38.3 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.353 1.061 . . . . 0.0 110.339 -165.852 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 12.3 tpt -128.12 70.24 78.33 Favored Pre-proline 0 CA--C 1.543 0.674 0 C-N-CA 124.537 1.135 . . . . 0.0 110.482 179.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -68.36 2.65 2.64 Favored 'Trans proline' 0 CA--C 1.543 0.948 0 C-N-CA 123.963 3.109 . . . . 0.0 115.904 -172.315 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -160.04 137.83 5.25 Favored Glycine 0 CA--C 1.53 0.997 0 C-N-CA 124.604 1.097 . . . . 0.0 110.531 170.26 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -168.02 171.87 9.31 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.924 1.689 . . . . 0.0 110.854 -173.212 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 10.7 p -149.29 155.9 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 C-N-CA 125.489 1.516 . . . . 0.0 109.527 177.449 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -62.5 137.88 58.35 Favored 'General case' 0 CA--C 1.548 0.87 0 O-C-N 121.567 -0.708 . . . . 0.0 111.415 172.302 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 58.7 m -82.35 136.57 34.97 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 121.563 -0.711 . . . . 0.0 112.025 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -138.4 71.65 45.37 Favored Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 124.594 1.158 . . . . 0.0 111.092 -174.396 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -73.88 128.65 12.6 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 123.177 2.585 . . . . 0.0 110.731 -176.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -148.8 161.57 32.45 Favored Pre-proline 0 CA--C 1.545 0.776 0 C-N-CA 126.314 1.846 . . . . 0.0 111.348 -177.312 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -72.11 151.44 55.47 Favored 'Trans proline' 0 CA--C 1.546 1.115 0 C-N-CA 122.515 2.144 . . . . 0.0 112.263 168.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -76.65 178.97 6.92 Favored 'Trans proline' 0 CA--C 1.537 0.666 0 C-N-CA 123.438 2.759 . . . . 0.0 112.183 164.692 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.432 ' CD ' ' H ' ' A' ' 18' ' ' SER . 0.0 OUTLIER -91.01 -46.15 8.31 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.657 1.583 . . . . 0.0 112.351 170.146 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.432 ' H ' ' CD ' ' A' ' 17' ' ' GLU . 58.3 m -169.94 -23.72 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 128.099 2.56 . . . . 0.0 114.62 -177.78 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 35.83 51.36 0.71 Allowed 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 128.256 2.622 . . . . 0.0 113.42 -175.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 5.0 tm-20 -90.88 -171.17 2.92 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.065 1.346 . . . . 0.0 112.466 -166.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 8.7 mtmp? -71.98 51.54 0.22 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 126.927 2.091 . . . . 0.0 113.3 -179.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 7.7 mtpp -100.99 152.83 37.95 Favored Pre-proline 0 N--CA 1.476 0.848 0 C-N-CA 124.5 1.12 . . . . 0.0 112.547 -164.269 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -74.88 176.86 9.31 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.337 2.025 . . . . 0.0 111.402 165.211 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.6 mt -135.51 165.49 25.39 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-O 122.294 1.045 . . . . 0.0 113.604 174.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.1 mtpt -122.79 136.59 26.91 Favored Pre-proline 0 N--CA 1.464 0.233 0 C-N-CA 127.541 2.337 . . . . 0.0 106.24 174.041 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -64.48 -42.3 17.23 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 C-N-CA 121.619 1.546 . . . . 0.0 111.016 -172.153 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 29.4 p -58.9 -36.31 74.46 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 126.268 1.827 . . . . 0.0 113.257 176.05 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 93.3 m -90.68 -10.45 43.11 Favored 'General case' 0 CA--C 1.554 1.097 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 177.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.76 -31.85 35.75 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 114.582 1.327 . . . . 0.0 114.582 -175.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 3.4 m -124.23 61.79 27.81 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 127.892 2.477 . . . . 0.0 110.441 168.362 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_endo -71.3 -18.17 30.34 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 122.634 2.223 . . . . 0.0 112.355 -170.268 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 36.9 mm-40 -81.57 -40.41 23.09 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.132 1.373 . . . . 0.0 112.554 -176.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.0 p -70.02 -30.45 67.75 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 120.879 -1.138 . . . . 0.0 111.741 161.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 10.1 tmtt? -58.85 -44.78 91.08 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 120.551 1.523 . . . . 0.0 112.201 170.486 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.1 mttt -52.95 -51.66 60.66 Favored 'General case' 0 C--O 1.223 -0.3 0 C-N-CA 127.52 2.328 . . . . 0.0 111.243 172.021 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.32 -37.77 80.91 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 178.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.402 HH12 ' CD ' ' A' ' 46' ' ' GLU . 6.5 ttp85 -57.95 -51.9 67.73 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.705 1.202 . . . . 0.0 109.566 174.83 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -73.25 -30.14 63.25 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.11 0.964 . . . . 0.0 113.14 -178.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.26 -39.27 92.35 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 120.644 -1.285 . . . . 0.0 111.946 167.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.8 t -60.35 -32.88 71.68 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 122.45 1.119 . . . . 0.0 112.322 172.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 70.4 mt -75.84 -33.83 26.55 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 124.528 1.131 . . . . 0.0 111.807 176.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 88.5 mt -66.34 -34.53 70.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 124.564 1.146 . . . . 0.0 111.724 168.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -71.18 -38.86 72.12 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 174.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.9 mppt? -140.87 -59.17 0.51 Allowed 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.384 1.473 . . . . 0.0 113.944 -177.027 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 137.54 160.73 8.66 Favored Glycine 0 CA--C 1.533 1.181 0 C-N-CA 126.144 1.83 . . . . 0.0 109.659 -158.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.402 ' CD ' HH12 ' A' ' 37' ' ' ARG . 0.3 OUTLIER -73.8 -29.51 62.21 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 119.219 1.51 . . . . 0.0 112.529 -168.77 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 22.9 pt-20 -58.36 -34.02 70.21 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 123.274 0.63 . . . . 0.0 112.204 179.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 98.5 m-70 -82.71 5.4 21.43 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.136 1.374 . . . . 0.0 113.148 177.764 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 4.3 m -145.52 20.28 1.51 Allowed 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 125.541 1.536 . . . . 0.0 112.258 -154.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -70.3 -17.0 73.81 Favored Glycine 0 C--O 1.219 -0.784 0 O-C-N 120.131 -1.606 . . . . 0.0 115.306 177.211 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 41.5 p-80 -61.17 -30.44 70.41 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 120.213 2.007 . . . . 0.0 112.35 161.196 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -80.29 -35.21 36.16 Favored 'General case' 0 C--O 1.232 0.177 0 C-N-CA 124.225 1.01 . . . . 0.0 111.073 174.637 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 10.4 mt -66.38 -42.47 90.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 CA-C-O 118.105 -0.95 . . . . 0.0 109.79 173.118 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.57 -53.96 49.41 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 118.526 0.603 . . . . 0.0 111.655 178.618 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.94 -39.27 68.7 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 120.952 -1.092 . . . . 0.0 113.271 179.459 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 13.5 t60 -69.49 -41.98 75.38 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 124.987 1.315 . . . . 0.0 114.253 173.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 39.5 mtpt -56.29 -52.7 63.55 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.49 1.116 . . . . 0.0 111.795 175.255 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -61.9 -39.62 92.61 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 123.093 0.557 . . . . 0.0 111.718 177.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 49.4 t -48.92 -59.74 3.34 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-O 118.709 -0.662 . . . . 0.0 111.503 170.28 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 74.2 mtm -56.43 -50.81 70.58 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.173 0.989 . . . . 0.0 111.763 174.663 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 74.3 mtt180 -54.04 -33.03 56.23 Favored 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 120.232 -1.542 . . . . 0.0 113.941 -174.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -44.19 -42.8 6.71 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.864 1.266 . . . . 0.0 113.837 166.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.4 mp -79.25 9.12 4.9 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.432 1.493 . . . . 0.0 111.777 -173.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 82.38 16.7 70.7 Favored Glycine 0 CA--C 1.532 1.135 0 C-N-CA 124.42 1.009 . . . . 0.0 113.636 -173.328 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -65.39 164.61 13.4 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 119.091 1.445 . . . . 0.0 112.385 -178.059 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.02 97.87 5.44 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 120.449 -1.407 . . . . 0.0 109.64 -177.838 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.15 0 C-N-CA 129.742 3.217 . . . . 0.0 107.735 -169.014 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.313 0 N-CA-C 105.557 -3.017 . . . . 0.0 105.557 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.6 m -50.15 157.72 0.63 Allowed 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 117.266 0.533 . . . . 0.0 110.751 140.38 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 37.4 p90 -159.66 -178.0 6.78 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.277 1.831 . . . . 0.0 109.331 179.285 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.2 m -135.94 148.53 48.56 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.679 0.791 . . . . 0.0 109.022 172.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 20.3 ptm -141.03 58.82 9.76 Favored Pre-proline 0 CA--C 1.546 0.799 0 C-N-CA 123.98 0.912 . . . . 0.0 113.146 -174.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -71.39 7.42 1.49 Allowed 'Trans proline' 0 CA--C 1.547 1.14 0 C-N-CA 123.914 3.076 . . . . 0.0 115.898 -170.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -82.83 41.19 2.84 Favored Glycine 0 CA--C 1.535 1.297 0 CA-C-N 119.876 1.216 . . . . 0.0 114.551 -175.078 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 5.9 mp -116.04 156.32 26.55 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 125.579 1.552 . . . . 0.0 112.7 -169.232 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 9.2 p -158.81 167.86 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 C-N-CA 127.1 2.16 . . . . 0.0 108.817 176.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -136.98 151.96 49.59 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.724 1.21 . . . . 0.0 109.598 165.18 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.9 t 54.39 -168.97 0.07 Allowed 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.854 1.661 . . . . 0.0 114.513 177.267 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -151.44 71.25 8.31 Favored Pre-proline 0 CA--C 1.544 0.741 0 C-N-CA 125.012 1.325 . . . . 0.0 109.914 169.228 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -70.24 102.67 1.13 Allowed 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 123.645 2.896 . . . . 0.0 111.766 -179.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -153.39 159.92 31.56 Favored Pre-proline 0 CA--C 1.544 0.716 0 C-N-CA 125.567 1.547 . . . . 0.0 112.053 -176.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -72.39 163.64 38.0 Favored 'Trans proline' 0 CA--C 1.546 1.084 0 C-N-CA 122.639 2.226 . . . . 0.0 111.168 161.41 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -76.01 176.84 9.51 Favored 'Trans proline' 0 CA--C 1.536 0.597 0 C-N-CA 122.699 2.266 . . . . 0.0 112.263 165.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -136.74 164.98 26.99 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.597 1.959 . . . . 0.0 111.545 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 93.9 p -53.43 151.21 5.79 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.313 1.845 . . . . 0.0 113.112 168.026 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.26 146.16 48.3 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 123.776 0.831 . . . . 0.0 110.526 173.361 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.05 -164.54 0.14 Allowed 'General case' 0 CA--C 1.543 0.677 0 CA-C-O 122.0 0.905 . . . . 0.0 111.029 168.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.21 45.79 1.09 Allowed 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.798 2.039 . . . . 0.0 109.208 178.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 26.1 mttp -145.84 167.84 13.24 Favored Pre-proline 0 N--CA 1.469 0.521 0 C-N-CA 126.364 1.865 . . . . 0.0 113.636 -165.29 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -63.15 109.53 0.98 Allowed 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 122.074 1.849 . . . . 0.0 107.716 158.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.576 ' CD1' ' H ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER 55.67 -162.56 0.16 Allowed 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 124.558 1.143 . . . . 0.0 112.591 -171.896 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.576 ' H ' ' CD1' ' A' ' 24' ' ' LEU . 5.4 ptmt -135.69 149.46 69.09 Favored Pre-proline 0 CA--C 1.543 0.683 1 C-N-CA 132.129 4.172 . . . . 0.0 106.038 169.122 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -71.15 -13.89 31.4 Favored 'Trans proline' 0 CA--C 1.535 0.558 0 C-N-CA 123.887 3.058 . . . . 0.0 115.168 -166.499 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.519 ' SG ' ' HE2' ' A' ' 25' ' ' LYS . 20.6 p -97.12 -33.92 11.33 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 126.74 2.016 . . . . 0.0 111.863 -174.313 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 99.0 m -87.43 -15.9 36.39 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.001 1.321 . . . . 0.0 114.051 177.249 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.36 142.85 30.65 Favored 'General case' 0 CA--C 1.533 0.291 0 O-C-N 121.738 -0.601 . . . . 0.0 111.902 -177.536 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 9.1 m 46.88 60.68 14.63 Favored Pre-proline 0 CA--C 1.548 0.886 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -173.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -66.63 -19.62 53.87 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.792 2.328 . . . . 0.0 111.555 -165.231 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.6 mm-40 -75.12 -49.3 20.04 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 125.951 1.701 . . . . 0.0 112.369 -179.143 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.7 p -69.09 -26.21 64.81 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 118.334 -0.841 . . . . 0.0 112.034 166.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 10.3 tmtt? -61.51 -50.96 70.61 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 119.969 1.259 . . . . 0.0 111.405 170.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 25.6 ttpt -54.22 -48.2 71.31 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 127.666 2.386 . . . . 0.0 111.485 172.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.74 -41.49 98.03 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 176.275 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 4.1 ttp180 -58.85 -55.59 33.11 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.736 1.214 . . . . 0.0 109.385 174.344 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -61.19 -37.32 82.51 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.169 1.388 . . . . 0.0 112.858 -179.081 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.65 -35.77 79.5 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.081 -1.012 . . . . 0.0 112.89 172.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.9 t -59.16 -41.59 88.74 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.339 -0.85 . . . . 0.0 111.298 170.488 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 78.5 mt -70.27 -31.36 46.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 C-N-CA 124.899 1.28 . . . . 0.0 111.267 -178.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 60.7 mt -60.56 -44.34 96.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 CA-C-N 118.765 0.712 . . . . 0.0 111.185 165.653 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -71.3 -35.18 71.18 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 115.218 1.562 . . . . 0.0 115.218 -174.563 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.4 -10.49 0.48 Allowed 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 117.061 2.245 . . . . 0.0 117.061 -177.7 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 84.63 172.25 48.9 Favored Glycine 0 CA--C 1.531 1.087 0 CA-C-N 119.367 0.985 . . . . 0.0 112.052 -165.612 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -81.75 -35.54 29.54 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 114.981 1.475 . . . . 0.0 114.981 -159.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -55.05 -37.25 66.47 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 174.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -80.36 5.84 13.77 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.2 1.4 . . . . 0.0 113.008 -179.244 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 2.3 m -137.17 18.0 2.98 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 125.846 1.658 . . . . 0.0 113.589 -164.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . 0.4 ' HA2' ' CD1' ' A' ' 53' ' ' ILE . . . -75.99 -14.9 81.78 Favored Glycine 0 N--CA 1.467 0.742 0 O-C-N 119.706 -1.871 . . . . 0.0 117.52 -174.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 40.3 p-80 -59.3 -31.31 69.02 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.844 1.822 . . . . 0.0 112.321 157.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.19 -37.76 52.94 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 123.449 0.7 . . . . 0.0 109.923 177.162 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.4 ' CD1' ' HA2' ' A' ' 50' ' ' GLY . 14.7 mt -67.44 -40.73 85.12 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.358 0 CA-C-O 119.301 -0.381 . . . . 0.0 109.974 177.259 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -65.36 -54.33 30.38 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.209 1.004 . . . . 0.0 113.409 178.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -57.03 -35.6 69.47 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 119.008 0.822 . . . . 0.0 112.315 179.008 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 7.6 t60 -69.97 -47.36 62.6 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 173.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -50.32 -52.07 39.89 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 125.193 1.397 . . . . 0.0 112.051 177.331 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -66.4 -36.86 83.9 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.117 0.567 . . . . 0.0 111.964 -177.468 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 17.5 t -52.9 -56.02 18.96 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.522 0.729 . . . . 0.0 112.866 168.559 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 7.7 mtt -53.06 -52.2 59.32 Favored 'General case' 0 N--CA 1.487 1.387 0 CA-C-N 119.888 1.222 . . . . 0.0 110.983 170.438 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 30.3 mtt180 -55.42 -31.44 61.88 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 125.774 1.63 . . . . 0.0 114.69 -174.053 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -45.84 -36.29 5.13 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.338 1.055 . . . . 0.0 113.053 169.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.1 mp -80.5 4.26 18.88 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.559 1.143 . . . . 0.0 112.248 -172.311 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 94.62 4.39 62.14 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 125.546 1.546 . . . . 0.0 113.446 -171.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.44 ' C ' ' HE3' ' A' ' 66' ' ' LYS . 1.3 m-85 -70.64 150.41 46.04 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 126.353 1.861 . . . . 0.0 113.45 -171.833 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.44 ' HE3' ' C ' ' A' ' 65' ' ' PHE . 0.0 OUTLIER -114.32 76.67 1.0 Allowed 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.661 1.584 . . . . 0.0 108.893 -163.402 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.026 0 C-N-CA 127.395 2.278 . . . . 0.0 109.504 -173.356 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.447 0 N-CA-C 109.144 -1.582 . . . . 0.0 109.144 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 71.7 p -160.92 176.79 11.04 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.812 1.245 . . . . 0.0 110.701 -173.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 45.2 m-85 -51.94 142.85 14.76 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 153.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 4.3 m -150.89 150.38 30.81 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.807 1.243 . . . . 0.0 108.852 -177.044 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.7 tpt -132.03 73.19 78.47 Favored Pre-proline 0 N--CA 1.471 0.595 0 C-N-CA 124.367 1.067 . . . . 0.0 110.827 178.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -72.27 36.46 0.33 Allowed 'Trans proline' 0 CA--C 1.547 1.175 0 C-N-CA 124.243 3.295 . . . . 0.0 113.428 177.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -135.32 -87.79 0.26 Allowed Glycine 0 CA--C 1.53 0.973 0 O-C-N 121.584 -0.698 . . . . 0.0 114.054 176.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.7 mm? 51.41 -149.24 0.33 Allowed 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 117.365 0.582 . . . . 0.0 111.381 -157.259 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 75.1 t 65.54 41.67 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 CA-C-O 124.522 2.106 . . . . 0.0 110.74 167.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -38.5 131.84 1.2 Allowed 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 129.47 3.108 . . . . 0.0 115.082 -179.049 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.3 t -59.15 76.3 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 128.202 2.601 . . . . 0.0 114.407 -171.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -148.31 70.37 10.78 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 124.942 1.297 . . . . 0.0 110.575 -168.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_endo -78.99 -174.25 2.21 Favored 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 124.349 3.366 . . . . 0.0 110.909 170.306 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -137.32 156.52 75.2 Favored Pre-proline 0 CA--C 1.542 0.656 0 C-N-CA 124.547 1.139 . . . . 0.0 111.432 172.393 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -70.79 152.83 64.27 Favored 'Trans proline' 0 CA--C 1.543 0.944 0 C-N-CA 122.337 2.025 . . . . 0.0 110.978 165.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_endo -74.25 174.6 12.22 Favored 'Trans proline' 0 CA--C 1.536 0.584 0 C-N-CA 122.482 2.121 . . . . 0.0 111.884 169.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.04 142.54 36.44 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 161.606 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 16.6 p -54.18 135.03 44.45 Favored 'General case' 0 C--O 1.238 0.49 0 O-C-N 121.626 -0.671 . . . . 0.0 112.068 167.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -67.03 128.0 34.7 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 121.188 0.518 . . . . 0.0 111.02 174.488 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -158.25 176.12 12.87 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.069 1.348 . . . . 0.0 109.683 167.329 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.43 96.31 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 124.694 1.198 . . . . 0.0 112.387 160.344 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 2.0 tttt -161.05 163.18 21.09 Favored Pre-proline 0 N--CA 1.476 0.866 0 C-N-CA 125.477 1.511 . . . . 0.0 112.75 -177.127 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -84.48 179.05 4.67 Favored 'Trans proline' 0 N--CA 1.457 -0.632 0 C-N-CA 123.587 2.858 . . . . 0.0 110.699 149.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -100.14 160.39 14.36 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 114.86 -1.064 . . . . 0.0 110.595 172.384 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 6.0 mtpt -89.01 141.19 29.31 Favored Pre-proline 0 N--CA 1.47 0.567 0 CA-C-O 117.539 -1.219 . . . . 0.0 108.03 178.393 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -79.32 -13.92 13.43 Favored 'Trans proline' 0 CA--C 1.548 1.187 0 C-N-CA 121.557 1.505 . . . . 0.0 111.684 -178.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 17.2 p -82.01 -20.83 37.61 Favored 'General case' 0 CA--C 1.557 1.237 0 C-N-CA 125.843 1.657 . . . . 0.0 111.734 175.156 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 90.8 m -119.06 -25.27 6.25 Favored 'General case' 0 CA--C 1.558 1.255 0 N-CA-C 115.457 1.651 . . . . 0.0 115.457 -178.241 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.58 154.98 30.95 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 120.981 -1.074 . . . . 0.0 110.6 177.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 42.6 m 44.54 50.21 6.77 Favored Pre-proline 0 CA--C 1.554 1.109 0 N-CA-C 113.264 0.838 . . . . 0.0 113.264 -175.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -64.93 -29.54 57.85 Favored 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 123.583 2.855 . . . . 0.0 112.432 -162.359 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -41.34 -69.4 0.14 Allowed 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 127.206 2.202 . . . . 0.0 115.275 158.202 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.5 p -69.11 -26.84 65.11 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 121.24 -0.913 . . . . 0.0 111.992 177.106 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 6.2 tmtt? -61.54 -51.01 70.38 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 119.54 1.064 . . . . 0.0 111.61 174.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 12.9 ttpt -62.26 -43.86 97.86 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.862 0.865 . . . . 0.0 111.385 176.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.34 -39.57 91.03 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 176.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 11.7 ttp85 -60.84 -54.24 47.51 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.733 1.213 . . . . 0.0 110.009 175.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 58.0 m-20 -71.73 -26.7 62.57 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 115.229 -0.896 . . . . 0.0 112.685 -175.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.22 -40.13 90.1 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 120.368 -1.458 . . . . 0.0 112.606 167.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 2.3 t -59.01 -33.83 71.17 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 122.695 1.236 . . . . 0.0 111.819 170.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 70.9 mt -76.53 -34.12 23.79 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 C-N-CA 124.619 1.168 . . . . 0.0 111.855 177.349 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 66.3 mt -64.63 -34.13 67.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 124.474 1.11 . . . . 0.0 111.734 167.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -70.79 -37.26 73.3 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 113.966 1.099 . . . . 0.0 113.966 174.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.2 mppt? -142.64 -60.65 0.44 Allowed 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 125.488 1.515 . . . . 0.0 113.488 -174.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 136.37 160.3 8.71 Favored Glycine 0 CA--C 1.531 1.072 0 C-N-CA 126.045 1.783 . . . . 0.0 109.374 -158.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.05 -29.53 63.04 Favored 'General case' 0 N--CA 1.466 0.325 0 O-C-N 120.786 -1.42 . . . . 0.0 112.934 -167.581 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.6 pt-20 -56.1 -31.45 63.27 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 123.2 0.6 . . . . 0.0 112.583 178.104 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -85.94 3.31 42.56 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.045 1.338 . . . . 0.0 113.188 177.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 4.6 m -147.08 17.84 1.22 Allowed 'General case' 0 N--CA 1.441 -0.903 0 C-N-CA 125.423 1.489 . . . . 0.0 112.881 -154.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -63.63 -30.95 79.15 Favored Glycine 0 C--O 1.215 -1.05 0 O-C-N 120.217 -1.552 . . . . 0.0 114.58 179.742 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 39.3 p-80 -53.36 -25.59 15.88 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 121.292 2.546 . . . . 0.0 113.944 168.38 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.85 -35.85 32.25 Favored 'General case' 0 C--N 1.341 0.196 0 C-N-CA 123.7 0.8 . . . . 0.0 111.138 172.266 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.417 HG22 ' HE2' ' A' ' 57' ' ' LYS . 34.4 mt -72.35 -37.43 58.15 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.444 0 CA-C-O 118.757 -0.64 . . . . 0.0 110.012 178.93 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.472 ' HG3' ' HE3' ' A' ' 57' ' ' LYS . 1.4 mp0 -67.17 -52.84 36.41 Favored 'General case' 0 N--CA 1.436 -1.157 0 C-N-CA 124.835 1.254 . . . . 0.0 112.818 176.665 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.41 -37.83 57.6 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 119.161 0.891 . . . . 0.0 112.95 174.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -72.52 -41.53 65.79 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 114.324 1.231 . . . . 0.0 114.324 173.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.472 ' HE3' ' HG3' ' A' ' 54' ' ' GLU . 23.7 mtmt -55.04 -52.62 62.61 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.942 1.297 . . . . 0.0 111.161 175.706 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -64.88 -38.44 90.97 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.408 0.683 . . . . 0.0 111.65 178.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 36.2 t -52.07 -60.69 2.9 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 118.284 -0.865 . . . . 0.0 111.741 169.458 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 79.3 mtm -49.64 -50.16 44.22 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 124.832 1.253 . . . . 0.0 111.474 172.437 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 22.3 mtt180 -53.11 -35.8 60.04 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 120.353 1.433 . . . . 0.0 114.133 -177.333 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -48.95 -37.03 18.86 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 119.272 0.942 . . . . 0.0 113.331 170.019 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 4.9 mp -82.87 8.74 11.62 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 125.154 1.381 . . . . 0.0 112.051 -172.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.53 22.55 43.19 Favored Glycine 0 CA--C 1.535 1.311 0 C-N-CA 124.931 1.253 . . . . 0.0 114.025 -179.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.508 ' C ' ' HE3' ' A' ' 66' ' ' LYS . 0.8 OUTLIER -84.49 153.67 23.19 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.494 1.518 . . . . 0.0 114.75 -163.265 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.508 ' HE3' ' C ' ' A' ' 65' ' ' PHE . 0.1 OUTLIER -94.97 81.34 3.71 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 126.441 1.897 . . . . 0.0 107.906 -174.32 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 29.4 mm . . . . . 0 C--O 1.245 0.862 0 C-N-CA 128.85 2.86 . . . . 0.0 108.896 -165.011 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.472 0 N-CA-C 109.441 -1.464 . . . . 0.0 109.441 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.5 p -135.67 8.16 3.3 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.143 1.377 . . . . 0.0 113.076 -176.539 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 53.7 p90 -157.43 177.9 10.91 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 127.589 2.356 . . . . 0.0 108.674 -178.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.9 m -127.26 148.5 50.22 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.603 1.161 . . . . 0.0 109.268 178.561 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 7.6 tpt -131.32 79.35 70.27 Favored Pre-proline 0 CA--C 1.539 0.552 0 C-N-CA 123.915 0.886 . . . . 0.0 110.15 175.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -73.61 -0.26 9.09 Favored 'Trans proline' 0 CA--C 1.543 0.962 0 C-N-CA 123.414 2.743 . . . . 0.0 114.574 177.333 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -79.65 44.82 2.79 Favored Glycine 0 CA--C 1.534 1.256 0 CA-C-N 119.661 1.118 . . . . 0.0 114.554 -174.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 6.3 mp -118.41 133.15 56.11 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 126.06 1.744 . . . . 0.0 110.593 -172.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.4 p -160.36 163.1 1.1 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 125.972 1.709 . . . . 0.0 109.152 178.119 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -138.46 158.41 44.32 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.47 1.108 . . . . 0.0 109.87 165.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 75.0 m -156.16 12.77 0.3 Allowed 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.534 1.933 . . . . 0.0 111.942 169.02 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -136.35 62.05 41.83 Favored Pre-proline 0 CA--C 1.55 0.979 0 CA-C-N 119.458 1.026 . . . . 0.0 112.612 -173.207 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -71.17 -176.91 2.06 Favored 'Trans proline' 0 CA--C 1.542 0.916 0 C-N-CA 123.725 2.95 . . . . 0.0 111.113 169.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -136.05 156.28 77.11 Favored Pre-proline 0 CA--C 1.542 0.636 0 C-N-CA 124.537 1.135 . . . . 0.0 111.682 -179.12 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -64.03 131.06 29.29 Favored 'Trans proline' 0 CA--C 1.545 1.03 0 C-N-CA 122.233 1.955 . . . . 0.0 111.175 172.285 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -77.72 -178.09 4.34 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.345 2.697 . . . . 0.0 112.305 172.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -123.99 165.12 17.99 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.805 1.242 . . . . 0.0 110.56 167.676 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 5.0 m -159.63 -1.17 0.08 Allowed 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 114.183 1.179 . . . . 0.0 114.183 175.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -152.92 98.24 2.3 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 114.257 1.206 . . . . 0.0 114.257 -174.347 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . 0.256 0.0 OUTLIER -140.36 -169.54 2.79 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.37 1.468 . . . . 0.0 109.007 151.599 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.82 -3.4 8.68 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 117.096 2.258 . . . . 0.0 117.096 -167.278 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.4 ' HB3' ' HE3' ' A' ' 22' ' ' LYS . 23.2 mtpp -89.92 167.27 17.59 Favored Pre-proline 0 N--CA 1.474 0.728 0 C-N-CA 126.861 2.065 . . . . 0.0 112.155 175.588 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -91.48 160.93 3.61 Favored 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 123.866 3.044 . . . . 0.0 112.052 170.545 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.585 ' CD1' ' H ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -71.99 165.54 24.02 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.32 166.744 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.585 ' H ' ' CD1' ' A' ' 24' ' ' LEU . 12.4 ptmm? -137.78 137.26 21.22 Favored Pre-proline 0 CA--C 1.536 0.42 0 C-N-CA 128.637 2.775 . . . . 0.0 107.209 -178.898 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -64.28 -20.08 66.38 Favored 'Trans proline' 0 CA--C 1.535 0.569 0 C-N-CA 124.646 3.564 . . . . 0.0 115.944 -154.55 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 26.9 p -84.36 -23.46 30.15 Favored 'General case' 0 CA--C 1.558 1.279 0 C-N-CA 125.265 1.426 . . . . 0.0 113.372 175.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 69.7 m -94.69 -13.06 26.15 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 115.307 1.595 . . . . 0.0 115.307 -174.123 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.55 156.58 32.19 Favored 'General case' 0 CA--C 1.545 0.767 0 O-C-N 121.625 -0.672 . . . . 0.0 111.506 -170.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 13.7 m 45.9 63.49 9.45 Favored Pre-proline 0 CA--C 1.55 0.965 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 177.082 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -68.7 -17.64 42.51 Favored 'Trans proline' 0 CA--C 1.536 0.577 0 C-N-CA 123.13 2.554 . . . . 0.0 113.176 -161.395 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -88.17 -41.09 13.22 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.93 1.292 . . . . 0.0 112.493 -174.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.7 p -64.01 -33.22 75.26 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 120.89 -1.131 . . . . 0.0 110.833 158.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 5.1 tmtt? -59.04 -47.89 83.59 Favored 'General case' 0 N--CA 1.478 0.962 0 CA-C-N 120.727 1.603 . . . . 0.0 111.691 173.284 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 26.9 mttt -54.29 -49.97 68.4 Favored 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 126.022 1.729 . . . . 0.0 111.772 173.27 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.83 -35.05 76.5 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.452 0.701 . . . . 0.0 112.756 179.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 3.1 ttp180 -57.96 -55.5 34.15 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 124.728 1.211 . . . . 0.0 109.914 172.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -62.46 -39.45 93.42 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.444 1.098 . . . . 0.0 111.98 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.1 -41.8 97.33 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 113.207 0.818 . . . . 0.0 113.207 172.031 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.9 t -59.38 -36.16 75.26 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 122.496 1.141 . . . . 0.0 111.584 174.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 68.6 mt -73.09 -29.53 28.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 O-C-N 120.657 -1.277 . . . . 0.0 111.279 177.793 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 96.8 mt -69.29 -36.36 72.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.435 1.094 . . . . 0.0 112.005 168.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -67.49 -42.1 83.46 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 124.507 1.123 . . . . 0.0 113.716 178.29 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.85 -17.42 0.31 Allowed 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 116.923 2.194 . . . . 0.0 116.923 -171.504 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 95.74 164.65 34.26 Favored Glycine 0 CA--C 1.535 1.318 0 C-N-CA 123.933 0.778 . . . . 0.0 112.815 -167.685 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -69.23 -39.67 78.41 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 -165.287 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -55.73 -34.44 65.16 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.513 1.525 . . . . 0.0 113.769 175.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 78.0 m-70 -91.13 15.11 12.37 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.823 1.249 . . . . 0.0 112.306 -176.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 1.2 m -143.2 1.22 1.22 Allowed 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 115.73 1.752 . . . . 0.0 115.73 -166.034 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -51.46 -27.35 17.29 Favored Glycine 0 N--CA 1.473 1.11 0 CA-C-O 115.979 -2.567 . . . . 0.0 118.068 -163.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 34.3 p-80 -51.77 -35.12 42.52 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 121.798 2.799 . . . . 0.0 113.255 170.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.59 -40.48 76.65 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 125.722 1.609 . . . . 0.0 112.056 171.283 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.3 mp -70.74 -36.32 64.37 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 C-N-CA 120.488 -0.485 . . . . 0.0 110.497 178.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -73.53 -51.19 17.87 Favored 'General case' 0 N--CA 1.444 -0.759 0 C-N-CA 126.741 2.016 . . . . 0.0 112.32 -174.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -56.89 -37.93 72.08 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 121.453 0.644 . . . . 0.0 112.294 172.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 20.9 t60 -69.02 -49.87 53.81 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 113.113 0.782 . . . . 0.0 113.113 175.244 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 13.7 mtpp -46.43 -49.94 17.46 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 125.736 1.614 . . . . 0.0 111.378 170.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 60.4 mm-40 -58.29 -48.32 80.83 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 119.433 1.015 . . . . 0.0 112.357 174.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 24.5 t -55.33 -47.84 75.07 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 123.558 0.743 . . . . 0.0 112.682 178.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 12.4 mtp -62.54 -49.68 74.37 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.535 1.134 . . . . 0.0 110.532 169.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 18.1 mtp180 -56.3 -30.6 62.73 Favored 'General case' 0 C--N 1.34 0.164 0 O-C-N 119.601 -1.937 . . . . 0.0 114.139 -175.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -42.31 -35.43 0.99 Allowed 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.319 1.447 . . . . 0.0 113.9 168.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.0 mp -79.52 3.69 17.97 Favored 'General case' 0 CA--C 1.548 0.894 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 -171.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.95 20.82 38.12 Favored Glycine 0 CA--C 1.536 1.346 0 C-N-CA 125.598 1.57 . . . . 0.0 112.381 -168.208 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.452 ' C ' ' HE3' ' A' ' 66' ' ' LYS . 0.0 OUTLIER -94.85 158.93 15.27 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 126.482 1.913 . . . . 0.0 112.815 -161.368 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.452 ' HE3' ' C ' ' A' ' 65' ' ' PHE . 0.1 OUTLIER -116.0 106.52 13.87 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 125.925 1.69 . . . . 0.0 107.477 -174.41 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.246 0.889 0 C-N-CA 125.198 1.399 . . . . 0.0 111.046 -170.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.554 0 CA-C-O 117.931 -1.483 . . . . 0.0 109.448 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 12.9 p -139.97 -0.56 1.67 Allowed 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 114.781 1.4 . . . . 0.0 114.781 -171.131 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -72.31 110.86 7.03 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 118.853 0.751 . . . . 0.0 111.313 177.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.6 m -63.35 141.82 58.62 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.209 0.603 . . . . 0.0 110.472 168.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 24.5 ttt -126.59 63.15 52.26 Favored Pre-proline 0 N--CA 1.471 0.623 0 C-N-CA 123.914 0.886 . . . . 0.0 111.648 -178.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -76.63 -9.98 18.56 Favored 'Trans proline' 0 CA--C 1.537 0.655 0 C-N-CA 122.417 2.078 . . . . 0.0 115.96 -167.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 134.65 78.74 0.11 Allowed Glycine 0 N--CA 1.471 0.979 0 CA-C-N 118.953 0.797 . . . . 0.0 111.93 -170.607 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -152.68 151.99 31.22 Favored 'General case' 0 CA--C 1.518 -0.25 0 C-N-CA 124.437 1.095 . . . . 0.0 111.911 -170.068 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 70.8 t 64.81 102.91 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 C-N-CA 126.384 1.874 . . . . 0.0 112.27 175.357 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -68.89 50.01 0.08 Allowed 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 127.686 2.394 . . . . 0.0 113.061 177.035 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.4 t 52.03 20.57 1.29 Allowed 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 126.233 1.813 . . . . 0.0 114.497 -167.264 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 48.7 t-20 -132.8 84.08 50.91 Favored Pre-proline 0 CA--C 1.544 0.73 0 C-N-CA 125.339 1.456 . . . . 0.0 109.555 -163.466 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_endo -85.45 -167.01 0.37 Allowed 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 125.162 3.908 . . . . 0.0 112.665 -172.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -123.92 161.61 45.82 Favored Pre-proline 0 CA--C 1.544 0.728 0 C-N-CA 125.814 1.646 . . . . 0.0 109.901 168.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -67.46 154.23 74.36 Favored 'Trans proline' 0 CA--C 1.545 1.067 0 C-N-CA 121.996 1.797 . . . . 0.0 111.134 167.018 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -77.72 176.12 10.41 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 123.566 2.844 . . . . 0.0 113.094 176.18 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -67.76 138.36 56.16 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.462 1.905 . . . . 0.0 114.587 -168.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 57.9 p -167.16 152.06 7.25 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.46 1.104 . . . . 0.0 110.734 151.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -150.33 17.13 0.83 Allowed 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 115.091 1.515 . . . . 0.0 115.091 -162.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.8 -176.7 0.2 Allowed 'General case' 0 CA--C 1.545 0.759 0 O-C-N 119.51 -1.994 . . . . 0.0 112.182 165.312 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.8 tptp -70.91 55.56 0.18 Allowed 'General case' 0 CA--C 1.549 0.915 0 O-C-N 120.519 -1.363 . . . . 0.0 113.337 175.289 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -49.6 155.92 1.28 Allowed Pre-proline 0 CA--C 1.55 0.963 0 C-N-CA 128.05 2.54 . . . . 0.0 114.005 178.001 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -90.72 -174.78 0.75 Allowed 'Trans proline' 0 CA--C 1.535 0.565 0 C-N-CA 125.069 3.846 . . . . 0.0 110.627 159.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.684 ' CD1' ' H ' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -131.16 165.34 23.53 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 122.151 0.977 . . . . 0.0 110.634 165.647 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.684 ' H ' ' CD1' ' A' ' 24' ' ' LEU . 0.1 OUTLIER -152.77 122.33 3.34 Favored Pre-proline 0 C--N 1.327 -0.37 0 C-N-CA 129.923 3.289 . . . . 0.0 104.224 -163.949 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -64.71 -29.08 59.96 Favored 'Trans proline' 0 CA--C 1.534 0.49 0 C-N-CA 123.719 2.946 . . . . 0.0 114.325 -148.279 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 29.0 p -67.17 -18.36 65.24 Favored 'General case' 0 CA--C 1.555 1.141 0 C-N-CA 124.586 1.154 . . . . 0.0 113.342 177.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 56.2 m -111.96 -4.0 14.66 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 115.216 1.562 . . . . 0.0 115.216 -175.25 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.43 158.41 23.87 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 120.0 1.273 . . . . 0.0 110.933 -179.376 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 33.5 m 36.33 62.25 2.94 Favored Pre-proline 0 CA--C 1.546 0.816 0 C-N-CA 124.717 1.207 . . . . 0.0 114.11 -179.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -69.16 -18.67 39.71 Favored 'Trans proline' 0 N--CA 1.459 -0.526 0 C-N-CA 122.38 2.054 . . . . 0.0 111.499 -161.462 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -76.46 -47.7 22.12 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.821 1.248 . . . . 0.0 111.726 -179.515 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.7 p -65.82 -31.62 72.69 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 117.841 -1.076 . . . . 0.0 111.612 165.704 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.2 tmtp? -58.76 -50.83 72.49 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 120.509 1.504 . . . . 0.0 112.112 171.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 23.6 ttpt -54.72 -47.42 73.77 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 126.898 2.079 . . . . 0.0 112.12 175.025 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.77 -39.02 90.6 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 114.398 -1.274 . . . . 0.0 113.591 174.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 14.4 ttp85 -60.73 -53.29 59.21 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.625 1.57 . . . . 0.0 110.124 177.293 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -74.76 -30.65 61.55 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 115.364 -0.834 . . . . 0.0 111.836 -175.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.89 -39.38 81.25 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 120.531 -1.356 . . . . 0.0 112.698 165.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.9 t -59.41 -37.89 79.19 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.744 0.818 . . . . 0.0 111.825 175.083 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 72.3 mt -71.35 -35.52 57.77 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 C-N-CA 124.946 1.298 . . . . 0.0 111.145 176.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 86.0 mt -67.04 -31.54 53.84 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 C-N-CA 124.451 1.1 . . . . 0.0 112.127 171.09 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -78.84 -35.62 43.72 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.285 1.434 . . . . 0.0 114.486 178.107 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.2 mppt? -134.62 -59.8 0.8 Allowed 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 125.078 1.351 . . . . 0.0 112.788 176.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 139.08 173.94 13.26 Favored Glycine 0 CA--C 1.531 1.091 0 C-N-CA 126.09 1.805 . . . . 0.0 110.281 -160.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -78.94 -32.54 45.53 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 114.601 1.334 . . . . 0.0 114.601 -162.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -58.73 -34.7 71.65 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.834 1.254 . . . . 0.0 113.742 173.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -81.08 6.9 12.26 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.183 0.993 . . . . 0.0 112.942 -176.652 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 21.7 m -145.57 13.25 1.36 Allowed 'General case' 0 N--CA 1.437 -1.093 0 C-N-CA 124.053 0.941 . . . . 0.0 113.413 -154.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -67.88 -29.48 73.68 Favored Glycine 0 N--CA 1.469 0.864 0 O-C-N 119.791 -1.818 . . . . 0.0 115.605 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 29.6 p-80 -56.82 -30.58 63.88 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 120.208 2.004 . . . . 0.0 112.582 165.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.06 -34.96 59.6 Favored 'General case' 0 CA--C 1.522 -0.119 0 C-N-CA 124.054 0.942 . . . . 0.0 109.698 174.661 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 44.4 mt -72.99 -27.44 24.63 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 N-CA-C 110.554 -0.165 . . . . 0.0 110.554 177.567 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 67.3 mt-10 -89.1 -47.16 8.29 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 -169.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.42 -37.89 57.75 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-O 121.737 0.78 . . . . 0.0 112.124 165.208 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 14.1 t60 -68.43 -46.36 70.09 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 173.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 19.8 mtmt -51.75 -52.74 46.46 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.906 1.283 . . . . 0.0 110.918 177.047 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -61.47 -41.59 97.48 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.023 0.529 . . . . 0.0 112.333 178.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 23.7 t -54.59 -50.39 68.13 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 123.438 0.695 . . . . 0.0 112.83 173.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -58.03 -53.4 58.69 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 125.535 1.534 . . . . 0.0 110.34 170.259 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 74.6 mtt180 -55.32 -31.42 61.66 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 126.579 1.952 . . . . 0.0 114.39 -175.046 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -45.78 -34.74 3.86 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.791 1.237 . . . . 0.0 113.497 169.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.9 mp -81.22 3.8 22.54 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.733 1.213 . . . . 0.0 112.244 -173.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.94 11.81 67.14 Favored Glycine 0 CA--C 1.535 1.305 0 C-N-CA 125.22 1.39 . . . . 0.0 113.286 -169.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.4 ' C ' ' HE3' ' A' ' 66' ' ' LYS . 0.9 OUTLIER -70.16 151.51 45.33 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 126.317 1.847 . . . . 0.0 113.506 -176.659 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.4 ' HE3' ' C ' ' A' ' 65' ' ' PHE . 0.0 OUTLIER -111.39 93.66 4.58 Favored 'General case' 0 C--N 1.341 0.198 0 C-N-CA 126.366 1.866 . . . . 0.0 109.502 -170.488 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.247 0.923 0 C-N-CA 127.471 2.308 . . . . 0.0 109.602 -173.266 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.175 0 N-CA-C 106.38 -2.688 . . . . 0.0 106.38 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.5 p 178.76 22.19 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.887 0 O-C-N 124.235 0.609 . . . . 0.0 112.183 -146.554 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -160.72 155.27 23.61 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.787 2.035 . . . . 0.0 108.487 -174.391 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -154.05 151.82 29.78 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.843 1.257 . . . . 0.0 109.158 178.683 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 9.2 tpt -133.96 60.18 43.54 Favored Pre-proline 0 N--CA 1.474 0.748 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 176.093 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -76.73 49.01 2.59 Favored 'Trans proline' 0 CA--C 1.547 1.148 0 C-N-CA 123.758 2.972 . . . . 0.0 110.85 170.064 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -126.72 34.4 3.16 Favored Glycine 0 CA--C 1.53 0.97 0 C-N-CA 125.458 1.504 . . . . 0.0 114.093 -167.186 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -151.7 171.5 17.58 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.978 1.311 . . . . 0.0 112.051 -179.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 14.8 p -146.96 138.72 18.69 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 124.576 1.151 . . . . 0.0 109.667 177.176 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 2.8 t0 54.32 -170.75 0.06 Allowed 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 124.5 1.12 . . . . 0.0 112.262 -159.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.479 ' HG ' ' CG ' ' A' ' 38' ' ' ASP . 54.3 p -121.22 -27.75 4.82 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.216 -0.928 . . . . 0.0 111.671 148.868 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -175.11 117.58 0.31 Allowed Pre-proline 0 CA--C 1.543 0.688 0 C-N-CA 125.655 1.582 . . . . 0.0 108.767 178.308 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -86.58 177.57 4.22 Favored 'Trans proline' 0 CA--C 1.543 0.948 0 C-N-CA 124.967 3.778 . . . . 0.0 110.99 172.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -152.17 158.42 33.69 Favored Pre-proline 0 CA--C 1.544 0.724 0 C-N-CA 124.12 0.968 . . . . 0.0 111.752 176.243 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -68.97 129.53 18.61 Favored 'Trans proline' 0 CA--C 1.546 1.11 0 C-N-CA 122.666 2.244 . . . . 0.0 111.457 169.239 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -84.65 -172.19 1.18 Allowed 'Trans proline' 0 CA--C 1.544 0.997 0 C-N-CA 124.085 3.19 . . . . 0.0 112.387 169.694 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 82.83 157.6 0.12 Allowed 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 127.56 2.344 . . . . 0.0 114.185 167.301 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 80.4 p -167.84 158.43 10.79 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 120.619 -1.301 . . . . 0.0 113.15 167.203 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -114.05 -63.29 1.47 Allowed 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 125.568 1.547 . . . . 0.0 109.506 178.176 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.01 -178.38 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 123.809 0.843 . . . . 0.0 111.515 147.009 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -135.15 161.75 34.46 Favored 'General case' 0 N--CA 1.455 -0.216 0 O-C-N 119.026 -2.297 . . . . 0.0 112.426 179.842 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.5 mmpt? -128.81 158.37 72.57 Favored Pre-proline 0 N--CA 1.474 0.739 0 C-N-CA 126.25 1.82 . . . . 0.0 109.831 -167.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_endo -71.45 169.2 21.46 Favored 'Trans proline' 0 N--CA 1.461 -0.413 0 C-N-CA 121.756 1.637 . . . . 0.0 110.638 155.353 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -75.87 158.6 31.9 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 122.295 1.045 . . . . 0.0 113.059 175.118 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.5 ptpt -132.12 137.6 30.45 Favored Pre-proline 0 CA--C 1.538 0.514 0 C-N-CA 126.836 2.055 . . . . 0.0 108.872 -174.44 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.453 ' HB3' ' CE1' ' A' ' 65' ' ' PHE . 24.6 Cg_endo -75.83 -18.88 16.67 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 124.617 3.545 . . . . 0.0 114.073 -161.114 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 30.3 p -77.01 -19.01 57.79 Favored 'General case' 0 CA--C 1.558 1.266 0 C-N-CA 125.731 1.612 . . . . 0.0 112.835 176.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 38.7 m -119.98 -20.38 7.51 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.945 1.698 . . . . 0.0 114.502 -172.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.97 147.52 19.5 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.724 0.81 . . . . 0.0 111.015 178.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 54.6 m 48.99 54.28 15.93 Favored Pre-proline 0 CA--C 1.553 1.087 0 N-CA-C 113.704 1.001 . . . . 0.0 113.704 -171.04 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -66.2 -31.9 43.7 Favored 'Trans proline' 0 CA--C 1.537 0.634 0 C-N-CA 123.696 2.931 . . . . 0.0 112.649 -168.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -39.98 -69.59 0.13 Allowed 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.598 1.959 . . . . 0.0 114.633 158.094 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.1 p -66.86 -28.55 68.43 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-O 117.636 -1.173 . . . . 0.0 111.935 176.184 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 12.1 tmtt? -57.25 -47.82 80.4 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 120.738 1.608 . . . . 0.0 112.163 176.001 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.5 mttp -83.86 -26.26 29.61 Favored 'General case' 0 CA--C 1.516 -0.34 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 -179.327 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.29 -41.46 97.0 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 123.343 0.402 . . . . 0.0 111.923 163.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 7.5 ttp85 -57.93 -53.53 57.18 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 125.505 1.522 . . . . 0.0 109.981 173.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.479 ' CG ' ' HG ' ' A' ' 11' ' ' SER . 82.7 m-20 -69.32 -30.18 68.18 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 115.042 -0.981 . . . . 0.0 113.496 -175.093 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.53 -45.63 92.08 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 120.351 1.432 . . . . 0.0 111.96 168.495 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.3 t -55.75 -34.11 64.9 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.058 0.943 . . . . 0.0 111.296 171.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 69.2 mt -77.3 -35.89 23.15 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 O-C-N 120.404 -1.435 . . . . 0.0 112.068 178.743 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 87.5 mt -59.92 -36.5 67.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 124.315 1.046 . . . . 0.0 111.385 167.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -70.35 -45.74 65.52 Favored 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 124.352 1.061 . . . . 0.0 113.718 178.473 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.58 -13.81 0.67 Allowed 'General case' 0 N--CA 1.483 1.224 0 N-CA-C 116.936 2.198 . . . . 0.0 116.936 -169.689 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 89.39 165.95 41.48 Favored Glycine 0 CA--C 1.536 1.395 0 C-N-CA 124.893 1.235 . . . . 0.0 112.476 -163.064 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.4 -34.66 63.34 Favored 'General case' 0 N--CA 1.466 0.326 0 O-C-N 120.553 -1.557 . . . . 0.0 113.259 -168.727 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -55.94 -35.21 66.39 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 123.118 0.567 . . . . 0.0 112.414 -179.629 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 84.5 m-70 -86.3 9.47 17.72 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.732 1.613 . . . . 0.0 112.961 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 1.3 m -143.0 9.19 1.7 Allowed 'General case' 0 N--CA 1.443 -0.825 0 C-N-CA 124.95 1.3 . . . . 0.0 113.895 -166.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -55.26 -22.21 28.95 Favored Glycine 0 C--O 1.215 -1.054 0 CA-C-O 117.041 -1.977 . . . . 0.0 117.656 -169.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 33.4 p-80 -54.46 -36.71 64.38 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 121.952 2.876 . . . . 0.0 113.145 167.207 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -70.73 -37.33 73.49 Favored 'General case' 0 N--CA 1.462 0.127 0 C-N-CA 125.332 1.453 . . . . 0.0 111.627 172.319 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 2.6 mp -71.12 -38.23 70.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 CA-C-N 118.912 0.778 . . . . 0.0 110.427 177.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.65 -53.66 21.12 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 125.393 1.477 . . . . 0.0 111.787 -173.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -57.88 -36.24 72.1 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-O 121.799 0.809 . . . . 0.0 112.755 175.7 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 15.4 t60 -68.48 -47.44 67.07 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.865 0.866 . . . . 0.0 112.775 175.028 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 31.1 mtpt -51.46 -49.14 62.34 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.53 1.132 . . . . 0.0 111.58 172.067 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -61.57 -46.5 89.62 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 124.215 1.006 . . . . 0.0 112.491 175.361 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 42.4 t -51.58 -52.65 45.61 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.073 0.949 . . . . 0.0 112.08 175.347 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 76.2 mtm -57.89 -48.93 78.41 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.913 0.885 . . . . 0.0 111.457 170.5 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.2 mtt-85 -58.47 -29.17 65.99 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 120.518 1.508 . . . . 0.0 114.205 -171.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -45.94 -35.22 4.47 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.22 1.008 . . . . 0.0 113.61 167.685 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.6 mp -81.95 6.65 15.31 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.221 1.008 . . . . 0.0 112.945 -170.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.07 27.07 42.01 Favored Glycine 0 CA--C 1.533 1.207 0 C-N-CA 124.722 1.153 . . . . 0.0 112.29 -169.084 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.453 ' CE1' ' HB3' ' A' ' 26' ' ' PRO . 0.2 OUTLIER -89.35 167.59 12.91 Favored 'General case' 0 N--CA 1.461 0.109 0 CA-C-O 123.694 1.711 . . . . 0.0 113.426 -171.623 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 16.0 ptpt -128.96 44.35 2.99 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 113.468 -1.696 . . . . 0.0 112.725 -136.04 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.917 0 C-N-CA 130.413 3.485 . . . . 0.0 109.593 -163.216 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.493 0 N-CA-C 109.337 -1.505 . . . . 0.0 109.337 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.2 t -153.79 175.7 13.0 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.005 1.322 . . . . 0.0 109.463 171.577 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -152.18 157.12 41.06 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.13 1.372 . . . . 0.0 110.771 -179.439 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -147.14 148.28 31.41 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.086 0.955 . . . . 0.0 110.109 -176.414 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 35.9 tpp -138.26 73.3 44.13 Favored Pre-proline 0 CA--C 1.541 0.624 0 C-N-CA 123.952 0.901 . . . . 0.0 110.332 174.041 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 79.1 Cg_endo -71.99 0.11 7.68 Favored 'Trans proline' 0 CA--C 1.542 0.9 0 C-N-CA 123.477 2.785 . . . . 0.0 115.352 -171.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -161.49 136.33 4.36 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.468 -1.053 . . . . 0.0 110.468 172.165 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -164.68 163.87 21.5 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.828 1.651 . . . . 0.0 110.412 -173.391 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 14.7 p -157.38 161.7 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 124.963 1.305 . . . . 0.0 110.382 -175.59 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.437 ' CG ' ' HZ3' ' A' ' 35' ' ' LYS . 25.5 t0 -61.76 160.45 11.78 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 123.685 0.794 . . . . 0.0 111.896 166.231 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.8 t -128.62 105.95 8.62 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 124.35 1.06 . . . . 0.0 109.749 179.068 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -142.52 61.84 12.07 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 124.211 1.005 . . . . 0.0 111.501 -170.159 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -72.52 179.12 5.42 Favored 'Trans proline' 0 CA--C 1.542 0.88 0 C-N-CA 124.959 3.773 . . . . 0.0 112.707 179.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -95.89 160.43 30.15 Favored Pre-proline 0 CA--C 1.547 0.834 0 C-N-CA 125.989 1.716 . . . . 0.0 111.588 173.252 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -70.71 156.06 61.58 Favored 'Trans proline' 0 CA--C 1.546 1.085 0 C-N-CA 123.199 2.599 . . . . 0.0 112.444 170.543 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -78.87 -178.95 5.03 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 123.73 2.953 . . . . 0.0 112.819 170.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -53.25 -22.92 7.65 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 126.196 1.798 . . . . 0.0 114.706 174.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.7 m -61.12 11.49 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 127.954 2.502 . . . . 0.0 116.297 -179.757 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 57.6 tp60 -49.14 107.58 0.15 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.15 1.78 . . . . 0.0 112.142 178.068 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.71 175.12 3.73 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 124.068 1.889 . . . . 0.0 113.29 175.235 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 8.5 mptt -124.68 62.59 1.13 Allowed 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 129.499 3.12 . . . . 0.0 108.275 -167.384 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.48 158.29 76.06 Favored Pre-proline 0 N--CA 1.476 0.861 0 C-N-CA 127.761 2.425 . . . . 0.0 110.277 -176.116 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -73.55 159.81 45.42 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 122.24 1.96 . . . . 0.0 111.856 173.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -80.17 162.86 24.48 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.478 1.111 . . . . 0.0 113.995 -176.899 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.7 ptmt -131.57 132.06 23.22 Favored Pre-proline 0 N--CA 1.468 0.43 0 C-N-CA 126.13 1.772 . . . . 0.0 106.771 171.734 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -70.51 -39.05 5.43 Favored 'Trans proline' 0 CA--C 1.533 0.473 0 C-N-CA 122.883 2.389 . . . . 0.0 114.762 -150.258 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 20.3 p -63.08 -24.97 68.15 Favored 'General case' 0 CA--C 1.554 1.098 0 C-N-CA 123.521 0.728 . . . . 0.0 112.715 178.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 64.7 m -98.63 -5.73 31.21 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 126.265 1.826 . . . . 0.0 113.101 175.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -92.07 -36.71 13.2 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-O 122.301 1.048 . . . . 0.0 113.542 -176.066 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 43.5 m -113.36 61.86 0.84 Allowed Pre-proline 0 CA--C 1.549 0.927 0 C-N-CA 127.381 2.272 . . . . 0.0 112.075 162.67 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -74.83 -22.41 15.25 Favored 'Trans proline' 0 CA--C 1.54 0.785 0 C-N-CA 122.778 2.318 . . . . 0.0 112.446 -171.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -66.41 -52.86 42.18 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.209 1.404 . . . . 0.0 112.767 174.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.1 p -65.4 -30.33 71.13 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 120.967 -1.083 . . . . 0.0 111.375 170.025 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 8.2 tmtt? -57.66 -49.02 77.87 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 120.378 1.445 . . . . 0.0 112.426 169.716 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.437 ' HZ3' ' CG ' ' A' ' 10' ' ' ASP . 48.1 tttt -54.5 -50.58 67.48 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 125.922 1.689 . . . . 0.0 111.159 174.374 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.97 -42.05 97.37 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 114.853 -1.067 . . . . 0.0 112.962 179.727 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 9.1 ttp85 -60.12 -51.97 67.33 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 125.102 1.361 . . . . 0.0 110.371 177.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 25.0 m-20 -72.31 -29.99 64.36 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 115.771 -0.65 . . . . 0.0 112.553 -175.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.91 -37.0 85.77 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 120.821 -1.175 . . . . 0.0 113.131 167.124 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.8 t -60.39 -39.76 88.49 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 121.053 -1.029 . . . . 0.0 111.651 168.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 73.7 mt -72.02 -29.95 34.82 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 O-C-N 121.001 -1.062 . . . . 0.0 111.468 -177.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 60.1 mt -58.01 -43.05 84.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 123.38 0.672 . . . . 0.0 111.489 163.591 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.9 -41.97 97.57 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.069 1.137 . . . . 0.0 114.069 -178.207 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -153.48 -9.34 0.16 Allowed 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 116.992 2.219 . . . . 0.0 116.992 -166.487 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 83.58 159.57 28.55 Favored Glycine 0 CA--C 1.53 1.017 0 CA-C-N 119.179 0.9 . . . . 0.0 112.895 -164.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.53 -28.72 68.05 Favored 'General case' 0 N--CA 1.463 0.181 0 O-C-N 121.147 -1.207 . . . . 0.0 112.728 -169.564 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -58.41 -24.42 59.99 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.911 0.885 . . . . 0.0 113.258 177.018 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -104.21 11.97 34.33 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 120.345 1.429 . . . . 0.0 111.117 178.137 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 1.7 m -139.67 18.09 2.52 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 126.768 2.027 . . . . 0.0 113.051 -162.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -63.81 -29.69 75.52 Favored Glycine 0 C--O 1.216 -1.001 0 CA-C-O 116.622 -2.21 . . . . 0.0 114.883 -175.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 41.0 p-80 -56.42 -24.75 47.26 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 120.358 2.079 . . . . 0.0 113.632 168.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -82.72 -33.63 27.47 Favored 'General case' 0 C--N 1.341 0.203 0 O-C-N 121.515 -0.74 . . . . 0.0 110.78 171.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 51.5 mt -75.11 -35.22 33.94 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-O 119.196 -0.43 . . . . 0.0 110.628 -179.18 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -67.84 -55.49 12.76 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 127.119 2.168 . . . . 0.0 110.94 -177.301 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.74 -40.76 72.96 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 173.138 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 13.6 t60 -66.3 -46.48 76.8 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 120.992 -1.067 . . . . 0.0 113.089 175.38 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 21.4 mtpp -54.06 -49.0 69.99 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.146 0.978 . . . . 0.0 111.269 172.658 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -61.74 -43.39 98.95 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 118.155 -0.926 . . . . 0.0 112.435 175.322 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 42.8 t -50.74 -58.2 6.47 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 119.016 0.825 . . . . 0.0 111.11 173.002 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 75.6 mtm -55.93 -45.89 78.62 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.203 0.601 . . . . 0.0 110.486 174.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 8.8 mtt-85 -58.91 -29.25 66.92 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 120.77 1.623 . . . . 0.0 115.232 -177.035 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -50.25 -31.32 13.79 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 118.9 0.773 . . . . 0.0 112.668 169.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.9 mp -85.21 26.74 0.85 Allowed 'General case' 0 CA--C 1.546 0.81 0 CA-C-O 122.732 1.253 . . . . 0.0 112.327 -172.195 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 68.09 30.1 73.75 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 127.156 2.312 . . . . 0.0 113.034 -174.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -102.35 170.35 8.12 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-O 124.03 1.871 . . . . 0.0 115.959 -148.578 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 13.0 ptpt -119.81 69.53 0.84 Allowed 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 124.1 1.905 . . . . 0.0 111.625 -152.273 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 17.8 mm . . . . . 0 C--O 1.254 1.313 0 CA-C-N 108.472 -3.967 . . . . 0.0 112.16 -147.72 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.402 0 N-CA-C 109.115 -1.594 . . . . 0.0 109.115 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.3 t -154.95 168.55 26.58 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.085 1.354 . . . . 0.0 108.972 169.244 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -142.78 152.53 42.35 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.355 1.462 . . . . 0.0 110.206 -179.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 3.2 m -160.58 145.17 14.21 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.405 1.082 . . . . 0.0 108.603 172.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 4.7 mpp? -129.46 66.44 76.92 Favored Pre-proline 0 CA--C 1.542 0.663 0 C-N-CA 123.734 0.813 . . . . 0.0 110.941 -177.555 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_endo -70.8 4.43 2.65 Favored 'Trans proline' 0 CA--C 1.544 1.019 0 C-N-CA 123.833 3.022 . . . . 0.0 116.477 -171.028 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -170.85 27.1 0.11 Allowed Glycine 0 CA--C 1.531 1.058 0 C-N-CA 124.213 0.911 . . . . 0.0 113.726 -179.589 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -163.16 -170.91 2.44 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.375 1.87 . . . . 0.0 109.657 -172.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 9.7 p -137.51 153.64 28.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 C-N-CA 124.24 1.016 . . . . 0.0 108.924 169.002 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -83.14 158.75 22.26 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 121.876 0.846 . . . . 0.0 111.194 172.756 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 75.1 m -157.12 0.79 0.12 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 126.429 1.892 . . . . 0.0 112.802 168.386 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -160.25 69.22 2.9 Favored Pre-proline 0 CA--C 1.551 1.002 0 C-N-CA 125.351 1.46 . . . . 0.0 109.93 -178.436 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -70.83 169.56 19.96 Favored 'Trans proline' 0 N--CA 1.45 -1.074 0 C-N-CA 123.527 2.818 . . . . 0.0 111.221 177.728 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -152.16 159.17 33.25 Favored Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 125.499 1.52 . . . . 0.0 110.417 175.246 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -68.38 158.76 56.22 Favored 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 121.471 1.447 . . . . 0.0 110.644 162.66 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -68.74 179.05 3.4 Favored 'Trans proline' 0 N--CA 1.459 -0.55 0 C-N-CA 121.569 1.513 . . . . 0.0 110.599 160.296 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -66.26 144.54 56.54 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-O 121.96 0.886 . . . . 0.0 111.673 162.541 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 77.8 p -161.44 43.5 0.16 Allowed 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 126.634 1.973 . . . . 0.0 111.533 174.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -152.4 -177.47 6.23 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 177.585 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.442 ' CD ' ' HZ2' ' A' ' 22' ' ' LYS . 1.0 OUTLIER -50.1 154.89 1.05 Allowed 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 124.343 2.021 . . . . 0.0 113.026 160.621 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 25.8 tttp 178.21 106.85 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 111.544 -2.571 . . . . 0.0 108.652 -161.237 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.442 ' HZ2' ' CD ' ' A' ' 20' ' ' GLU . 9.1 mmpt? -61.87 145.47 92.45 Favored Pre-proline 0 N--CA 1.476 0.845 0 O-C-N 121.118 -0.989 . . . . 0.0 110.61 174.079 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.5 171.0 14.96 Favored 'Trans proline' 0 CA--C 1.534 0.517 0 C-N-CA 122.763 2.309 . . . . 0.0 112.427 -175.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.645 ' CD1' ' H ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -128.72 163.33 25.37 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.879 1.272 . . . . 0.0 109.182 177.014 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.645 ' H ' ' CD1' ' A' ' 24' ' ' LEU . 19.4 pttp -132.5 131.06 22.03 Favored Pre-proline 0 N--CA 1.465 0.299 0 C-N-CA 128.258 2.623 . . . . 0.0 107.373 179.18 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -64.14 -24.38 66.13 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 123.893 3.062 . . . . 0.0 114.226 -154.115 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 28.6 p -66.63 -21.26 66.12 Favored 'General case' 0 CA--C 1.558 1.269 0 C-N-CA 124.956 1.302 . . . . 0.0 113.418 175.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.424 ' SG ' ' NZ ' ' A' ' 25' ' ' LYS . 40.4 m -111.13 -8.5 14.41 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.714 1.606 . . . . 0.0 114.973 -173.589 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.24 152.23 45.32 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 121.015 -1.053 . . . . 0.0 111.64 -170.113 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 64.9 m 42.77 57.18 11.4 Favored Pre-proline 0 CA--C 1.55 0.962 0 C-N-CA 124.7 1.2 . . . . 0.0 113.928 -173.014 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -63.68 -29.08 69.16 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 123.873 3.049 . . . . 0.0 112.63 -168.036 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -39.37 -72.19 0.07 Allowed 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.688 2.395 . . . . 0.0 115.753 156.299 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -68.72 -24.77 64.51 Favored 'General case' 0 N--CA 1.475 0.815 0 O-C-N 121.029 -1.044 . . . . 0.0 112.169 176.222 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 8.8 tmtt? -60.37 -43.74 96.28 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 120.419 1.463 . . . . 0.0 111.124 172.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 62.5 tttt -58.84 -49.74 76.58 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.858 1.263 . . . . 0.0 111.677 173.169 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.56 -37.17 86.29 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.332 -0.849 . . . . 0.0 112.739 178.131 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 6.6 ttp85 -59.35 -56.48 21.56 Favored 'General case' 0 C--O 1.223 -0.299 0 C-N-CA 125.619 1.568 . . . . 0.0 109.842 175.15 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -69.61 -27.4 65.05 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 115.315 -0.857 . . . . 0.0 112.572 -176.4 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.35 -44.31 91.85 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 120.768 -1.207 . . . . 0.0 112.971 166.356 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -57.76 -31.7 66.75 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 122.454 1.121 . . . . 0.0 111.57 171.964 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 72.3 mt -77.27 -34.33 21.07 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 O-C-N 120.524 -1.36 . . . . 0.0 111.726 177.259 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 70.2 mt -61.92 -34.72 64.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.2 1.0 . . . . 0.0 111.659 167.193 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -70.13 -43.03 71.79 Favored 'General case' 0 CA--C 1.556 1.181 0 N-CA-C 114.12 1.155 . . . . 0.0 114.12 177.104 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.87 -11.71 0.28 Allowed 'General case' 0 N--CA 1.485 1.297 0 N-CA-C 117.828 2.529 . . . . 0.0 117.828 -171.049 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 90.03 162.34 38.25 Favored Glycine 0 CA--C 1.536 1.36 0 CA-C-N 119.612 1.096 . . . . 0.0 112.663 -163.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.43 -34.99 68.22 Favored 'General case' 0 N--CA 1.465 0.3 0 O-C-N 120.707 -1.467 . . . . 0.0 113.422 -168.687 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -56.15 -34.9 66.56 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.765 0.826 . . . . 0.0 112.612 178.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 79.5 m-70 -90.21 12.15 18.93 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.698 1.599 . . . . 0.0 112.686 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -145.72 11.67 1.27 Allowed 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 124.954 1.302 . . . . 0.0 114.11 -169.286 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -53.73 -26.18 31.64 Favored Glycine 0 N--CA 1.472 1.038 0 CA-C-O 116.354 -2.359 . . . . 0.0 116.879 -169.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 37.1 p-80 -52.56 -33.67 46.79 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 120.997 2.399 . . . . 0.0 113.143 170.147 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -74.16 -38.5 63.69 Favored 'General case' 0 CA--C 1.522 -0.114 0 C-N-CA 125.117 1.367 . . . . 0.0 112.364 171.521 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 2.8 mp -67.91 -34.53 67.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 119.964 -0.695 . . . . 0.0 110.906 175.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -74.38 -53.63 9.23 Favored 'General case' 0 N--CA 1.44 -0.957 0 C-N-CA 125.28 1.432 . . . . 0.0 111.557 -176.211 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.23 -38.39 65.68 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.541 -0.724 . . . . 0.0 112.383 175.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 17.1 t60 -67.25 -49.81 62.97 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.593 1.157 . . . . 0.0 113.504 173.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -48.19 -49.78 31.51 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.632 1.573 . . . . 0.0 112.405 177.326 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -69.36 -39.81 77.86 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.366 0.666 . . . . 0.0 112.053 -176.214 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 48.8 t -50.13 -51.58 42.15 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 123.528 0.731 . . . . 0.0 112.493 167.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 36.0 mtp -57.95 -51.79 68.2 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.118 1.367 . . . . 0.0 110.787 172.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 45.9 mtt180 -54.9 -29.84 56.92 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 126.097 1.759 . . . . 0.0 114.392 -177.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -48.06 -22.06 0.56 Allowed 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 114.793 1.405 . . . . 0.0 114.793 168.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.8 mp -95.85 1.89 53.37 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.662 1.585 . . . . 0.0 112.186 -173.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 86.76 15.04 64.08 Favored Glycine 0 CA--C 1.535 1.33 0 C-N-CA 124.744 1.164 . . . . 0.0 113.07 -169.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -71.73 141.06 49.79 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 126.576 1.95 . . . . 0.0 111.524 -179.167 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -101.2 93.71 5.59 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.332 1.453 . . . . 0.0 108.344 -178.31 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.126 0 C-N-CA 127.544 2.338 . . . . 0.0 109.313 -177.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.319 0 N-CA-C 108.325 -1.91 . . . . 0.0 108.325 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 12.2 m -145.88 155.25 42.76 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.156 0.982 . . . . 0.0 109.792 -170.333 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 -143.27 154.5 43.87 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 123.881 0.872 . . . . 0.0 111.045 -172.414 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 4.0 m -148.88 157.94 43.8 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 125.41 1.484 . . . . 0.0 109.12 -174.278 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 35.8 tpp -127.59 72.52 78.0 Favored Pre-proline 0 N--CA 1.472 0.665 0 C-N-CA 123.671 0.789 . . . . 0.0 112.099 176.39 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -76.87 37.38 0.57 Allowed 'Trans proline' 0 CA--C 1.549 1.236 0 C-N-CA 124.0 3.134 . . . . 0.0 112.072 173.623 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -156.35 41.79 0.56 Allowed Glycine 0 CA--C 1.529 0.911 0 O-C-N 121.293 -0.879 . . . . 0.0 114.601 -163.725 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -138.23 170.23 16.39 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.384 1.074 . . . . 0.0 111.554 174.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 14.7 p -152.28 150.75 12.69 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 125.24 1.416 . . . . 0.0 109.407 173.219 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.4 p-10 -132.96 -9.08 3.06 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 126.177 1.791 . . . . 0.0 113.58 -172.092 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.3 m -86.66 29.44 0.79 Allowed 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 114.781 1.4 . . . . 0.0 114.781 -140.628 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -132.81 73.98 75.09 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 125.811 1.644 . . . . 0.0 110.022 -177.062 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -73.89 178.42 6.86 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 124.119 3.212 . . . . 0.0 112.367 -179.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -72.08 156.24 90.96 Favored Pre-proline 0 CA--C 1.547 0.837 0 C-N-CA 124.62 1.168 . . . . 0.0 112.236 172.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -70.24 162.06 43.71 Favored 'Trans proline' 0 CA--C 1.545 1.069 0 C-N-CA 122.884 2.39 . . . . 0.0 111.492 164.62 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -73.09 178.99 5.83 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 123.248 2.632 . . . . 0.0 112.534 171.23 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -66.34 149.26 50.64 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.869 1.268 . . . . 0.0 113.96 -178.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.3 m -65.48 27.38 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 127.512 2.325 . . . . 0.0 114.8 168.176 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 10.3 tm0? -65.1 128.45 35.84 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.157 1.383 . . . . 0.0 110.938 -174.091 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.441 ' HG3' ' H ' ' A' ' 21' ' ' LYS . 4.6 tp10 62.93 171.83 0.15 Allowed 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 127.767 2.427 . . . . 0.0 116.694 176.322 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.441 ' H ' ' HG3' ' A' ' 20' ' ' GLU . 0.0 OUTLIER -70.68 137.48 49.84 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 113.897 -1.502 . . . . 0.0 109.404 156.419 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.8 mptt -133.03 161.11 65.78 Favored Pre-proline 0 N--CA 1.475 0.777 0 C-N-CA 125.003 1.321 . . . . 0.0 111.266 179.071 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -80.6 168.41 17.96 Favored 'Trans proline' 0 CA--C 1.535 0.546 0 C-N-CA 122.986 2.457 . . . . 0.0 112.131 175.196 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.663 ' CD1' ' H ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -100.48 163.62 12.28 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.193 0.997 . . . . 0.0 109.939 169.03 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.663 ' H ' ' CD1' ' A' ' 24' ' ' LEU . 19.1 pttp -139.39 129.93 14.53 Favored Pre-proline 0 CA--C 1.534 0.361 0 C-N-CA 129.668 3.187 . . . . 0.0 107.101 178.569 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -63.87 -24.49 67.92 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 124.121 3.214 . . . . 0.0 113.919 -155.43 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 19.1 p -65.96 -16.36 63.81 Favored 'General case' 0 CA--C 1.558 1.267 0 C-N-CA 125.488 1.515 . . . . 0.0 113.352 175.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.425 ' SG ' ' NZ ' ' A' ' 25' ' ' LYS . 52.4 m -118.68 -6.31 10.64 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.358 1.863 . . . . 0.0 114.804 -176.549 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.47 151.67 45.8 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.183 -0.948 . . . . 0.0 110.968 -175.143 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 21.3 m 37.69 56.06 4.17 Favored Pre-proline 0 CA--C 1.549 0.92 0 N-CA-C 114.227 1.195 . . . . 0.0 114.227 -174.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -66.9 -11.47 32.27 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 123.149 2.566 . . . . 0.0 112.695 -166.24 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 38.0 mm-40 -88.02 -41.56 13.02 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.468 1.507 . . . . 0.0 112.44 -177.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -64.0 -35.31 80.28 Favored 'General case' 0 N--CA 1.48 1.049 0 O-C-N 120.635 -1.291 . . . . 0.0 110.674 158.297 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.443 ' HE2' ' OD2' ' A' ' 38' ' ' ASP . 17.3 tttt -59.82 -42.6 93.88 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 119.484 1.038 . . . . 0.0 112.656 175.475 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.4 mttt -55.43 -50.01 70.93 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 125.513 1.525 . . . . 0.0 110.552 176.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.46 -34.34 76.97 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.83 0.852 . . . . 0.0 113.018 174.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 4.3 ttp180 -59.48 -54.89 41.42 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.892 1.277 . . . . 0.0 109.943 176.568 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.443 ' OD2' ' HE2' ' A' ' 34' ' ' LYS . 84.2 m-20 -74.46 -28.69 61.14 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.526 1.13 . . . . 0.0 111.596 -175.4 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.01 -39.95 94.01 Favored 'General case' 0 CA--C 1.547 0.834 0 O-C-N 120.637 -1.289 . . . . 0.0 113.356 163.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.6 t -59.64 -34.07 72.33 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.007 -1.058 . . . . 0.0 111.435 173.467 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 91.4 mt -71.85 -35.14 53.71 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 O-C-N 120.62 -1.3 . . . . 0.0 111.183 176.172 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 87.6 mt -63.79 -35.45 73.14 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 124.05 0.94 . . . . 0.0 111.985 169.503 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -69.95 -43.62 71.2 Favored 'General case' 0 CA--C 1.556 1.21 0 N-CA-C 114.053 1.131 . . . . 0.0 114.053 177.611 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.51 -15.26 0.38 Allowed 'General case' 0 N--CA 1.485 1.31 0 N-CA-C 116.874 2.176 . . . . 0.0 116.874 -170.147 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 92.55 164.31 38.05 Favored Glycine 0 CA--C 1.536 1.36 0 CA-C-O 122.153 0.863 . . . . 0.0 113.148 -165.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -68.89 -41.99 77.56 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 -164.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -55.7 -34.83 65.44 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.771 1.228 . . . . 0.0 113.804 175.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 68.8 m-70 -87.64 12.23 13.13 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.561 1.145 . . . . 0.0 112.342 -176.592 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 1.2 m -141.41 2.59 1.66 Allowed 'General case' 0 N--CA 1.438 -1.064 0 C-N-CA 124.739 1.216 . . . . 0.0 114.163 -167.315 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -54.23 -21.16 17.94 Favored Glycine 0 N--CA 1.474 1.181 0 N-CA-C 118.136 2.014 . . . . 0.0 118.136 -167.427 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 30.1 p-80 -55.32 -36.79 66.6 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 121.72 2.76 . . . . 0.0 113.41 166.5 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.2 -41.6 85.54 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 125.377 1.471 . . . . 0.0 111.072 170.699 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 2.8 mp -70.04 -39.44 77.29 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 CA-C-N 118.73 0.695 . . . . 0.0 109.708 -178.683 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.08 -51.73 50.75 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 125.461 1.504 . . . . 0.0 112.62 -177.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.55 -38.58 84.95 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.479 0.657 . . . . 0.0 112.413 176.588 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 21.0 t60 -65.31 -48.29 73.59 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.648 0.779 . . . . 0.0 112.759 173.638 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 35.2 mtpt -52.11 -47.69 65.17 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.607 1.163 . . . . 0.0 112.617 171.833 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -57.74 -44.77 86.26 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.461 1.028 . . . . 0.0 112.375 172.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 38.1 t -56.09 -50.07 72.06 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 118.681 0.673 . . . . 0.0 112.299 175.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 71.8 mtm -59.06 -50.92 72.24 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 121.291 -0.88 . . . . 0.0 111.013 171.358 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 15.9 mtt180 -55.82 -30.89 62.12 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 126.068 1.747 . . . . 0.0 113.743 -174.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -44.66 -34.84 2.35 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.702 1.201 . . . . 0.0 113.749 168.304 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.1 mp -81.26 8.86 7.99 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 123.992 0.917 . . . . 0.0 112.744 -173.177 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 75.87 22.06 75.22 Favored Glycine 0 CA--C 1.533 1.194 0 C-N-CA 125.54 1.543 . . . . 0.0 112.408 -167.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -78.06 129.25 35.0 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 126.354 1.862 . . . . 0.0 110.974 -172.427 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.4 mppt? -82.6 78.92 9.16 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.476 1.51 . . . . 0.0 109.391 -178.089 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.247 0.934 0 C-N-CA 125.898 1.679 . . . . 0.0 109.731 -176.041 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 38.7 m . . . . . 0 CA--C 1.553 1.085 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.6 -24.67 30.16 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.429 2.752 . . . . 0.0 112.309 -158.331 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -63.07 -48.3 79.25 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.458 1.903 . . . . 0.0 113.789 169.219 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.48 -34.27 74.1 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 119.483 1.038 . . . . 0.0 111.732 168.707 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 7.0 tmtt? -58.8 -45.49 89.79 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.895 1.278 . . . . 0.0 112.211 173.484 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 72.6 tttt -55.51 -51.22 67.73 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 126.427 1.891 . . . . 0.0 111.422 172.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.05 -37.97 89.36 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 114.796 -1.093 . . . . 0.0 112.641 178.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 10.2 ttp85 -59.94 -57.25 13.66 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.767 1.227 . . . . 0.0 110.178 174.351 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 62.0 m-20 -69.18 -29.74 67.79 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.163 0.985 . . . . 0.0 112.67 -175.513 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.61 -41.41 96.22 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 120.542 -1.349 . . . . 0.0 112.35 168.139 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.8 t -57.67 -34.53 69.49 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 122.21 1.005 . . . . 0.0 111.76 172.464 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 64.3 mt -77.11 -33.76 20.75 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 C-N-CA 125.182 1.393 . . . . 0.0 112.257 178.429 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 74.0 mt -64.99 -34.97 74.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 124.052 0.941 . . . . 0.0 111.395 168.365 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -72.92 -36.03 67.17 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 114.54 1.311 . . . . 0.0 114.54 177.299 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -139.24 -58.64 0.59 Allowed 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 125.078 1.351 . . . . 0.0 113.788 175.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 139.79 161.93 8.91 Favored Glycine 0 CA--C 1.53 1.003 0 C-N-CA 126.278 1.894 . . . . 0.0 109.558 -159.535 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.489 ' HB3' HD11 ' A' ' 53' ' ' ILE . 0.3 OUTLIER -73.45 -28.49 61.99 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 120.993 -1.298 . . . . 0.0 112.928 -169.102 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -55.98 -33.67 65.03 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 123.501 0.72 . . . . 0.0 112.444 177.324 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -85.81 5.82 30.89 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.989 1.316 . . . . 0.0 113.067 178.269 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 6.1 m -148.22 16.05 1.04 Allowed 'General case' 0 N--CA 1.441 -0.887 0 C-N-CA 125.307 1.443 . . . . 0.0 113.094 -154.631 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLY . . . . . 0.689 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -65.84 -27.83 73.1 Favored Glycine 0 C--O 1.213 -1.173 0 O-C-N 120.19 -1.568 . . . . 0.0 114.658 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 41.6 p-80 -56.54 -25.18 51.19 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 120.666 2.233 . . . . 0.0 113.933 166.045 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.85 -34.57 30.06 Favored 'General case' 0 C--O 1.231 0.113 0 C-N-CA 123.837 0.855 . . . . 0.0 110.664 172.551 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.689 HD12 ' HA2' ' A' ' 50' ' ' GLY . 33.2 mt -70.43 -40.38 77.49 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.598 0 CA-C-O 118.72 -0.657 . . . . 0.0 109.711 177.454 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.54 -50.74 49.66 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 125.004 1.322 . . . . 0.0 111.912 -175.647 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.99 -37.47 66.6 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 121.152 -0.968 . . . . 0.0 113.006 173.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 14.5 t60 -72.45 -44.26 62.61 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.508 1.123 . . . . 0.0 113.901 174.978 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.86 -54.75 25.53 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.769 1.628 . . . . 0.0 110.956 175.838 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.431 ' HA ' ' HB2' ' A' ' 61' ' ' ARG . 11.2 mm-40 -72.18 -33.85 67.98 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 122.773 0.429 . . . . 0.0 111.692 -174.041 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 48.8 t -48.51 -60.45 2.68 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-O 118.505 -0.76 . . . . 0.0 112.3 162.957 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 78.3 mtm -52.66 -45.61 66.83 Favored 'General case' 0 N--CA 1.486 1.331 0 CA-C-N 120.027 1.285 . . . . 0.0 111.388 171.74 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.431 ' HB2' ' HA ' ' A' ' 58' ' ' GLU . 2.4 ttt85 -51.91 -39.03 58.42 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 114.378 1.251 . . . . 0.0 114.378 -175.17 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.446 ' HB3' HD12 ' A' ' 63' ' ' LEU . . . -47.33 -36.24 9.16 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.619 1.167 . . . . 0.0 113.25 172.848 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.446 HD12 ' HB3' ' A' ' 62' ' ' ALA . 5.7 mp -82.65 9.57 9.26 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 125.209 1.404 . . . . 0.0 111.658 -172.705 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.53 40.82 5.59 Favored Glycine 0 CA--C 1.532 1.138 0 C-N-CA 125.046 1.307 . . . . 0.0 113.274 177.919 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -112.28 143.65 43.01 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 121.507 -0.996 . . . . 0.0 112.273 -151.009 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? -92.54 79.87 4.86 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 125.8 1.64 . . . . 0.0 108.805 -173.306 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.427 ' OXT' HG22 ' A' ' 67' ' ' ILE . 39.2 mm . . . . . 0 CA--C 1.552 1.039 0 C-N-CA 128.81 2.844 . . . . 0.0 110.604 -161.487 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 28.5 m . . . . . 0 CA--C 1.55 0.949 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.12 -17.2 36.06 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.521 2.148 . . . . 0.0 112.47 -156.965 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -82.87 -38.78 22.47 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.575 1.55 . . . . 0.0 112.019 -178.854 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.2 p -71.06 -31.43 67.84 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 121.055 -1.028 . . . . 0.0 111.51 161.752 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 10.3 tmtt? -59.15 -47.54 84.9 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 120.096 1.316 . . . . 0.0 111.785 172.118 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 44.2 mttt -52.81 -51.94 58.88 Favored 'General case' 0 C--O 1.225 -0.217 0 C-N-CA 126.901 2.08 . . . . 0.0 111.823 171.179 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.08 -37.17 83.51 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -179.739 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 13.1 ttp85 -59.45 -55.33 36.06 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 124.709 1.203 . . . . 0.0 109.865 174.604 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -72.4 -29.41 63.71 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 115.414 -0.812 . . . . 0.0 112.41 -174.576 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.88 -44.65 96.38 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 120.795 -1.19 . . . . 0.0 112.039 165.738 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.0 t -55.96 -34.61 65.85 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 122.275 1.036 . . . . 0.0 111.678 173.717 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 66.6 mt -76.42 -32.46 21.73 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 125.274 1.43 . . . . 0.0 112.613 178.736 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 83.4 mt -66.59 -38.33 81.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 123.878 0.871 . . . . 0.0 110.868 167.273 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -72.03 -38.82 69.48 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 114.49 1.292 . . . . 0.0 114.49 -179.376 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.7 mppt? -137.77 -33.84 0.7 Allowed 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 115.993 1.849 . . . . 0.0 115.993 -177.966 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 101.79 156.7 26.44 Favored Glycine 0 CA--C 1.532 1.149 0 C-N-CA 124.605 1.098 . . . . 0.0 111.738 -157.944 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.499 ' HB3' HD11 ' A' ' 53' ' ' ILE . 0.5 OUTLIER -69.96 -27.68 64.93 Favored 'General case' 0 N--CA 1.466 0.367 0 O-C-N 121.148 -1.207 . . . . 0.0 113.059 -166.837 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -56.12 -27.59 54.54 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 123.725 0.81 . . . . 0.0 112.843 176.896 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -96.3 8.72 43.21 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.368 1.067 . . . . 0.0 112.847 177.919 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 3.7 m -146.83 17.58 1.26 Allowed 'General case' 0 N--CA 1.443 -0.811 0 C-N-CA 125.547 1.539 . . . . 0.0 112.407 -155.405 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLY . . . . . 0.741 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -68.77 -25.72 74.99 Favored Glycine 0 C--O 1.217 -0.935 0 CA-C-O 116.918 -2.046 . . . . 0.0 114.905 -177.629 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 38.9 p-80 -56.07 -28.52 57.91 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 120.016 1.908 . . . . 0.0 112.978 165.224 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.42 -34.8 35.9 Favored 'General case' 0 C--N 1.34 0.172 0 C-N-CA 123.856 0.862 . . . . 0.0 110.459 175.016 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.741 HD12 ' HA2' ' A' ' 50' ' ' GLY . 36.1 mt -69.76 -40.75 79.5 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.663 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 176.976 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -64.52 -52.43 57.82 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 125.625 1.57 . . . . 0.0 111.173 179.123 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.25 -40.04 58.0 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 113.453 0.909 . . . . 0.0 113.453 174.342 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 11.2 t60 -71.19 -42.79 68.57 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 114.193 1.182 . . . . 0.0 114.193 173.357 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.32 -52.5 65.11 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.737 1.215 . . . . 0.0 111.978 177.147 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -69.54 -33.94 73.5 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 123.145 0.578 . . . . 0.0 111.318 -176.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 48.7 t -49.35 -60.97 2.36 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-O 118.62 -0.705 . . . . 0.0 111.795 161.807 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 78.9 mtm -54.13 -45.14 71.86 Favored 'General case' 0 N--CA 1.483 1.217 0 CA-C-N 120.03 1.286 . . . . 0.0 112.712 175.533 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 47.8 mtt180 -52.18 -35.31 48.65 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 121.028 1.74 . . . . 0.0 113.976 -179.234 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.558 ' HB3' HD12 ' A' ' 63' ' ' LEU . . . -47.74 -40.12 19.61 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 113.908 1.077 . . . . 0.0 113.908 168.495 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.558 HD12 ' HB3' ' A' ' 62' ' ' ALA . 4.0 mp -82.75 10.2 8.13 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 126.458 1.903 . . . . 0.0 112.029 -172.686 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.84 30.83 13.73 Favored Glycine 0 CA--C 1.535 1.333 0 C-N-CA 124.732 1.158 . . . . 0.0 114.348 176.385 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.432 ' C ' ' HE3' ' A' ' 66' ' ' LYS . 0.3 OUTLIER -100.14 152.36 20.35 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.793 1.237 . . . . 0.0 114.105 -154.3 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.432 ' HE3' ' C ' ' A' ' 65' ' ' PHE . 0.4 OUTLIER -92.39 75.96 5.2 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 125.866 1.666 . . . . 0.0 108.955 -174.905 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 28.5 mm . . . . . 0 C--O 1.249 1.059 0 C-N-CA 127.798 2.439 . . . . 0.0 111.113 -158.321 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 56.9 m . . . . . 0 CA--C 1.544 0.743 0 N-CA-C 113.82 1.045 . . . . 0.0 113.82 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_endo -69.19 -22.67 34.37 Favored 'Trans proline' 0 CA--C 1.534 0.509 0 C-N-CA 123.425 2.75 . . . . 0.0 112.552 -157.754 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -63.1 -62.45 1.69 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.967 2.107 . . . . 0.0 112.812 171.332 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.8 p -61.12 -30.83 70.61 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 118.187 -0.911 . . . . 0.0 111.694 170.592 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 8.1 tmtt? -59.09 -49.68 76.95 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 120.052 1.296 . . . . 0.0 111.659 171.891 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 16.1 tttp -63.26 -43.06 99.04 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.783 0.833 . . . . 0.0 111.436 176.767 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.19 -39.37 92.5 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.49 0.716 . . . . 0.0 112.86 176.082 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 8.2 ttp85 -58.26 -54.62 44.98 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.551 1.54 . . . . 0.0 109.405 173.637 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 78.5 m-20 -68.78 -33.56 74.09 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.039 0.936 . . . . 0.0 113.442 -176.556 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.4 -37.32 82.92 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 120.588 -1.32 . . . . 0.0 112.854 171.142 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.1 t -57.19 -38.54 73.82 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.723 0.773 . . . . 0.0 111.225 168.461 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 67.0 mt -75.43 -30.17 22.01 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 C-N-CA 124.95 1.3 . . . . 0.0 112.27 -176.912 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 67.2 mt -58.18 -45.38 88.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 CA-C-N 119.028 0.831 . . . . 0.0 110.377 163.743 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.67 -37.35 79.53 Favored 'General case' 0 CA--C 1.552 1.05 0 N-CA-C 115.024 1.491 . . . . 0.0 115.024 -174.284 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.87 -8.63 0.41 Allowed 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 117.57 2.433 . . . . 0.0 117.57 -176.555 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 82.96 165.62 37.88 Favored Glycine 0 CA--C 1.536 1.358 0 CA-C-N 119.773 1.17 . . . . 0.0 112.531 -164.335 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -76.69 -30.92 56.91 Favored 'General case' 0 CA--C 1.516 -0.349 0 O-C-N 120.311 -1.699 . . . . 0.0 114.401 -164.735 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -58.94 -35.87 73.83 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 123.229 0.33 . . . . 0.0 111.462 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 -82.83 4.42 25.51 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.967 1.707 . . . . 0.0 112.986 177.212 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.407 ' HA ' ' CE1' ' A' ' 51' ' ' HIS . 1.8 m -139.3 18.0 2.58 Favored 'General case' 0 N--CA 1.442 -0.86 0 C-N-CA 127.794 2.438 . . . . 0.0 112.154 -168.125 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLY . . . . . 0.712 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -69.93 -19.38 75.26 Favored Glycine 0 C--O 1.221 -0.658 0 O-C-N 119.751 -1.843 . . . . 0.0 115.56 -176.251 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' HIS . . . . . 0.407 ' CE1' ' HA ' ' A' ' 49' ' ' CYS . 38.4 p-80 -58.24 -34.65 70.68 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 120.18 1.99 . . . . 0.0 112.352 162.883 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.65 -32.87 60.38 Favored 'General case' 0 CA--C 1.52 -0.201 0 C-N-CA 125.326 1.45 . . . . 0.0 110.774 174.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.712 HD12 ' HA2' ' A' ' 50' ' ' GLY . 5.1 mt -66.72 -39.28 83.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 118.843 -1.143 . . . . 0.0 110.748 167.641 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -74.63 -47.98 28.96 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 -170.352 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.79 -39.99 72.05 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 121.597 0.713 . . . . 0.0 112.138 170.374 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 18.5 t60 -65.36 -48.96 71.12 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.73 0.812 . . . . 0.0 112.913 174.597 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 52.7 mttm -48.13 -47.18 34.84 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 124.885 1.274 . . . . 0.0 112.168 177.651 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -75.79 -25.95 56.87 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 117.844 -1.074 . . . . 0.0 113.045 -177.286 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 37.6 t -58.55 -58.31 9.12 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-O 118.376 -0.821 . . . . 0.0 111.545 160.523 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 9.3 mmm -47.15 -45.23 22.52 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-N 120.341 1.428 . . . . 0.0 111.36 174.351 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 1.9 mtt85 -63.07 -32.42 73.79 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 117.028 -1.463 . . . . 0.0 114.134 -171.147 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -50.48 -36.83 35.44 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 118.985 0.811 . . . . 0.0 112.613 170.212 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 4.9 mp -82.52 8.04 12.81 Favored 'General case' 0 CA--C 1.554 1.098 0 C-N-CA 125.817 1.647 . . . . 0.0 112.003 -173.018 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.75 41.21 5.42 Favored Glycine 0 CA--C 1.534 1.266 0 C-N-CA 124.864 1.221 . . . . 0.0 114.788 171.153 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -119.75 145.83 46.2 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 120.725 -1.456 . . . . 0.0 114.031 -142.868 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -91.64 89.56 7.19 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.429 1.892 . . . . 0.0 109.158 -176.198 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 23.9 mm . . . . . 0 C--O 1.25 1.114 0 C-N-CA 126.707 2.003 . . . . 0.0 111.848 -158.143 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.6 m . . . . . 0 CA--C 1.549 0.919 0 N-CA-C 114.21 1.189 . . . . 0.0 114.21 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -65.3 -24.35 58.08 Favored 'Trans proline' 0 CA--C 1.538 0.701 0 C-N-CA 122.483 2.122 . . . . 0.0 112.328 -160.961 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -58.37 -52.01 67.39 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 127.065 2.146 . . . . 0.0 111.843 177.942 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.9 p -76.5 -38.26 55.5 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.289 1.436 . . . . 0.0 111.565 170.247 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 6.4 tmtt? -52.73 -46.87 67.62 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 120.102 1.319 . . . . 0.0 112.057 179.048 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.5 tmmm? -51.97 -55.0 23.09 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 126.959 2.104 . . . . 0.0 112.183 171.094 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.5 -35.02 79.23 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 114.393 -1.276 . . . . 0.0 112.634 -177.004 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 7.5 ttp85 -62.6 -54.98 31.51 Favored 'General case' 0 C--O 1.222 -0.368 0 C-N-CA 125.766 1.626 . . . . 0.0 109.444 174.614 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -71.45 -28.16 63.77 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -175.843 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.86 -41.22 87.68 Favored 'General case' 0 CA--C 1.544 0.75 0 O-C-N 120.549 -1.344 . . . . 0.0 112.965 167.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 6.2 t -55.5 -37.39 67.8 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 122.271 1.034 . . . . 0.0 111.044 169.694 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 73.5 mt -75.39 -31.27 23.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 O-C-N 121.052 -1.03 . . . . 0.0 111.949 -179.374 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 86.0 mt -64.11 -35.76 74.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 CA-C-N 118.825 0.738 . . . . 0.0 111.641 166.796 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 27.2 mt-10 -75.03 -36.66 61.87 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 178.336 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.411 ' HG3' ' HB2' ' A' ' 48' ' ' HIS . 0.0 OUTLIER -148.68 -11.13 0.34 Allowed 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 118.083 2.623 . . . . 0.0 118.083 -173.666 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 86.78 166.7 42.82 Favored Glycine 0 CA--C 1.539 1.55 0 CA-C-N 120.035 1.289 . . . . 0.0 112.908 -163.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -76.44 -30.53 57.41 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 120.351 -1.676 . . . . 0.0 113.58 -168.388 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -58.25 -33.34 69.26 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 123.155 0.582 . . . . 0.0 112.258 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' HIS . . . . . 0.411 ' HB2' ' HG3' ' A' ' 44' ' ' LYS . 93.9 m-70 -88.58 10.9 18.82 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.715 1.606 . . . . 0.0 112.591 178.767 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 2.7 m -141.2 14.91 2.23 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 126.294 1.838 . . . . 0.0 113.85 -162.788 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -60.29 -32.73 77.78 Favored Glycine 0 C--O 1.213 -1.189 0 O-C-N 120.152 -1.593 . . . . 0.0 115.264 -176.713 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 41.8 p-80 -55.37 -25.55 36.01 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 121.963 2.881 . . . . 0.0 114.439 169.375 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -79.89 -36.56 36.35 Favored 'General case' 0 C--N 1.339 0.119 0 C-N-CA 123.948 0.899 . . . . 0.0 111.379 170.066 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 42.6 mt -75.89 -33.52 25.64 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.391 0 CA-C-O 119.092 -0.48 . . . . 0.0 110.184 -177.673 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.519 ' HG3' ' HE3' ' A' ' 57' ' ' LYS . 1.5 mp0 -70.24 -53.23 17.88 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 125.48 1.512 . . . . 0.0 112.781 177.382 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -53.37 -35.11 59.94 Favored 'General case' 0 CA--C 1.545 0.752 0 O-C-N 121.267 -0.895 . . . . 0.0 113.028 173.384 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 19.2 t60 -73.9 -43.18 59.27 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.535 1.134 . . . . 0.0 113.931 174.513 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.519 ' HE3' ' HG3' ' A' ' 54' ' ' GLU . 26.3 mtmt -53.16 -52.21 59.51 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 125.275 1.43 . . . . 0.0 111.339 175.302 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -66.56 -37.58 85.27 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 122.99 0.516 . . . . 0.0 111.586 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 18.6 t -52.57 -59.64 4.21 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-O 117.805 -1.093 . . . . 0.0 112.162 167.603 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 92.9 mtp -47.6 -51.6 20.63 Favored 'General case' 0 N--CA 1.488 1.464 0 CA-C-N 120.69 1.586 . . . . 0.0 110.821 171.833 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 37.5 mtt180 -54.91 -34.8 63.47 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 125.453 1.501 . . . . 0.0 114.0 -177.421 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -48.45 -39.09 21.61 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 119.203 0.91 . . . . 0.0 113.192 169.389 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.6 mp -81.0 8.86 7.47 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 124.84 1.256 . . . . 0.0 111.746 -173.704 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 86.65 18.81 57.82 Favored Glycine 0 CA--C 1.535 1.334 0 C-N-CA 125.278 1.418 . . . . 0.0 114.404 -178.363 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -72.59 170.67 13.95 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.538 1.535 . . . . 0.0 114.846 -166.039 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.31 88.93 3.01 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 125.103 1.361 . . . . 0.0 108.369 -177.158 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 26.0 mm . . . . . 0 C--O 1.244 0.765 0 C-N-CA 130.69 3.596 . . . . 0.0 107.458 -162.392 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 56.7 m . . . . . 0 CA--C 1.547 0.852 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -69.65 -24.09 30.57 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 123.319 2.679 . . . . 0.0 112.776 -158.903 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.41 ' HG3' ' H ' ' A' ' 33' ' ' THR . 0.1 OUTLIER -53.48 -69.83 0.11 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 127.785 2.434 . . . . 0.0 113.76 164.177 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.41 ' H ' ' HG3' ' A' ' 32' ' ' GLU . 0.0 OUTLIER -60.84 -35.28 76.13 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 126.129 1.771 . . . . 0.0 110.96 176.554 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 9.2 tmtm? -53.41 -52.01 60.74 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.969 1.708 . . . . 0.0 112.264 169.808 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 50.4 tttm -58.5 -47.89 82.6 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.806 0.842 . . . . 0.0 111.984 175.369 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.14 -39.76 95.61 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 114.731 -1.122 . . . . 0.0 112.209 -178.191 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 11.8 ttp85 -61.48 -57.12 13.44 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 125.729 1.612 . . . . 0.0 109.918 174.453 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -66.35 -28.51 68.72 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.851 0.861 . . . . 0.0 112.92 -176.941 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.97 -42.39 80.92 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 120.216 -1.552 . . . . 0.0 112.646 169.005 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.7 t -55.43 -34.41 64.42 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 122.173 0.987 . . . . 0.0 111.545 171.386 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 61.8 mt -77.36 -33.55 19.89 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 C-N-CA 125.381 1.472 . . . . 0.0 112.428 178.352 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 73.2 mt -66.05 -34.06 67.69 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 123.883 0.873 . . . . 0.0 111.44 168.207 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -74.01 -36.3 64.45 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.013 1.325 . . . . 0.0 114.509 178.595 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.7 mppt? -138.43 -55.97 0.64 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.162 1.385 . . . . 0.0 113.646 175.533 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 136.75 163.54 9.82 Favored Glycine 0 CA--C 1.532 1.103 0 C-N-CA 126.32 1.914 . . . . 0.0 109.6 -159.936 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.521 ' HB3' HD11 ' A' ' 53' ' ' ILE . 0.2 OUTLIER -74.1 -28.22 61.26 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 120.927 -1.337 . . . . 0.0 112.893 -169.091 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 -57.49 -32.49 67.06 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 178.935 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -84.79 5.22 29.46 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.941 1.296 . . . . 0.0 113.13 177.706 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 6.9 m -147.47 16.11 1.14 Allowed 'General case' 0 N--CA 1.441 -0.901 0 C-N-CA 125.067 1.347 . . . . 0.0 113.107 -154.299 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLY . . . . . 0.643 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -65.76 -27.59 72.84 Favored Glycine 0 C--O 1.216 -0.983 0 O-C-N 120.115 -1.615 . . . . 0.0 114.964 -179.549 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 40.8 p-80 -54.93 -25.58 30.34 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 120.973 2.386 . . . . 0.0 113.852 165.761 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.58 -34.04 31.24 Favored 'General case' 0 N--CA 1.462 0.135 0 C-N-CA 123.718 0.807 . . . . 0.0 110.956 173.081 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.643 HD12 ' HA2' ' A' ' 50' ' ' GLY . 35.9 mt -74.45 -38.57 46.77 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-O 119.202 -0.428 . . . . 0.0 110.626 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.68 -53.12 56.29 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 125.851 1.66 . . . . 0.0 111.404 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -56.37 -40.5 74.66 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.052 -1.03 . . . . 0.0 112.65 177.324 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 15.5 t60 -68.31 -48.12 65.75 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.937 1.295 . . . . 0.0 113.737 177.14 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 4.1 mtpp -48.97 -53.05 21.5 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 126.258 1.823 . . . . 0.0 111.498 174.635 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 34.8 mm-40 -72.9 -36.82 67.38 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.206 0.602 . . . . 0.0 111.564 -176.346 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 48.6 t -49.89 -56.49 10.31 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.594 0.757 . . . . 0.0 112.16 165.428 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 8.1 mtp -54.36 -53.59 51.96 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.89 1.276 . . . . 0.0 110.168 174.353 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 57.9 mtt180 -53.34 -30.93 41.93 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 126.137 1.775 . . . . 0.0 114.683 -176.362 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -47.56 -35.89 9.71 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.346 1.058 . . . . 0.0 112.911 169.847 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.3 mp -79.0 5.62 11.27 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.909 1.283 . . . . 0.0 112.381 -172.845 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.56 8.6 70.31 Favored Glycine 0 CA--C 1.535 1.291 0 C-N-CA 125.899 1.714 . . . . 0.0 113.049 -170.83 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -72.36 160.74 31.85 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 127.407 2.283 . . . . 0.0 112.74 -172.656 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.9 94.44 4.68 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.727 1.211 . . . . 0.0 108.131 -179.245 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.308 0 C-N-CA 127.469 2.308 . . . . 0.0 109.676 174.276 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 53.6 m . . . . . 0 CA--C 1.549 0.925 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -68.98 -7.93 22.17 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 123.906 3.071 . . . . 0.0 113.578 -158.771 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 36.2 mm-40 -96.37 -43.54 7.62 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 125.215 1.406 . . . . 0.0 110.685 -176.605 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.1 p -66.58 -27.26 67.59 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 117.948 -1.025 . . . . 0.0 111.99 161.534 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 9.8 tmtt? -58.32 -55.43 35.11 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 120.276 1.398 . . . . 0.0 111.457 169.821 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.6 mttp -55.16 -43.38 74.19 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 125.355 1.462 . . . . 0.0 112.458 172.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.61 -39.8 80.67 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 177.493 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 12.0 ttp85 -58.49 -53.25 60.44 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.514 1.125 . . . . 0.0 109.106 176.825 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -74.37 -30.11 61.84 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 115.124 -0.944 . . . . 0.0 112.817 -174.752 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.49 -43.32 99.08 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 120.772 -1.205 . . . . 0.0 111.794 166.148 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.8 t -56.27 -33.45 65.5 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.952 0.901 . . . . 0.0 111.741 173.955 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 67.0 mt -77.88 -35.46 20.84 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 124.769 1.228 . . . . 0.0 112.482 177.982 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 84.4 mt -64.46 -36.29 76.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 124.375 1.07 . . . . 0.0 111.379 168.364 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -71.98 -37.84 69.82 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.761 1.625 . . . . 0.0 113.983 178.625 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.9 mppt? -139.12 -59.23 0.59 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.582 1.553 . . . . 0.0 113.706 178.043 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 135.61 158.24 8.17 Favored Glycine 0 CA--C 1.531 1.033 0 C-N-CA 126.104 1.811 . . . . 0.0 109.714 -159.102 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.505 ' HB3' HD11 ' A' ' 53' ' ' ILE . 0.4 OUTLIER -72.96 -27.48 61.85 Favored 'General case' 0 N--CA 1.465 0.28 0 O-C-N 120.746 -1.444 . . . . 0.0 113.011 -165.857 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -56.46 -36.18 68.77 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 122.76 0.424 . . . . 0.0 111.76 177.68 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -81.51 4.46 21.16 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.81 1.244 . . . . 0.0 113.1 177.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 6.0 m -147.81 15.84 1.09 Allowed 'General case' 0 N--CA 1.439 -0.994 0 C-N-CA 125.945 1.698 . . . . 0.0 112.473 -154.957 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLY . . . . . 0.756 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -75.33 -13.16 83.08 Favored Glycine 0 C--O 1.222 -0.652 0 O-C-N 119.707 -1.87 . . . . 0.0 115.378 -178.061 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 35.2 p-80 -60.65 -33.82 73.38 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.889 1.844 . . . . 0.0 112.214 158.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.84 -37.85 67.28 Favored 'General case' 0 CA--C 1.516 -0.332 0 C-N-CA 124.132 0.973 . . . . 0.0 108.944 177.147 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.756 HD12 ' HA2' ' A' ' 50' ' ' GLY . 17.6 mt -71.23 -43.05 74.91 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.614 0 CA-C-O 118.853 -0.594 . . . . 0.0 109.673 177.617 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -60.93 -46.67 89.75 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 119.43 1.014 . . . . 0.0 112.267 179.55 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -61.54 -44.52 96.89 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.501 0.72 . . . . 0.0 112.865 175.339 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 14.2 t60 -63.33 -45.42 91.36 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 121.142 -0.973 . . . . 0.0 112.643 174.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.6 mtmt -54.76 -48.29 72.83 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.598 0.759 . . . . 0.0 111.235 173.667 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 87.3 mt-10 -70.94 -28.29 64.38 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 117.929 -1.034 . . . . 0.0 113.112 -178.563 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 48.9 t -57.02 -60.24 3.88 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 119.183 0.901 . . . . 0.0 111.212 160.841 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 76.0 mtm -54.05 -45.51 71.69 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 119.576 1.08 . . . . 0.0 113.355 178.212 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 47.7 mtt180 -50.71 -37.28 40.6 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 126.636 1.974 . . . . 0.0 113.292 -178.196 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.57 ' HB3' HD12 ' A' ' 63' ' ' LEU . . . -47.45 -39.08 14.9 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 169.428 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.57 HD12 ' HB3' ' A' ' 62' ' ' ALA . 1.7 mp -84.1 10.26 10.55 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 126.367 1.867 . . . . 0.0 111.571 -172.397 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.11 33.46 10.76 Favored Glycine 0 CA--C 1.534 1.247 0 O-C-N 120.623 -1.298 . . . . 0.0 113.685 -179.313 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -99.07 156.46 16.92 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.038 1.735 . . . . 0.0 112.749 -168.578 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 3.1 mppt? -116.37 73.11 0.84 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.0 1.72 . . . . 0.0 109.504 -160.464 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.028 0 C-N-CA 125.801 1.64 . . . . 0.0 111.759 -165.691 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 55.6 m . . . . . 0 CA--C 1.548 0.879 0 N-CA-C 113.777 1.028 . . . . 0.0 113.777 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -69.9 -18.22 36.48 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.642 2.228 . . . . 0.0 112.747 -156.519 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 27.5 mm-40 -85.37 -40.8 16.08 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.691 1.196 . . . . 0.0 112.295 -178.277 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.4 p -65.53 -30.28 71.01 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 120.725 -1.235 . . . . 0.0 111.328 161.134 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 9.6 tmtt? -60.85 -48.14 83.18 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 120.39 1.45 . . . . 0.0 111.836 171.794 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 42.4 mttt -55.04 -49.64 71.07 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 126.106 1.763 . . . . 0.0 111.694 171.297 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.17 -36.6 83.51 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 112.921 0.712 . . . . 0.0 112.921 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 8.3 ttp85 -58.87 -53.46 58.18 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.939 1.296 . . . . 0.0 109.6 174.219 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 60.6 m-20 -70.46 -30.39 67.2 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.78 0.832 . . . . 0.0 112.836 -176.954 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.42 -39.42 93.8 Favored 'General case' 0 CA--C 1.547 0.857 0 O-C-N 120.418 -1.426 . . . . 0.0 112.969 166.889 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.8 t -59.73 -32.38 70.49 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 122.773 1.273 . . . . 0.0 112.095 169.959 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 67.9 mt -75.57 -33.01 25.84 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 O-C-N 120.386 -1.446 . . . . 0.0 111.341 177.522 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 77.3 mt -62.48 -36.63 75.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.617 1.167 . . . . 0.0 112.173 166.511 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -64.88 -48.67 73.42 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 119.573 1.079 . . . . 0.0 113.269 175.599 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.4 pttm -155.5 -4.91 0.13 Allowed 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 116.407 2.003 . . . . 0.0 116.407 -160.994 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 83.71 158.42 26.76 Favored Glycine 0 CA--C 1.527 0.811 0 CA-C-N 119.057 0.844 . . . . 0.0 112.62 -167.973 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.09 -28.36 68.11 Favored 'General case' 0 C--N 1.334 -0.101 0 O-C-N 121.578 -0.954 . . . . 0.0 112.723 -169.782 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.416 ' HG3' ' CD2' ' A' ' 48' ' ' HIS . 11.3 pt-20 -59.69 -26.22 65.4 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-O 118.122 -0.942 . . . . 0.0 112.905 175.613 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' HIS . . . . . 0.416 ' CD2' ' HG3' ' A' ' 47' ' ' GLU . 82.5 m-70 -98.72 15.33 25.64 Favored 'General case' 0 C--N 1.352 0.683 0 CA-C-N 120.61 1.55 . . . . 0.0 110.528 -179.594 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 1.8 m -147.79 14.74 1.07 Allowed 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 125.973 1.709 . . . . 0.0 113.503 -157.695 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLY . . . . . 0.544 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -67.11 -17.63 68.15 Favored Glycine 0 C--O 1.215 -1.064 0 O-C-N 119.569 -1.957 . . . . 0.0 115.825 -175.508 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 35.2 p-80 -58.94 -33.69 70.89 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 121.572 2.686 . . . . 0.0 112.795 164.402 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.24 -34.64 61.43 Favored 'General case' 0 N--CA 1.462 0.175 0 C-N-CA 126.354 1.862 . . . . 0.0 111.453 173.737 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.544 HD12 ' HA2' ' A' ' 50' ' ' GLY . 3.5 mt -70.54 -43.44 77.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 118.911 -1.115 . . . . 0.0 110.914 171.058 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -63.02 -53.78 48.54 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.921 0.888 . . . . 0.0 112.278 -176.516 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -58.45 -32.69 68.95 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.34 -1.475 . . . . 0.0 113.646 178.082 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 10.7 t60 -74.02 -44.67 53.66 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.677 1.191 . . . . 0.0 113.043 175.053 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.519 ' HD3' HG22 ' A' ' 53' ' ' ILE . 35.0 mtpt -53.54 -53.1 56.46 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.162 1.385 . . . . 0.0 112.07 176.27 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -62.76 -40.62 97.83 Favored 'General case' 0 C--N 1.327 -0.405 0 O-C-N 123.318 0.386 . . . . 0.0 111.713 -176.285 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 44.0 t -51.5 -51.28 56.51 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 124.069 0.948 . . . . 0.0 112.844 169.269 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 72.8 mtm -62.06 -51.72 66.81 Favored 'General case' 0 N--CA 1.481 1.081 0 O-C-N 120.979 -1.076 . . . . 0.0 111.507 171.864 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 69.0 mtt180 -53.77 -32.37 52.1 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 126.981 2.112 . . . . 0.0 113.87 -175.44 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -44.86 -33.35 1.92 Allowed 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.047 1.339 . . . . 0.0 113.804 168.605 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.3 mp -82.19 5.63 19.2 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.195 0.998 . . . . 0.0 112.375 -173.286 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.29 17.9 75.3 Favored Glycine 0 CA--C 1.534 1.233 0 C-N-CA 125.039 1.304 . . . . 0.0 112.614 -166.903 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -70.49 144.24 51.45 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.999 1.72 . . . . 0.0 110.692 179.371 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? -106.34 101.72 11.17 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 125.084 1.354 . . . . 0.0 108.979 -175.124 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.252 1.207 0 C-N-CA 128.512 2.725 . . . . 0.0 109.191 -172.027 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 57.4 m . . . . . 0 CA--C 1.552 1.032 0 N-CA-C 114.1 1.148 . . . . 0.0 114.1 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -65.57 -30.84 51.43 Favored 'Trans proline' 0 CA--C 1.534 0.495 0 C-N-CA 123.729 2.953 . . . . 0.0 112.041 -166.092 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -41.5 -70.04 0.12 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 127.349 2.26 . . . . 0.0 115.31 158.365 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -65.25 -28.7 69.53 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.007 -1.058 . . . . 0.0 111.726 177.046 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 5.0 tmtt? -58.12 -46.69 85.15 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 120.359 1.436 . . . . 0.0 111.088 171.878 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 4.5 tmtm? -63.34 -45.06 92.98 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 123.721 0.808 . . . . 0.0 110.716 176.434 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.78 -42.4 97.46 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 176.832 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 11.4 ttp85 -59.45 -53.72 54.93 Favored 'General case' 0 C--O 1.221 -0.429 0 C-N-CA 126.148 1.779 . . . . 0.0 110.247 175.581 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 56.8 m-20 -66.19 -31.97 73.12 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.014 0.926 . . . . 0.0 113.137 179.564 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -69.22 -37.08 77.87 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 120.728 -1.232 . . . . 0.0 112.447 172.914 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 9.3 t -55.91 -43.21 77.08 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 121.949 0.88 . . . . 0.0 110.89 169.24 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 71.4 mt -69.16 -29.01 41.24 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 C-N-CA 124.319 1.048 . . . . 0.0 111.272 -179.697 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 89.3 mt -70.31 -35.15 61.41 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 C-N-CA 123.509 0.724 . . . . 0.0 112.092 169.048 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -76.41 -32.58 58.59 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 114.561 1.319 . . . . 0.0 114.561 178.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.414 ' HG3' ' HB2' ' A' ' 48' ' ' HIS . 0.0 OUTLIER -146.2 -18.14 0.44 Allowed 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 117.238 2.31 . . . . 0.0 117.238 -175.413 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 91.33 174.66 43.47 Favored Glycine 0 CA--C 1.536 1.364 0 CA-C-N 118.868 0.758 . . . . 0.0 113.386 -167.179 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -79.6 -35.07 40.13 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 115.592 1.701 . . . . 0.0 115.592 -157.575 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -60.89 -34.38 74.56 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.086 0.954 . . . . 0.0 113.423 174.19 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' HIS . . . . . 0.414 ' HB2' ' HG3' ' A' ' 44' ' ' LYS . 99.4 m-70 -81.92 9.16 8.7 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.574 1.15 . . . . 0.0 112.514 -178.439 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 9.8 m -140.03 12.56 2.43 Favored 'General case' 0 N--CA 1.441 -0.906 0 C-N-CA 125.805 1.642 . . . . 0.0 113.949 -162.794 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -63.96 -30.11 76.78 Favored Glycine 0 C--O 1.213 -1.182 0 O-C-N 120.126 -1.609 . . . . 0.0 114.973 179.246 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 40.6 p-80 -57.14 -28.17 62.51 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 121.537 2.668 . . . . 0.0 113.523 167.44 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.83 -36.38 56.9 Favored 'General case' 0 CA--C 1.522 -0.13 0 C-N-CA 123.721 0.808 . . . . 0.0 110.757 171.856 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.532 HG22 ' HD3' ' A' ' 57' ' ' LYS . 27.9 mt -72.04 -39.68 66.31 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 CA-C-O 119.321 -0.371 . . . . 0.0 110.64 179.335 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.15 -49.12 63.06 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 125.464 1.506 . . . . 0.0 111.594 -177.029 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -58.23 -45.23 88.08 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.912 0.885 . . . . 0.0 112.563 172.819 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 11.9 t60 -60.49 -45.66 92.93 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 122.184 0.992 . . . . 0.0 112.644 174.142 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.532 ' HD3' HG22 ' A' ' 53' ' ' ILE . 17.0 mtpp -55.34 -48.53 74.07 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.851 1.261 . . . . 0.0 111.283 174.027 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 60.3 mm-40 -60.15 -41.58 93.08 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 120.934 1.697 . . . . 0.0 111.244 177.867 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 41.8 t -55.88 -52.88 62.54 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.353 0.661 . . . . 0.0 111.582 178.173 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 71.4 mtm -60.32 -45.25 94.05 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.503 0.721 . . . . 0.0 111.116 172.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 25.2 mtm180 -54.67 -32.81 59.88 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 119.821 -1.799 . . . . 0.0 114.051 -178.101 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -44.63 -36.06 2.9 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.12 0.968 . . . . 0.0 113.445 169.434 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.8 mp -79.33 6.62 9.55 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 123.919 0.888 . . . . 0.0 112.644 -173.638 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 82.93 23.98 54.02 Favored Glycine 0 CA--C 1.534 1.241 0 C-N-CA 125.994 1.759 . . . . 0.0 112.399 -172.875 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -87.05 154.09 21.03 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.047 1.739 . . . . 0.0 113.052 -156.749 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.5 mmpt? -92.91 72.72 4.8 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.366 1.866 . . . . 0.0 110.543 -172.576 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 12.5 mm . . . . . 0 C--O 1.252 1.214 0 N-CA-C 114.966 1.469 . . . . 0.0 114.966 -151.781 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.2 m . . . . . 0 CA--C 1.549 0.91 0 N-CA-C 112.535 0.568 . . . . 0.0 112.535 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -67.36 -9.29 24.76 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 123.722 2.948 . . . . 0.0 112.944 -162.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 40.6 mm-40 -90.66 -48.69 6.91 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 126.589 1.956 . . . . 0.0 111.888 -178.624 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 9.1 p -65.79 -28.22 68.85 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 119.761 1.164 . . . . 0.0 111.862 163.575 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 24.3 tttt -57.94 -57.76 11.38 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.934 0.893 . . . . 0.0 110.476 169.813 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.0 mtmp? -58.73 -37.63 76.6 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.132 0.973 . . . . 0.0 112.718 176.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.86 -39.3 87.5 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 174.19 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 4.3 ttp180 -60.2 -53.05 62.37 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.388 1.075 . . . . 0.0 109.564 171.717 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -62.05 -37.91 86.74 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.46 1.504 . . . . 0.0 112.352 -177.744 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.29 -37.98 84.28 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 120.839 -1.163 . . . . 0.0 112.882 171.312 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.2 t -57.68 -36.14 71.53 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 122.298 1.047 . . . . 0.0 111.848 173.467 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 92.0 mt -70.82 -35.21 59.21 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 O-C-N 120.828 -1.17 . . . . 0.0 110.565 177.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 97.2 mt -64.59 -36.99 78.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 123.633 0.773 . . . . 0.0 112.189 169.096 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 67.2 mt-10 -65.37 -47.03 77.82 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 119.777 1.172 . . . . 0.0 113.276 177.833 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -151.99 -8.35 0.21 Allowed 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 -165.417 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 87.88 159.81 34.89 Favored Glycine 0 CA--C 1.524 0.619 0 CA-C-O 122.47 1.039 . . . . 0.0 111.799 -172.689 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.484 ' HG2' HD11 ' A' ' 53' ' ' ILE . 39.5 tt0 -66.97 -28.53 68.34 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 -165.508 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -61.45 -25.55 67.3 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 113.828 1.048 . . . . 0.0 113.828 173.041 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 80.7 m-70 -96.71 18.06 15.17 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 120.646 1.567 . . . . 0.0 110.571 -177.116 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 5.9 m -146.99 14.27 1.15 Allowed 'General case' 0 N--CA 1.442 -0.863 0 N-CA-C 115.819 1.785 . . . . 0.0 115.819 -156.045 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLY . . . . . 0.846 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -69.93 -27.44 73.09 Favored Glycine 0 N--CA 1.474 1.194 0 CA-C-N 122.12 2.236 . . . . 0.0 116.809 -174.012 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 43.4 p-80 -54.54 -26.18 30.35 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 120.811 2.305 . . . . 0.0 113.833 163.595 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.17 -35.52 36.38 Favored 'General case' 0 CA--C 1.518 -0.262 0 C-N-CA 123.476 0.711 . . . . 0.0 110.968 173.88 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.846 HD12 ' HA2' ' A' ' 50' ' ' GLY . 15.5 mt -71.69 -38.23 65.72 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 CA-C-O 119.42 -0.324 . . . . 0.0 110.697 177.341 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.412 ' HG3' ' HE3' ' A' ' 57' ' ' LYS . 1.1 mp0 -73.53 -52.35 13.85 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 125.985 1.714 . . . . 0.0 114.619 -178.951 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -56.29 -35.68 67.76 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 122.005 0.907 . . . . 0.0 112.042 174.117 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 9.5 t60 -68.71 -48.41 63.91 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 113.589 0.959 . . . . 0.0 113.589 173.029 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.412 ' HE3' ' HG3' ' A' ' 54' ' ' GLU . 2.3 mtmt -46.99 -53.07 13.21 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.543 1.137 . . . . 0.0 111.395 172.008 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -65.15 -39.79 93.48 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.154 0.981 . . . . 0.0 112.101 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 18.8 t -54.21 -50.92 66.01 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 123.592 0.757 . . . . 0.0 112.149 172.623 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 71.0 mtm -60.15 -46.83 88.33 Favored 'General case' 0 N--CA 1.48 1.032 0 O-C-N 120.819 -1.176 . . . . 0.0 111.528 169.999 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 1.5 mtt180 -61.56 -25.82 67.56 Favored 'General case' 0 CA--C 1.53 0.197 0 O-C-N 119.943 -1.723 . . . . 0.0 113.641 -175.434 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -46.88 -33.0 4.16 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 124.724 1.21 . . . . 0.0 113.362 167.778 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.9 mp -81.74 9.65 7.54 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-O 121.64 0.733 . . . . 0.0 112.598 -174.434 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 71.2 25.89 74.69 Favored Glycine 0 CA--C 1.532 1.143 0 C-N-CA 125.947 1.737 . . . . 0.0 112.179 -169.426 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -74.47 147.12 42.21 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 126.034 1.733 . . . . 0.0 112.22 -162.388 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.35 77.94 3.11 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.991 1.316 . . . . 0.0 110.619 -175.794 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.107 0 C-N-CA 128.527 2.731 . . . . 0.0 108.042 179.07 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 33.5 m . . . . . 0 CA--C 1.549 0.937 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -63.9 -29.9 67.49 Favored 'Trans proline' 0 CA--C 1.537 0.669 0 C-N-CA 122.843 2.362 . . . . 0.0 111.745 -170.401 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.487 ' HG3' ' H ' ' A' ' 33' ' ' THR . 0.3 OUTLIER -39.81 -69.76 0.12 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 127.064 2.146 . . . . 0.0 114.842 161.413 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.487 ' H ' ' HG3' ' A' ' 32' ' ' GLU . 0.0 OUTLIER -74.43 -23.74 58.97 Favored 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 124.939 1.296 . . . . 0.0 111.464 -178.842 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 4.7 tmtt? -58.31 -49.62 76.52 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 119.797 1.18 . . . . 0.0 111.207 167.347 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.1 tmtp? -62.52 -43.66 98.27 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.454 0.702 . . . . 0.0 111.309 177.355 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.44 -42.23 95.66 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 113.182 0.808 . . . . 0.0 113.182 174.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 8.1 ttp85 -59.8 -52.79 63.97 Favored 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 125.639 1.576 . . . . 0.0 110.326 174.695 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 61.8 m-20 -65.06 -32.14 73.71 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.63 0.772 . . . . 0.0 112.862 179.58 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -65.85 -36.37 83.27 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 120.781 -1.199 . . . . 0.0 113.015 170.762 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 11.3 t -59.62 -44.04 93.59 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 121.921 0.867 . . . . 0.0 111.121 168.913 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 58.4 mt -68.91 -32.5 54.87 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 C-N-CA 124.263 1.025 . . . . 0.0 110.966 -178.604 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 35.4 mt -60.82 -39.71 82.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 124.1 0.96 . . . . 0.0 112.328 167.514 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -70.26 -44.5 68.32 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 177.061 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.44 ' HG3' ' HB2' ' A' ' 48' ' ' HIS . 0.0 OUTLIER -140.37 -10.41 1.09 Allowed 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 117.133 2.271 . . . . 0.0 117.133 -165.477 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.25 175.96 49.35 Favored Glycine 0 CA--C 1.533 1.202 0 CA-C-N 119.203 0.911 . . . . 0.0 113.252 -165.757 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -83.81 -30.44 26.55 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 115.065 1.505 . . . . 0.0 115.065 -156.932 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -62.86 -32.61 73.88 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.079 0.952 . . . . 0.0 113.567 174.263 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' HIS . . . . . 0.44 ' HB2' ' HG3' ' A' ' 44' ' ' LYS . 95.1 m-70 -85.16 12.22 8.32 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.792 1.237 . . . . 0.0 112.595 -178.503 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 9.7 m -138.41 13.51 2.78 Favored 'General case' 0 N--CA 1.445 -0.701 0 C-N-CA 125.592 1.557 . . . . 0.0 114.354 -163.523 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLY . . . . . 0.406 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -62.77 -33.37 86.67 Favored Glycine 0 C--O 1.216 -1.029 0 CA-C-O 117.844 -1.531 . . . . 0.0 115.728 -176.927 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 41.1 p-80 -55.95 -29.97 60.98 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 121.095 2.447 . . . . 0.0 113.415 168.13 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.35 -33.45 42.96 Favored 'General case' 0 CA--C 1.519 -0.219 0 C-N-CA 124.428 1.091 . . . . 0.0 110.76 173.505 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.406 HD12 ' HA2' ' A' ' 50' ' ' GLY . 37.1 mt -72.51 -37.74 57.88 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.564 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 177.354 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -72.37 -53.07 13.37 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.818 1.647 . . . . 0.0 114.239 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.08 -31.95 53.36 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 118.951 0.796 . . . . 0.0 112.834 174.71 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 10.5 t60 -74.12 -51.13 16.59 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.719 1.608 . . . . 0.0 113.986 170.641 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -48.52 -54.44 14.36 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 125.346 1.459 . . . . 0.0 110.378 176.17 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -61.22 -39.03 88.77 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.526 0.73 . . . . 0.0 112.204 -177.329 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 34.5 t -53.64 -48.43 69.37 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 124.231 1.013 . . . . 0.0 113.122 169.402 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 23.8 mtp -62.87 -53.06 59.99 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 125.468 1.507 . . . . 0.0 110.389 172.465 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.409 ' HG3' ' HB ' ' A' ' 67' ' ' ILE . 22.1 mtp85 -52.52 -33.91 47.35 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 127.977 2.511 . . . . 0.0 115.21 -176.64 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -42.88 -35.07 1.08 Allowed 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.841 1.257 . . . . 0.0 114.025 167.45 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.2 mp -81.14 5.48 16.65 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.383 1.073 . . . . 0.0 112.784 -173.279 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.73 15.58 70.25 Favored Glycine 0 CA--C 1.536 1.352 0 C-N-CA 125.94 1.733 . . . . 0.0 112.797 -169.718 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -75.09 142.92 43.61 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.946 2.098 . . . . 0.0 112.353 -168.591 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.1 mppt? -92.9 82.73 4.68 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.138 1.375 . . . . 0.0 108.909 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.409 ' HB ' ' HG3' ' A' ' 61' ' ' ARG . 4.3 mm . . . . . 0 C--O 1.254 1.328 0 C-N-CA 131.11 3.764 . . . . 0.0 107.801 -165.922 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 83.6 m . . . . . 0 CA--C 1.552 1.034 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -73.59 -5.47 17.14 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 123.169 2.579 . . . . 0.0 112.694 -162.795 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -101.37 -40.51 7.07 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 125.058 1.343 . . . . 0.0 112.521 -177.187 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.3 p -60.8 -34.62 74.78 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-O 117.765 -1.112 . . . . 0.0 110.278 157.664 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 2.0 ttmt -58.21 -54.86 42.26 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 119.598 1.09 . . . . 0.0 112.244 169.111 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.76 -49.22 58.64 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.819 0.847 . . . . 0.0 112.135 176.621 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.19 -37.05 84.66 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 114.674 -1.148 . . . . 0.0 113.268 176.907 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.408 ' CG ' HG13 ' A' ' 53' ' ' ILE . 3.4 ttp180 -58.1 -56.03 27.36 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.142 1.377 . . . . 0.0 109.126 173.632 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -65.41 -37.15 86.09 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.423 1.489 . . . . 0.0 111.265 -173.828 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.25 -43.4 98.11 Favored 'General case' 0 CA--C 1.545 0.788 0 O-C-N 120.983 -1.073 . . . . 0.0 113.255 170.381 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -58.74 -34.21 71.13 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.177 -0.952 . . . . 0.0 111.232 172.983 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 81.8 mt -75.55 -35.53 32.26 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 O-C-N 120.911 -1.118 . . . . 0.0 111.642 177.22 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 70.2 mt -62.29 -34.18 62.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 124.309 1.044 . . . . 0.0 111.587 169.325 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.426 ' HB3' ' HD2' ' A' ' 44' ' ' LYS . 45.9 mt-10 -70.87 -41.57 71.22 Favored 'General case' 0 CA--C 1.555 1.159 0 N-CA-C 114.183 1.179 . . . . 0.0 114.183 177.02 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.426 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -150.58 -11.59 0.24 Allowed 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 117.586 2.439 . . . . 0.0 117.586 -170.633 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 86.13 159.96 33.29 Favored Glycine 0 CA--C 1.534 1.266 0 CA-C-N 119.224 0.92 . . . . 0.0 112.525 -161.772 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -73.2 -33.97 65.7 Favored 'General case' 0 C--N 1.337 0.065 0 O-C-N 120.741 -1.446 . . . . 0.0 113.623 -166.397 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -53.82 -36.83 62.93 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.782 0.833 . . . . 0.0 112.534 176.583 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 79.8 m-70 -87.55 12.45 12.41 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.6 1.56 . . . . 0.0 112.937 178.375 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -146.38 5.08 0.93 Allowed 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.863 1.665 . . . . 0.0 113.831 -170.312 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLY . . . . . 0.403 ' HA2' ' CD1' ' A' ' 53' ' ' ILE . . . -60.73 -14.55 37.15 Favored Glycine 0 N--CA 1.474 1.178 0 N-CA-C 118.69 2.236 . . . . 0.0 118.69 -160.216 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 30.2 p-80 -55.3 -36.27 66.01 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 121.08 2.44 . . . . 0.0 112.87 164.434 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.41 -42.24 96.18 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 125.157 1.383 . . . . 0.0 110.75 172.402 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.408 HG13 ' CG ' ' A' ' 37' ' ' ARG . 4.2 mp -72.9 -37.98 55.57 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.344 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.177 -178.427 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.475 ' HA ' ' HE3' ' A' ' 57' ' ' LYS . 3.5 mm-40 -64.85 -52.65 55.51 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 123.511 0.725 . . . . 0.0 112.557 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.76 -39.97 86.63 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.628 0.771 . . . . 0.0 112.61 177.807 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 16.1 t60 -65.81 -48.13 72.77 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 123.438 0.695 . . . . 0.0 112.576 174.856 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.475 ' HE3' ' HA ' ' A' ' 54' ' ' GLU . 1.6 mtmp? -52.56 -46.47 66.84 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-O 118.968 -0.539 . . . . 0.0 111.669 171.467 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -65.15 -37.6 87.91 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 123.895 0.878 . . . . 0.0 112.793 177.862 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 49.7 t -56.97 -52.82 63.7 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 118.795 0.725 . . . . 0.0 111.912 169.367 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 77.6 mtm -56.94 -48.93 77.15 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.32 1.048 . . . . 0.0 111.714 173.018 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.531 ' HE ' ' C ' ' A' ' 67' ' ' ILE . 11.5 mtt-85 -56.49 -30.3 62.81 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.26 1.824 . . . . 0.0 114.374 -176.474 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -46.26 -31.61 2.61 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.166 0.986 . . . . 0.0 113.284 167.518 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.2 mp -84.47 4.75 30.29 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 123.802 0.841 . . . . 0.0 112.364 -173.347 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.58 19.35 71.3 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 124.507 1.051 . . . . 0.0 112.547 -168.399 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -74.94 141.74 44.03 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 126.607 1.963 . . . . 0.0 110.601 178.197 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.5 mppt? -100.15 76.8 1.93 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 125.077 1.351 . . . . 0.0 109.593 -171.371 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.531 ' C ' ' HE ' ' A' ' 61' ' ' ARG . 0.2 OUTLIER . . . . . 0 C--O 1.248 0.99 0 CA-C-O 116.913 -1.518 . . . . 0.0 111.076 -171.28 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 3.4 m . . . . . 0 CA--C 1.545 0.774 0 CA-C-O 120.876 0.369 . . . . 0.0 110.441 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_endo -71.3 -18.17 30.34 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 122.634 2.223 . . . . 0.0 112.355 -170.268 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 36.9 mm-40 -81.57 -40.41 23.09 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.132 1.373 . . . . 0.0 112.554 -176.613 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.0 p -70.02 -30.45 67.75 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 120.879 -1.138 . . . . 0.0 111.741 161.946 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 10.1 tmtt? -58.85 -44.78 91.08 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 120.551 1.523 . . . . 0.0 112.201 170.486 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.1 mttt -52.95 -51.66 60.66 Favored 'General case' 0 C--O 1.223 -0.3 0 C-N-CA 127.52 2.328 . . . . 0.0 111.243 172.021 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.32 -37.77 80.91 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 178.942 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 6.5 ttp85 -57.95 -51.9 67.73 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.705 1.202 . . . . 0.0 109.566 174.83 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -73.25 -30.14 63.25 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.11 0.964 . . . . 0.0 113.14 -178.189 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.26 -39.27 92.35 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 120.644 -1.285 . . . . 0.0 111.946 167.103 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.8 t -60.35 -32.88 71.68 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 122.45 1.119 . . . . 0.0 112.322 172.6 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 70.4 mt -75.84 -33.83 26.55 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 124.528 1.131 . . . . 0.0 111.807 176.863 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 88.5 mt -66.34 -34.53 70.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 124.564 1.146 . . . . 0.0 111.724 168.318 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -71.18 -38.86 72.12 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 174.705 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.9 mppt? -140.87 -59.17 0.51 Allowed 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.384 1.473 . . . . 0.0 113.944 -177.027 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 137.54 160.73 8.66 Favored Glycine 0 CA--C 1.533 1.181 0 C-N-CA 126.144 1.83 . . . . 0.0 109.659 -158.019 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -73.8 -29.51 62.21 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 119.219 1.51 . . . . 0.0 112.529 -168.77 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 22.9 pt-20 -58.36 -34.02 70.21 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 123.274 0.63 . . . . 0.0 112.204 179.732 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 98.5 m-70 -82.71 5.4 21.43 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.136 1.374 . . . . 0.0 113.148 177.764 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 4.3 m -145.52 20.28 1.51 Allowed 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 125.541 1.536 . . . . 0.0 112.258 -154.873 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLY . . . . . 0.581 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -70.3 -17.0 73.81 Favored Glycine 0 C--O 1.219 -0.784 0 O-C-N 120.131 -1.606 . . . . 0.0 115.306 177.211 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 41.5 p-80 -61.17 -30.44 70.41 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 120.213 2.007 . . . . 0.0 112.35 161.196 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -80.29 -35.21 36.16 Favored 'General case' 0 C--O 1.232 0.177 0 C-N-CA 124.225 1.01 . . . . 0.0 111.073 174.637 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.655 HG22 ' HD3' ' A' ' 57' ' ' LYS . 10.4 mt -66.38 -42.47 90.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 CA-C-O 118.105 -0.95 . . . . 0.0 109.79 173.118 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.57 -53.96 49.41 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 118.526 0.603 . . . . 0.0 111.655 178.618 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.94 -39.27 68.7 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 120.952 -1.092 . . . . 0.0 113.271 179.459 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 13.5 t60 -69.49 -41.98 75.38 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 124.987 1.315 . . . . 0.0 114.253 173.901 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.655 ' HD3' HG22 ' A' ' 53' ' ' ILE . 39.5 mtpt -56.29 -52.7 63.55 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.49 1.116 . . . . 0.0 111.795 175.255 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -61.9 -39.62 92.61 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 123.093 0.557 . . . . 0.0 111.718 177.813 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 49.4 t -48.92 -59.74 3.34 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-O 118.709 -0.662 . . . . 0.0 111.503 170.28 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 74.2 mtm -56.43 -50.81 70.58 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.173 0.989 . . . . 0.0 111.763 174.663 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 74.3 mtt180 -54.04 -33.03 56.23 Favored 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 120.232 -1.542 . . . . 0.0 113.941 -174.707 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.528 ' HB3' HD12 ' A' ' 63' ' ' LEU . . . -44.19 -42.8 6.71 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.864 1.266 . . . . 0.0 113.837 166.874 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.528 HD12 ' HB3' ' A' ' 62' ' ' ALA . 1.4 mp -79.25 9.12 4.9 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.432 1.493 . . . . 0.0 111.777 -173.295 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 82.38 16.7 70.7 Favored Glycine 0 CA--C 1.532 1.135 0 C-N-CA 124.42 1.009 . . . . 0.0 113.636 -173.328 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -65.39 164.61 13.4 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 119.091 1.445 . . . . 0.0 112.385 -178.059 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.02 97.87 5.44 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 120.449 -1.407 . . . . 0.0 109.64 -177.838 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.15 0 C-N-CA 129.742 3.217 . . . . 0.0 107.735 -169.014 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 9.1 m . . . . . 0 CA--C 1.548 0.886 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -66.63 -19.62 53.87 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.792 2.328 . . . . 0.0 111.555 -165.231 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.6 mm-40 -75.12 -49.3 20.04 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 125.951 1.701 . . . . 0.0 112.369 -179.143 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.7 p -69.09 -26.21 64.81 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 118.334 -0.841 . . . . 0.0 112.034 166.887 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 10.3 tmtt? -61.51 -50.96 70.61 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 119.969 1.259 . . . . 0.0 111.405 170.433 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 25.6 ttpt -54.22 -48.2 71.31 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 127.666 2.386 . . . . 0.0 111.485 172.754 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.74 -41.49 98.03 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 176.275 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 4.1 ttp180 -58.85 -55.59 33.11 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.736 1.214 . . . . 0.0 109.385 174.344 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -61.19 -37.32 82.51 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.169 1.388 . . . . 0.0 112.858 -179.081 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.65 -35.77 79.5 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.081 -1.012 . . . . 0.0 112.89 172.942 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.9 t -59.16 -41.59 88.74 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.339 -0.85 . . . . 0.0 111.298 170.488 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 78.5 mt -70.27 -31.36 46.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 C-N-CA 124.899 1.28 . . . . 0.0 111.267 -178.959 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 60.7 mt -60.56 -44.34 96.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 CA-C-N 118.765 0.712 . . . . 0.0 111.185 165.653 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -71.3 -35.18 71.18 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 115.218 1.562 . . . . 0.0 115.218 -174.563 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.4 -10.49 0.48 Allowed 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 117.061 2.245 . . . . 0.0 117.061 -177.7 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 84.63 172.25 48.9 Favored Glycine 0 CA--C 1.531 1.087 0 CA-C-N 119.367 0.985 . . . . 0.0 112.052 -165.612 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.46 ' CG ' HD11 ' A' ' 53' ' ' ILE . 45.3 tt0 -81.75 -35.54 29.54 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 114.981 1.475 . . . . 0.0 114.981 -159.198 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -55.05 -37.25 66.47 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 174.587 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -80.36 5.84 13.77 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.2 1.4 . . . . 0.0 113.008 -179.244 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 2.3 m -137.17 18.0 2.98 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 125.846 1.658 . . . . 0.0 113.589 -164.0 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLY . . . . . 0.826 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -75.99 -14.9 81.78 Favored Glycine 0 N--CA 1.467 0.742 0 O-C-N 119.706 -1.871 . . . . 0.0 117.52 -174.977 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 40.3 p-80 -59.3 -31.31 69.02 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.844 1.822 . . . . 0.0 112.321 157.985 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.19 -37.76 52.94 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 123.449 0.7 . . . . 0.0 109.923 177.162 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.826 HD12 ' HA2' ' A' ' 50' ' ' GLY . 14.7 mt -67.44 -40.73 85.12 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.358 0 CA-C-O 119.301 -0.381 . . . . 0.0 109.974 177.259 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -65.36 -54.33 30.38 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.209 1.004 . . . . 0.0 113.409 178.681 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -57.03 -35.6 69.47 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 119.008 0.822 . . . . 0.0 112.315 179.008 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 7.6 t60 -69.97 -47.36 62.6 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 173.661 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -50.32 -52.07 39.89 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 125.193 1.397 . . . . 0.0 112.051 177.331 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -66.4 -36.86 83.9 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.117 0.567 . . . . 0.0 111.964 -177.468 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 17.5 t -52.9 -56.02 18.96 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.522 0.729 . . . . 0.0 112.866 168.559 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 7.7 mtt -53.06 -52.2 59.32 Favored 'General case' 0 N--CA 1.487 1.387 0 CA-C-N 119.888 1.222 . . . . 0.0 110.983 170.438 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 30.3 mtt180 -55.42 -31.44 61.88 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 125.774 1.63 . . . . 0.0 114.69 -174.053 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -45.84 -36.29 5.13 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.338 1.055 . . . . 0.0 113.053 169.418 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.1 mp -80.5 4.26 18.88 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.559 1.143 . . . . 0.0 112.248 -172.311 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 94.62 4.39 62.14 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 125.546 1.546 . . . . 0.0 113.446 -171.466 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.462 ' C ' ' HE3' ' A' ' 66' ' ' LYS . 1.3 m-85 -70.64 150.41 46.04 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 126.353 1.861 . . . . 0.0 113.45 -171.833 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.462 ' HE3' ' C ' ' A' ' 65' ' ' PHE . 0.0 OUTLIER -114.32 76.67 1.0 Allowed 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.661 1.584 . . . . 0.0 108.893 -163.402 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.026 0 C-N-CA 127.395 2.278 . . . . 0.0 109.504 -173.356 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 42.6 m . . . . . 0 CA--C 1.554 1.109 0 N-CA-C 113.264 0.838 . . . . 0.0 113.264 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -64.93 -29.54 57.85 Favored 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 123.583 2.855 . . . . 0.0 112.432 -162.359 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -41.34 -69.4 0.14 Allowed 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 127.206 2.202 . . . . 0.0 115.275 158.202 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.5 p -69.11 -26.84 65.11 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 121.24 -0.913 . . . . 0.0 111.992 177.106 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 6.2 tmtt? -61.54 -51.01 70.38 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 119.54 1.064 . . . . 0.0 111.61 174.665 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 12.9 ttpt -62.26 -43.86 97.86 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.862 0.865 . . . . 0.0 111.385 176.522 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.34 -39.57 91.03 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 176.17 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 11.7 ttp85 -60.84 -54.24 47.51 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.733 1.213 . . . . 0.0 110.009 175.543 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 58.0 m-20 -71.73 -26.7 62.57 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 115.229 -0.896 . . . . 0.0 112.685 -175.482 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.22 -40.13 90.1 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 120.368 -1.458 . . . . 0.0 112.606 167.803 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 2.3 t -59.01 -33.83 71.17 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 122.695 1.236 . . . . 0.0 111.819 170.702 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 70.9 mt -76.53 -34.12 23.79 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 C-N-CA 124.619 1.168 . . . . 0.0 111.855 177.349 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 66.3 mt -64.63 -34.13 67.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 124.474 1.11 . . . . 0.0 111.734 167.988 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -70.79 -37.26 73.3 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 113.966 1.099 . . . . 0.0 113.966 174.543 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.2 mppt? -142.64 -60.65 0.44 Allowed 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 125.488 1.515 . . . . 0.0 113.488 -174.824 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 136.37 160.3 8.71 Favored Glycine 0 CA--C 1.531 1.072 0 C-N-CA 126.045 1.783 . . . . 0.0 109.374 -158.999 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.483 ' HB3' HD11 ' A' ' 53' ' ' ILE . 0.4 OUTLIER -73.05 -29.53 63.04 Favored 'General case' 0 N--CA 1.466 0.325 0 O-C-N 120.786 -1.42 . . . . 0.0 112.934 -167.581 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.6 pt-20 -56.1 -31.45 63.27 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 123.2 0.6 . . . . 0.0 112.583 178.104 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -85.94 3.31 42.56 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.045 1.338 . . . . 0.0 113.188 177.865 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 4.6 m -147.08 17.84 1.22 Allowed 'General case' 0 N--CA 1.441 -0.903 0 C-N-CA 125.423 1.489 . . . . 0.0 112.881 -154.877 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLY . . . . . 0.691 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -63.63 -30.95 79.15 Favored Glycine 0 C--O 1.215 -1.05 0 O-C-N 120.217 -1.552 . . . . 0.0 114.58 179.742 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 39.3 p-80 -53.36 -25.59 15.88 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 121.292 2.546 . . . . 0.0 113.944 168.38 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.85 -35.85 32.25 Favored 'General case' 0 C--N 1.341 0.196 0 C-N-CA 123.7 0.8 . . . . 0.0 111.138 172.266 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.691 HD12 ' HA2' ' A' ' 50' ' ' GLY . 34.4 mt -72.35 -37.43 58.15 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.444 0 CA-C-O 118.757 -0.64 . . . . 0.0 110.012 178.93 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.556 ' HG3' ' HE3' ' A' ' 57' ' ' LYS . 1.4 mp0 -67.17 -52.84 36.41 Favored 'General case' 0 N--CA 1.436 -1.157 0 C-N-CA 124.835 1.254 . . . . 0.0 112.818 176.665 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.41 -37.83 57.6 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 119.161 0.891 . . . . 0.0 112.95 174.881 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -72.52 -41.53 65.79 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 114.324 1.231 . . . . 0.0 114.324 173.753 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.556 ' HE3' ' HG3' ' A' ' 54' ' ' GLU . 23.7 mtmt -55.04 -52.62 62.61 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.942 1.297 . . . . 0.0 111.161 175.706 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -64.88 -38.44 90.97 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.408 0.683 . . . . 0.0 111.65 178.786 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 36.2 t -52.07 -60.69 2.9 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 118.284 -0.865 . . . . 0.0 111.741 169.458 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 79.3 mtm -49.64 -50.16 44.22 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 124.832 1.253 . . . . 0.0 111.474 172.437 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 22.3 mtt180 -53.11 -35.8 60.04 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 120.353 1.433 . . . . 0.0 114.133 -177.333 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.415 ' HB3' HD12 ' A' ' 63' ' ' LEU . . . -48.95 -37.03 18.86 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 119.272 0.942 . . . . 0.0 113.331 170.019 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.415 HD12 ' HB3' ' A' ' 62' ' ' ALA . 4.9 mp -82.87 8.74 11.62 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 125.154 1.381 . . . . 0.0 112.051 -172.825 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.53 22.55 43.19 Favored Glycine 0 CA--C 1.535 1.311 0 C-N-CA 124.931 1.253 . . . . 0.0 114.025 -179.058 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.501 ' C ' ' HE3' ' A' ' 66' ' ' LYS . 0.8 OUTLIER -84.49 153.67 23.19 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.494 1.518 . . . . 0.0 114.75 -163.265 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.501 ' HE3' ' C ' ' A' ' 65' ' ' PHE . 0.1 OUTLIER -94.97 81.34 3.71 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 126.441 1.897 . . . . 0.0 107.906 -174.32 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 29.4 mm . . . . . 0 C--O 1.245 0.862 0 C-N-CA 128.85 2.86 . . . . 0.0 108.896 -165.011 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 13.7 m . . . . . 0 CA--C 1.55 0.965 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -68.7 -17.64 42.51 Favored 'Trans proline' 0 CA--C 1.536 0.577 0 C-N-CA 123.13 2.554 . . . . 0.0 113.176 -161.395 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -88.17 -41.09 13.22 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.93 1.292 . . . . 0.0 112.493 -174.85 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.7 p -64.01 -33.22 75.26 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 120.89 -1.131 . . . . 0.0 110.833 158.905 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 5.1 tmtt? -59.04 -47.89 83.59 Favored 'General case' 0 N--CA 1.478 0.962 0 CA-C-N 120.727 1.603 . . . . 0.0 111.691 173.284 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 26.9 mttt -54.29 -49.97 68.4 Favored 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 126.022 1.729 . . . . 0.0 111.772 173.27 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.83 -35.05 76.5 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.452 0.701 . . . . 0.0 112.756 179.89 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 3.1 ttp180 -57.96 -55.5 34.15 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 124.728 1.211 . . . . 0.0 109.914 172.848 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -62.46 -39.45 93.42 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.444 1.098 . . . . 0.0 111.98 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.1 -41.8 97.33 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 113.207 0.818 . . . . 0.0 113.207 172.031 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.9 t -59.38 -36.16 75.26 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 122.496 1.141 . . . . 0.0 111.584 174.088 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 68.6 mt -73.09 -29.53 28.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 O-C-N 120.657 -1.277 . . . . 0.0 111.279 177.793 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 96.8 mt -69.29 -36.36 72.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.435 1.094 . . . . 0.0 112.005 168.251 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -67.49 -42.1 83.46 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 124.507 1.123 . . . . 0.0 113.716 178.29 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.85 -17.42 0.31 Allowed 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 116.923 2.194 . . . . 0.0 116.923 -171.504 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 95.74 164.65 34.26 Favored Glycine 0 CA--C 1.535 1.318 0 C-N-CA 123.933 0.778 . . . . 0.0 112.815 -167.685 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -69.23 -39.67 78.41 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 -165.287 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -55.73 -34.44 65.16 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.513 1.525 . . . . 0.0 113.769 175.729 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 78.0 m-70 -91.13 15.11 12.37 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.823 1.249 . . . . 0.0 112.306 -176.471 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 1.2 m -143.2 1.22 1.22 Allowed 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 115.73 1.752 . . . . 0.0 115.73 -166.034 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -51.46 -27.35 17.29 Favored Glycine 0 N--CA 1.473 1.11 0 CA-C-O 115.979 -2.567 . . . . 0.0 118.068 -163.921 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 34.3 p-80 -51.77 -35.12 42.52 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 121.798 2.799 . . . . 0.0 113.255 170.143 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.59 -40.48 76.65 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 125.722 1.609 . . . . 0.0 112.056 171.283 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.473 HG22 ' HD3' ' A' ' 57' ' ' LYS . 3.3 mp -70.74 -36.32 64.37 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 C-N-CA 120.488 -0.485 . . . . 0.0 110.497 178.914 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -73.53 -51.19 17.87 Favored 'General case' 0 N--CA 1.444 -0.759 0 C-N-CA 126.741 2.016 . . . . 0.0 112.32 -174.936 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -56.89 -37.93 72.08 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 121.453 0.644 . . . . 0.0 112.294 172.628 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 20.9 t60 -69.02 -49.87 53.81 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 113.113 0.782 . . . . 0.0 113.113 175.244 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.473 ' HD3' HG22 ' A' ' 53' ' ' ILE . 13.7 mtpp -46.43 -49.94 17.46 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 125.736 1.614 . . . . 0.0 111.378 170.745 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 60.4 mm-40 -58.29 -48.32 80.83 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 119.433 1.015 . . . . 0.0 112.357 174.935 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 24.5 t -55.33 -47.84 75.07 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 123.558 0.743 . . . . 0.0 112.682 178.679 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 12.4 mtp -62.54 -49.68 74.37 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.535 1.134 . . . . 0.0 110.532 169.828 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 18.1 mtp180 -56.3 -30.6 62.73 Favored 'General case' 0 C--N 1.34 0.164 0 O-C-N 119.601 -1.937 . . . . 0.0 114.139 -175.64 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -42.31 -35.43 0.99 Allowed 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.319 1.447 . . . . 0.0 113.9 168.354 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.0 mp -79.52 3.69 17.97 Favored 'General case' 0 CA--C 1.548 0.894 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 -171.92 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.95 20.82 38.12 Favored Glycine 0 CA--C 1.536 1.346 0 C-N-CA 125.598 1.57 . . . . 0.0 112.381 -168.208 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.442 ' C ' ' HE3' ' A' ' 66' ' ' LYS . 0.0 OUTLIER -94.85 158.93 15.27 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 126.482 1.913 . . . . 0.0 112.815 -161.368 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.442 ' HE3' ' C ' ' A' ' 65' ' ' PHE . 0.1 OUTLIER -116.0 106.52 13.87 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 125.925 1.69 . . . . 0.0 107.477 -174.41 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.407 HG22 ' HG2' ' A' ' 57' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--O 1.246 0.889 0 C-N-CA 125.198 1.399 . . . . 0.0 111.046 -170.126 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 33.5 m . . . . . 0 CA--C 1.546 0.816 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -69.16 -18.67 39.71 Favored 'Trans proline' 0 N--CA 1.459 -0.526 0 C-N-CA 122.38 2.054 . . . . 0.0 111.499 -161.462 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -76.46 -47.7 22.12 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.821 1.248 . . . . 0.0 111.726 -179.515 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.7 p -65.82 -31.62 72.69 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 117.841 -1.076 . . . . 0.0 111.612 165.704 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.2 tmtp? -58.76 -50.83 72.49 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 120.509 1.504 . . . . 0.0 112.112 171.548 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 23.6 ttpt -54.72 -47.42 73.77 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 126.898 2.079 . . . . 0.0 112.12 175.025 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.77 -39.02 90.6 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 114.398 -1.274 . . . . 0.0 113.591 174.986 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 14.4 ttp85 -60.73 -53.29 59.21 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.625 1.57 . . . . 0.0 110.124 177.293 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -74.76 -30.65 61.55 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 115.364 -0.834 . . . . 0.0 111.836 -175.64 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.89 -39.38 81.25 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 120.531 -1.356 . . . . 0.0 112.698 165.413 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.9 t -59.41 -37.89 79.19 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.744 0.818 . . . . 0.0 111.825 175.083 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 72.3 mt -71.35 -35.52 57.77 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 C-N-CA 124.946 1.298 . . . . 0.0 111.145 176.517 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 86.0 mt -67.04 -31.54 53.84 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 C-N-CA 124.451 1.1 . . . . 0.0 112.127 171.09 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -78.84 -35.62 43.72 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.285 1.434 . . . . 0.0 114.486 178.107 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.2 mppt? -134.62 -59.8 0.8 Allowed 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 125.078 1.351 . . . . 0.0 112.788 176.941 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 139.08 173.94 13.26 Favored Glycine 0 CA--C 1.531 1.091 0 C-N-CA 126.09 1.805 . . . . 0.0 110.281 -160.952 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -78.94 -32.54 45.53 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 114.601 1.334 . . . . 0.0 114.601 -162.582 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -58.73 -34.7 71.65 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.834 1.254 . . . . 0.0 113.742 173.952 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -81.08 6.9 12.26 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.183 0.993 . . . . 0.0 112.942 -176.652 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 21.7 m -145.57 13.25 1.36 Allowed 'General case' 0 N--CA 1.437 -1.093 0 C-N-CA 124.053 0.941 . . . . 0.0 113.413 -154.088 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' GLY . . . . . 0.455 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -67.88 -29.48 73.68 Favored Glycine 0 N--CA 1.469 0.864 0 O-C-N 119.791 -1.818 . . . . 0.0 115.605 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 29.6 p-80 -56.82 -30.58 63.88 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 120.208 2.004 . . . . 0.0 112.582 165.645 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.06 -34.96 59.6 Favored 'General case' 0 CA--C 1.522 -0.119 0 C-N-CA 124.054 0.942 . . . . 0.0 109.698 174.661 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.455 HD12 ' HA2' ' A' ' 50' ' ' GLY . 44.4 mt -72.99 -27.44 24.63 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 N-CA-C 110.554 -0.165 . . . . 0.0 110.554 177.567 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 67.3 mt-10 -89.1 -47.16 8.29 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 -169.158 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.42 -37.89 57.75 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-O 121.737 0.78 . . . . 0.0 112.124 165.208 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 14.1 t60 -68.43 -46.36 70.09 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 173.833 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 19.8 mtmt -51.75 -52.74 46.46 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.906 1.283 . . . . 0.0 110.918 177.047 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -61.47 -41.59 97.48 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.023 0.529 . . . . 0.0 112.333 178.71 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 23.7 t -54.59 -50.39 68.13 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 123.438 0.695 . . . . 0.0 112.83 173.636 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -58.03 -53.4 58.69 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 125.535 1.534 . . . . 0.0 110.34 170.259 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 74.6 mtt180 -55.32 -31.42 61.66 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 126.579 1.952 . . . . 0.0 114.39 -175.046 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -45.78 -34.74 3.86 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.791 1.237 . . . . 0.0 113.497 169.158 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.9 mp -81.22 3.8 22.54 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.733 1.213 . . . . 0.0 112.244 -173.669 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.94 11.81 67.14 Favored Glycine 0 CA--C 1.535 1.305 0 C-N-CA 125.22 1.39 . . . . 0.0 113.286 -169.796 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.405 ' C ' ' HE3' ' A' ' 66' ' ' LYS . 0.9 OUTLIER -70.16 151.51 45.33 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 126.317 1.847 . . . . 0.0 113.506 -176.659 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.405 ' HE3' ' C ' ' A' ' 65' ' ' PHE . 0.0 OUTLIER -111.39 93.66 4.58 Favored 'General case' 0 C--N 1.341 0.198 0 C-N-CA 126.366 1.866 . . . . 0.0 109.502 -170.488 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.247 0.923 0 C-N-CA 127.471 2.308 . . . . 0.0 109.602 -173.266 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 54.6 m . . . . . 0 CA--C 1.553 1.087 0 N-CA-C 113.704 1.001 . . . . 0.0 113.704 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -66.2 -31.9 43.7 Favored 'Trans proline' 0 CA--C 1.537 0.634 0 C-N-CA 123.696 2.931 . . . . 0.0 112.649 -168.549 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -39.98 -69.59 0.13 Allowed 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.598 1.959 . . . . 0.0 114.633 158.094 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.1 p -66.86 -28.55 68.43 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-O 117.636 -1.173 . . . . 0.0 111.935 176.184 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 12.1 tmtt? -57.25 -47.82 80.4 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 120.738 1.608 . . . . 0.0 112.163 176.001 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.5 mttp -83.86 -26.26 29.61 Favored 'General case' 0 CA--C 1.516 -0.34 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 -179.327 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.29 -41.46 97.0 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 123.343 0.402 . . . . 0.0 111.923 163.545 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 7.5 ttp85 -57.93 -53.53 57.18 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 125.505 1.522 . . . . 0.0 109.981 173.803 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 82.7 m-20 -69.32 -30.18 68.18 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 115.042 -0.981 . . . . 0.0 113.496 -175.093 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.53 -45.63 92.08 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 120.351 1.432 . . . . 0.0 111.96 168.495 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.3 t -55.75 -34.11 64.9 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.058 0.943 . . . . 0.0 111.296 171.656 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 69.2 mt -77.3 -35.89 23.15 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 O-C-N 120.404 -1.435 . . . . 0.0 112.068 178.743 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 87.5 mt -59.92 -36.5 67.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 124.315 1.046 . . . . 0.0 111.385 167.793 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -70.35 -45.74 65.52 Favored 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 124.352 1.061 . . . . 0.0 113.718 178.473 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.58 -13.81 0.67 Allowed 'General case' 0 N--CA 1.483 1.224 0 N-CA-C 116.936 2.198 . . . . 0.0 116.936 -169.689 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 89.39 165.95 41.48 Favored Glycine 0 CA--C 1.536 1.395 0 C-N-CA 124.893 1.235 . . . . 0.0 112.476 -163.064 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.4 -34.66 63.34 Favored 'General case' 0 N--CA 1.466 0.326 0 O-C-N 120.553 -1.557 . . . . 0.0 113.259 -168.727 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -55.94 -35.21 66.39 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 123.118 0.567 . . . . 0.0 112.414 -179.629 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 84.5 m-70 -86.3 9.47 17.72 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.732 1.613 . . . . 0.0 112.961 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 1.3 m -143.0 9.19 1.7 Allowed 'General case' 0 N--CA 1.443 -0.825 0 C-N-CA 124.95 1.3 . . . . 0.0 113.895 -166.71 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -55.26 -22.21 28.95 Favored Glycine 0 C--O 1.215 -1.054 0 CA-C-O 117.041 -1.977 . . . . 0.0 117.656 -169.974 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 33.4 p-80 -54.46 -36.71 64.38 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 121.952 2.876 . . . . 0.0 113.145 167.207 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -70.73 -37.33 73.49 Favored 'General case' 0 N--CA 1.462 0.127 0 C-N-CA 125.332 1.453 . . . . 0.0 111.627 172.319 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.718 HG22 ' HD3' ' A' ' 57' ' ' LYS . 2.6 mp -71.12 -38.23 70.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 CA-C-N 118.912 0.778 . . . . 0.0 110.427 177.121 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.65 -53.66 21.12 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 125.393 1.477 . . . . 0.0 111.787 -173.992 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -57.88 -36.24 72.1 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-O 121.799 0.809 . . . . 0.0 112.755 175.7 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 15.4 t60 -68.48 -47.44 67.07 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.865 0.866 . . . . 0.0 112.775 175.028 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.718 ' HD3' HG22 ' A' ' 53' ' ' ILE . 31.1 mtpt -51.46 -49.14 62.34 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.53 1.132 . . . . 0.0 111.58 172.067 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -61.57 -46.5 89.62 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 124.215 1.006 . . . . 0.0 112.491 175.361 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 42.4 t -51.58 -52.65 45.61 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.073 0.949 . . . . 0.0 112.08 175.347 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 76.2 mtm -57.89 -48.93 78.41 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.913 0.885 . . . . 0.0 111.457 170.5 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.2 mtt-85 -58.47 -29.17 65.99 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 120.518 1.508 . . . . 0.0 114.205 -171.419 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -45.94 -35.22 4.47 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.22 1.008 . . . . 0.0 113.61 167.685 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.6 mp -81.95 6.65 15.31 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.221 1.008 . . . . 0.0 112.945 -170.552 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.07 27.07 42.01 Favored Glycine 0 CA--C 1.533 1.207 0 C-N-CA 124.722 1.153 . . . . 0.0 112.29 -169.084 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -89.35 167.59 12.91 Favored 'General case' 0 N--CA 1.461 0.109 0 CA-C-O 123.694 1.711 . . . . 0.0 113.426 -171.623 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 16.0 ptpt -128.96 44.35 2.99 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 113.468 -1.696 . . . . 0.0 112.725 -136.04 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.917 0 C-N-CA 130.413 3.485 . . . . 0.0 109.593 -163.216 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 43.5 m . . . . . 0 CA--C 1.549 0.927 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -74.83 -22.41 15.25 Favored 'Trans proline' 0 CA--C 1.54 0.785 0 C-N-CA 122.778 2.318 . . . . 0.0 112.446 -171.65 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -66.41 -52.86 42.18 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.209 1.404 . . . . 0.0 112.767 174.8 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.1 p -65.4 -30.33 71.13 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 120.967 -1.083 . . . . 0.0 111.375 170.025 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 8.2 tmtt? -57.66 -49.02 77.87 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 120.378 1.445 . . . . 0.0 112.426 169.716 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 48.1 tttt -54.5 -50.58 67.48 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 125.922 1.689 . . . . 0.0 111.159 174.374 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.97 -42.05 97.37 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 114.853 -1.067 . . . . 0.0 112.962 179.727 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 9.1 ttp85 -60.12 -51.97 67.33 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 125.102 1.361 . . . . 0.0 110.371 177.269 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 25.0 m-20 -72.31 -29.99 64.36 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 115.771 -0.65 . . . . 0.0 112.553 -175.514 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.91 -37.0 85.77 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 120.821 -1.175 . . . . 0.0 113.131 167.124 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.8 t -60.39 -39.76 88.49 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 121.053 -1.029 . . . . 0.0 111.651 168.939 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 73.7 mt -72.02 -29.95 34.82 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 O-C-N 121.001 -1.062 . . . . 0.0 111.468 -177.753 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 60.1 mt -58.01 -43.05 84.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 123.38 0.672 . . . . 0.0 111.489 163.591 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.9 -41.97 97.57 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.069 1.137 . . . . 0.0 114.069 -178.207 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -153.48 -9.34 0.16 Allowed 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 116.992 2.219 . . . . 0.0 116.992 -166.487 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 83.58 159.57 28.55 Favored Glycine 0 CA--C 1.53 1.017 0 CA-C-N 119.179 0.9 . . . . 0.0 112.895 -164.811 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.521 ' HB3' HD11 ' A' ' 53' ' ' ILE . 0.5 OUTLIER -67.53 -28.72 68.05 Favored 'General case' 0 N--CA 1.463 0.181 0 O-C-N 121.147 -1.207 . . . . 0.0 112.728 -169.564 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.438 ' HG3' ' CD2' ' A' ' 48' ' ' HIS . 10.4 pt-20 -58.41 -24.42 59.99 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.911 0.885 . . . . 0.0 113.258 177.018 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' HIS . . . . . 0.438 ' CD2' ' HG3' ' A' ' 47' ' ' GLU . 96.8 m-70 -104.21 11.97 34.33 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 120.345 1.429 . . . . 0.0 111.117 178.137 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 1.7 m -139.67 18.09 2.52 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 126.768 2.027 . . . . 0.0 113.051 -162.803 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' GLY . . . . . 0.47 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -63.81 -29.69 75.52 Favored Glycine 0 C--O 1.216 -1.001 0 CA-C-O 116.622 -2.21 . . . . 0.0 114.883 -175.728 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 41.0 p-80 -56.42 -24.75 47.26 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 120.358 2.079 . . . . 0.0 113.632 168.943 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -82.72 -33.63 27.47 Favored 'General case' 0 C--N 1.341 0.203 0 O-C-N 121.515 -0.74 . . . . 0.0 110.78 171.948 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.53 HG22 ' HD3' ' A' ' 57' ' ' LYS . 51.5 mt -75.11 -35.22 33.94 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-O 119.196 -0.43 . . . . 0.0 110.628 -179.18 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -67.84 -55.49 12.76 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 127.119 2.168 . . . . 0.0 110.94 -177.301 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.74 -40.76 72.96 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 173.138 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 13.6 t60 -66.3 -46.48 76.8 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 120.992 -1.067 . . . . 0.0 113.089 175.38 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.53 ' HD3' HG22 ' A' ' 53' ' ' ILE . 21.4 mtpp -54.06 -49.0 69.99 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.146 0.978 . . . . 0.0 111.269 172.658 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -61.74 -43.39 98.95 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 118.155 -0.926 . . . . 0.0 112.435 175.322 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 42.8 t -50.74 -58.2 6.47 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 119.016 0.825 . . . . 0.0 111.11 173.002 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 75.6 mtm -55.93 -45.89 78.62 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.203 0.601 . . . . 0.0 110.486 174.967 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 8.8 mtt-85 -58.91 -29.25 66.92 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 120.77 1.623 . . . . 0.0 115.232 -177.035 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -50.25 -31.32 13.79 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 118.9 0.773 . . . . 0.0 112.668 169.638 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.9 mp -85.21 26.74 0.85 Allowed 'General case' 0 CA--C 1.546 0.81 0 CA-C-O 122.732 1.253 . . . . 0.0 112.327 -172.195 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 68.09 30.1 73.75 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 127.156 2.312 . . . . 0.0 113.034 -174.714 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -102.35 170.35 8.12 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-O 124.03 1.871 . . . . 0.0 115.959 -148.578 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 13.0 ptpt -119.81 69.53 0.84 Allowed 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 124.1 1.905 . . . . 0.0 111.625 -152.273 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 17.8 mm . . . . . 0 C--O 1.254 1.313 0 CA-C-N 108.472 -3.967 . . . . 0.0 112.16 -147.72 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 64.9 m . . . . . 0 CA--C 1.55 0.962 0 N-CA-C 113.928 1.085 . . . . 0.0 113.928 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -63.68 -29.08 69.16 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 123.873 3.049 . . . . 0.0 112.63 -168.036 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -39.37 -72.19 0.07 Allowed 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.688 2.395 . . . . 0.0 115.753 156.299 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -68.72 -24.77 64.51 Favored 'General case' 0 N--CA 1.475 0.815 0 O-C-N 121.029 -1.044 . . . . 0.0 112.169 176.222 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 8.8 tmtt? -60.37 -43.74 96.28 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 120.419 1.463 . . . . 0.0 111.124 172.991 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 62.5 tttt -58.84 -49.74 76.58 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.858 1.263 . . . . 0.0 111.677 173.169 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.56 -37.17 86.29 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.332 -0.849 . . . . 0.0 112.739 178.131 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 6.6 ttp85 -59.35 -56.48 21.56 Favored 'General case' 0 C--O 1.223 -0.299 0 C-N-CA 125.619 1.568 . . . . 0.0 109.842 175.15 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -69.61 -27.4 65.05 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 115.315 -0.857 . . . . 0.0 112.572 -176.4 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.35 -44.31 91.85 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 120.768 -1.207 . . . . 0.0 112.971 166.356 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -57.76 -31.7 66.75 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 122.454 1.121 . . . . 0.0 111.57 171.964 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 72.3 mt -77.27 -34.33 21.07 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 O-C-N 120.524 -1.36 . . . . 0.0 111.726 177.259 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 70.2 mt -61.92 -34.72 64.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.2 1.0 . . . . 0.0 111.659 167.193 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -70.13 -43.03 71.79 Favored 'General case' 0 CA--C 1.556 1.181 0 N-CA-C 114.12 1.155 . . . . 0.0 114.12 177.104 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.87 -11.71 0.28 Allowed 'General case' 0 N--CA 1.485 1.297 0 N-CA-C 117.828 2.529 . . . . 0.0 117.828 -171.049 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 90.03 162.34 38.25 Favored Glycine 0 CA--C 1.536 1.36 0 CA-C-N 119.612 1.096 . . . . 0.0 112.663 -163.561 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.43 -34.99 68.22 Favored 'General case' 0 N--CA 1.465 0.3 0 O-C-N 120.707 -1.467 . . . . 0.0 113.422 -168.687 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -56.15 -34.9 66.56 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.765 0.826 . . . . 0.0 112.612 178.923 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 79.5 m-70 -90.21 12.15 18.93 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.698 1.599 . . . . 0.0 112.686 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -145.72 11.67 1.27 Allowed 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 124.954 1.302 . . . . 0.0 114.11 -169.286 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -53.73 -26.18 31.64 Favored Glycine 0 N--CA 1.472 1.038 0 CA-C-O 116.354 -2.359 . . . . 0.0 116.879 -169.995 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 37.1 p-80 -52.56 -33.67 46.79 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 120.997 2.399 . . . . 0.0 113.143 170.147 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -74.16 -38.5 63.69 Favored 'General case' 0 CA--C 1.522 -0.114 0 C-N-CA 125.117 1.367 . . . . 0.0 112.364 171.521 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 2.8 mp -67.91 -34.53 67.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 119.964 -0.695 . . . . 0.0 110.906 175.676 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -74.38 -53.63 9.23 Favored 'General case' 0 N--CA 1.44 -0.957 0 C-N-CA 125.28 1.432 . . . . 0.0 111.557 -176.211 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.23 -38.39 65.68 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.541 -0.724 . . . . 0.0 112.383 175.843 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 17.1 t60 -67.25 -49.81 62.97 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.593 1.157 . . . . 0.0 113.504 173.694 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -48.19 -49.78 31.51 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.632 1.573 . . . . 0.0 112.405 177.326 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -69.36 -39.81 77.86 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.366 0.666 . . . . 0.0 112.053 -176.214 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 48.8 t -50.13 -51.58 42.15 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 123.528 0.731 . . . . 0.0 112.493 167.314 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 36.0 mtp -57.95 -51.79 68.2 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.118 1.367 . . . . 0.0 110.787 172.782 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 45.9 mtt180 -54.9 -29.84 56.92 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 126.097 1.759 . . . . 0.0 114.392 -177.829 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -48.06 -22.06 0.56 Allowed 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 114.793 1.405 . . . . 0.0 114.793 168.071 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.8 mp -95.85 1.89 53.37 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.662 1.585 . . . . 0.0 112.186 -173.836 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 86.76 15.04 64.08 Favored Glycine 0 CA--C 1.535 1.33 0 C-N-CA 124.744 1.164 . . . . 0.0 113.07 -169.746 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -71.73 141.06 49.79 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 126.576 1.95 . . . . 0.0 111.524 -179.167 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -101.2 93.71 5.59 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.332 1.453 . . . . 0.0 108.344 -178.31 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.126 0 C-N-CA 127.544 2.338 . . . . 0.0 109.313 -177.683 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 21.3 m . . . . . 0 CA--C 1.549 0.92 0 N-CA-C 114.227 1.195 . . . . 0.0 114.227 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -66.9 -11.47 32.27 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 123.149 2.566 . . . . 0.0 112.695 -166.24 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 38.0 mm-40 -88.02 -41.56 13.02 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.468 1.507 . . . . 0.0 112.44 -177.465 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -64.0 -35.31 80.28 Favored 'General case' 0 N--CA 1.48 1.049 0 O-C-N 120.635 -1.291 . . . . 0.0 110.674 158.297 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.432 ' HE2' ' OD2' ' A' ' 38' ' ' ASP . 17.3 tttt -59.82 -42.6 93.88 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 119.484 1.038 . . . . 0.0 112.656 175.475 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.4 mttt -55.43 -50.01 70.93 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 125.513 1.525 . . . . 0.0 110.552 176.432 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.46 -34.34 76.97 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.83 0.852 . . . . 0.0 113.018 174.645 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.408 ' CG ' HG13 ' A' ' 53' ' ' ILE . 4.3 ttp180 -59.48 -54.89 41.42 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.892 1.277 . . . . 0.0 109.943 176.568 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.432 ' OD2' ' HE2' ' A' ' 34' ' ' LYS . 84.2 m-20 -74.46 -28.69 61.14 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.526 1.13 . . . . 0.0 111.596 -175.4 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.01 -39.95 94.01 Favored 'General case' 0 CA--C 1.547 0.834 0 O-C-N 120.637 -1.289 . . . . 0.0 113.356 163.885 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.6 t -59.64 -34.07 72.33 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.007 -1.058 . . . . 0.0 111.435 173.467 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 91.4 mt -71.85 -35.14 53.71 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 O-C-N 120.62 -1.3 . . . . 0.0 111.183 176.172 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 87.6 mt -63.79 -35.45 73.14 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 124.05 0.94 . . . . 0.0 111.985 169.503 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -69.95 -43.62 71.2 Favored 'General case' 0 CA--C 1.556 1.21 0 N-CA-C 114.053 1.131 . . . . 0.0 114.053 177.611 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.51 -15.26 0.38 Allowed 'General case' 0 N--CA 1.485 1.31 0 N-CA-C 116.874 2.176 . . . . 0.0 116.874 -170.147 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 92.55 164.31 38.05 Favored Glycine 0 CA--C 1.536 1.36 0 CA-C-O 122.153 0.863 . . . . 0.0 113.148 -165.907 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -68.89 -41.99 77.56 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 -164.658 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -55.7 -34.83 65.44 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.771 1.228 . . . . 0.0 113.804 175.993 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 68.8 m-70 -87.64 12.23 13.13 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.561 1.145 . . . . 0.0 112.342 -176.592 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 1.2 m -141.41 2.59 1.66 Allowed 'General case' 0 N--CA 1.438 -1.064 0 C-N-CA 124.739 1.216 . . . . 0.0 114.163 -167.315 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -54.23 -21.16 17.94 Favored Glycine 0 N--CA 1.474 1.181 0 N-CA-C 118.136 2.014 . . . . 0.0 118.136 -167.427 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 30.1 p-80 -55.32 -36.79 66.6 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 121.72 2.76 . . . . 0.0 113.41 166.5 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.2 -41.6 85.54 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 125.377 1.471 . . . . 0.0 111.072 170.699 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.697 HG22 ' HD3' ' A' ' 57' ' ' LYS . 2.8 mp -70.04 -39.44 77.29 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 CA-C-N 118.73 0.695 . . . . 0.0 109.708 -178.683 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.08 -51.73 50.75 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 125.461 1.504 . . . . 0.0 112.62 -177.985 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.55 -38.58 84.95 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.479 0.657 . . . . 0.0 112.413 176.588 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 21.0 t60 -65.31 -48.29 73.59 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.648 0.779 . . . . 0.0 112.759 173.638 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.697 ' HD3' HG22 ' A' ' 53' ' ' ILE . 35.2 mtpt -52.11 -47.69 65.17 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.607 1.163 . . . . 0.0 112.617 171.833 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -57.74 -44.77 86.26 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.461 1.028 . . . . 0.0 112.375 172.863 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 38.1 t -56.09 -50.07 72.06 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 118.681 0.673 . . . . 0.0 112.299 175.868 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 71.8 mtm -59.06 -50.92 72.24 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 121.291 -0.88 . . . . 0.0 111.013 171.358 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 15.9 mtt180 -55.82 -30.89 62.12 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 126.068 1.747 . . . . 0.0 113.743 -174.929 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -44.66 -34.84 2.35 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.702 1.201 . . . . 0.0 113.749 168.304 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.1 mp -81.26 8.86 7.99 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 123.992 0.917 . . . . 0.0 112.744 -173.177 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 75.87 22.06 75.22 Favored Glycine 0 CA--C 1.533 1.194 0 C-N-CA 125.54 1.543 . . . . 0.0 112.408 -167.885 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.47 ' HB3' HG13 ' A' ' 67' ' ' ILE . 0.1 OUTLIER -78.06 129.25 35.0 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 126.354 1.862 . . . . 0.0 110.974 -172.427 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.4 mppt? -82.6 78.92 9.16 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.476 1.51 . . . . 0.0 109.391 -178.089 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.47 HG13 ' HB3' ' A' ' 65' ' ' PHE . 0.4 OUTLIER . . . . . 0 C--O 1.247 0.934 0 C-N-CA 125.898 1.679 . . . . 0.0 109.731 -176.041 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.414 0 N-CA-C 107.573 -2.211 . . . . 0.0 107.573 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.2 m 52.37 -157.78 0.14 Allowed 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 118.932 1.366 . . . . 0.0 110.622 -153.324 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -51.04 132.72 27.71 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 119.714 1.143 . . . . 0.0 111.002 170.714 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 4.5 m -146.17 148.25 32.36 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.108 0.963 . . . . 0.0 109.3 -174.164 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 29.7 tpp -126.18 73.63 72.13 Favored Pre-proline 0 N--CA 1.471 0.583 0 C-N-CA 124.497 1.119 . . . . 0.0 110.744 176.28 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_endo -72.57 27.18 0.28 Allowed 'Trans proline' 0 CA--C 1.549 1.26 0 C-N-CA 124.273 3.315 . . . . 0.0 114.414 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -114.8 -64.75 0.41 Allowed Glycine 0 CA--C 1.531 1.091 0 CA-C-N 118.906 0.775 . . . . 0.0 113.618 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.3 mm? 53.75 -174.38 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.876 1.27 . . . . 0.0 113.513 -169.303 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 14.3 p -159.02 117.77 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 C-N-CA 125.369 1.468 . . . . 0.0 109.839 174.488 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -155.82 176.03 13.16 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 126.831 2.052 . . . . 0.0 111.081 -173.212 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 57.7 m -80.42 161.76 24.78 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.925 0.89 . . . . 0.0 112.935 176.27 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 21.0 p-10 -129.96 74.43 80.58 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 126.472 1.909 . . . . 0.0 110.742 -173.678 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_endo -81.57 -174.15 2.07 Favored 'Trans proline' 0 CA--C 1.543 0.943 0 C-N-CA 124.419 3.413 . . . . 0.0 113.04 -173.604 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -147.49 154.6 45.2 Favored Pre-proline 0 CA--C 1.549 0.937 0 C-N-CA 125.096 1.359 . . . . 0.0 112.112 174.346 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -64.1 162.49 29.37 Favored 'Trans proline' 0 CA--C 1.554 1.48 0 C-N-CA 124.538 3.492 . . . . 0.0 117.79 -171.216 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -88.21 -170.3 0.52 Allowed 'Trans proline' 0 CA--C 1.546 1.107 1 C-N-CA 126.161 4.574 . . . . 0.0 115.607 -177.152 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -46.75 105.88 0.07 Allowed 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.128 0.971 . . . . 0.0 112.064 157.083 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 35.7 m -173.77 103.76 0.12 Allowed 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 126.403 1.881 . . . . 0.0 113.24 163.166 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.32 39.62 0.83 Allowed 'General case' 0 CA--C 1.545 0.771 0 CA-C-O 122.149 0.976 . . . . 0.0 108.613 148.3 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -156.64 -162.85 1.32 Allowed 'General case' 0 CA--C 1.54 0.562 0 O-C-N 120.607 -1.308 . . . . 0.0 111.891 -146.164 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 7.3 mmtt -140.25 -0.88 1.58 Allowed 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 118.557 2.799 . . . . 0.0 118.557 -174.314 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.7 mtpm? -51.37 163.52 0.56 Allowed Pre-proline 0 N--CA 1.474 0.742 0 C-N-CA 128.462 2.705 . . . . 0.0 114.51 170.703 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -76.23 177.69 8.46 Favored 'Trans proline' 0 N--CA 1.453 -0.892 0 C-N-CA 122.258 1.972 . . . . 0.0 110.993 166.319 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.558 HD23 ' H ' ' A' ' 25' ' ' LYS . 0.5 OUTLIER -132.94 165.17 25.31 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 114.715 -1.13 . . . . 0.0 111.369 174.658 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.558 ' H ' HD23 ' A' ' 24' ' ' LEU . 0.6 OUTLIER -114.88 138.3 23.29 Favored Pre-proline 0 N--CA 1.47 0.565 0 C-N-CA 127.451 2.301 . . . . 0.0 107.223 -172.318 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo -79.16 -14.5 13.35 Favored 'Trans proline' 0 CA--C 1.548 1.211 0 C-N-CA 122.774 2.316 . . . . 0.0 112.449 -171.184 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.425 ' HA ' ' HE3' ' A' ' 34' ' ' LYS . 20.1 p -74.76 -21.6 59.25 Favored 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 126.42 1.888 . . . . 0.0 112.713 165.581 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 50.0 m -115.18 -31.16 6.1 Favored 'General case' 0 CA--C 1.554 1.113 0 N-CA-C 116.069 1.877 . . . . 0.0 116.069 -172.004 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.88 160.52 23.15 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.057 -1.027 . . . . 0.0 110.55 -178.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 38.7 m 42.4 50.37 5.2 Favored Pre-proline 0 CA--C 1.553 1.085 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 -178.064 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.6 -24.67 30.16 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.429 2.752 . . . . 0.0 112.309 -158.331 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -63.07 -48.3 79.25 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.458 1.903 . . . . 0.0 113.789 169.219 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.48 -34.27 74.1 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 119.483 1.038 . . . . 0.0 111.732 168.707 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.425 ' HE3' ' HA ' ' A' ' 27' ' ' CYS . 7.0 tmtt? -58.8 -45.49 89.79 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.895 1.278 . . . . 0.0 112.211 173.484 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 72.6 tttt -55.51 -51.22 67.73 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 126.427 1.891 . . . . 0.0 111.422 172.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.05 -37.97 89.36 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 114.796 -1.093 . . . . 0.0 112.641 178.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 10.2 ttp85 -59.94 -57.25 13.66 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.767 1.227 . . . . 0.0 110.178 174.351 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 62.0 m-20 -69.18 -29.74 67.79 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.163 0.985 . . . . 0.0 112.67 -175.513 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.61 -41.41 96.22 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 120.542 -1.349 . . . . 0.0 112.35 168.139 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.8 t -57.67 -34.53 69.49 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 122.21 1.005 . . . . 0.0 111.76 172.464 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 64.3 mt -77.11 -33.76 20.75 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 C-N-CA 125.182 1.393 . . . . 0.0 112.257 178.429 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 74.0 mt -64.99 -34.97 74.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 124.052 0.941 . . . . 0.0 111.395 168.365 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -72.92 -36.03 67.17 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 114.54 1.311 . . . . 0.0 114.54 177.299 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -139.24 -58.64 0.59 Allowed 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 125.078 1.351 . . . . 0.0 113.788 175.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 139.79 161.93 8.91 Favored Glycine 0 CA--C 1.53 1.003 0 C-N-CA 126.278 1.894 . . . . 0.0 109.558 -159.535 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.489 ' HB3' HD11 ' A' ' 53' ' ' ILE . 0.3 OUTLIER -73.45 -28.49 61.99 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 120.993 -1.298 . . . . 0.0 112.928 -169.102 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -55.98 -33.67 65.03 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 123.501 0.72 . . . . 0.0 112.444 177.324 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -85.81 5.82 30.89 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.989 1.316 . . . . 0.0 113.067 178.269 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 6.1 m -148.22 16.05 1.04 Allowed 'General case' 0 N--CA 1.441 -0.887 0 C-N-CA 125.307 1.443 . . . . 0.0 113.094 -154.631 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLY . . . . . 0.689 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -65.84 -27.83 73.1 Favored Glycine 0 C--O 1.213 -1.173 0 O-C-N 120.19 -1.568 . . . . 0.0 114.658 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 41.6 p-80 -56.54 -25.18 51.19 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 120.666 2.233 . . . . 0.0 113.933 166.045 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.85 -34.57 30.06 Favored 'General case' 0 C--O 1.231 0.113 0 C-N-CA 123.837 0.855 . . . . 0.0 110.664 172.551 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.689 HD12 ' HA2' ' A' ' 50' ' ' GLY . 33.2 mt -70.43 -40.38 77.49 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.598 0 CA-C-O 118.72 -0.657 . . . . 0.0 109.711 177.454 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.54 -50.74 49.66 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 125.004 1.322 . . . . 0.0 111.912 -175.647 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.99 -37.47 66.6 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 121.152 -0.968 . . . . 0.0 113.006 173.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 14.5 t60 -72.45 -44.26 62.61 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.508 1.123 . . . . 0.0 113.901 174.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.86 -54.75 25.53 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.769 1.628 . . . . 0.0 110.956 175.838 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.431 ' HA ' ' HB2' ' A' ' 61' ' ' ARG . 11.2 mm-40 -72.18 -33.85 67.98 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 122.773 0.429 . . . . 0.0 111.692 -174.041 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 48.8 t -48.51 -60.45 2.68 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-O 118.505 -0.76 . . . . 0.0 112.3 162.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 78.3 mtm -52.66 -45.61 66.83 Favored 'General case' 0 N--CA 1.486 1.331 0 CA-C-N 120.027 1.285 . . . . 0.0 111.388 171.74 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.431 ' HB2' ' HA ' ' A' ' 58' ' ' GLU . 2.4 ttt85 -51.91 -39.03 58.42 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 114.378 1.251 . . . . 0.0 114.378 -175.17 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.446 ' HB3' HD12 ' A' ' 63' ' ' LEU . . . -47.33 -36.24 9.16 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.619 1.167 . . . . 0.0 113.25 172.848 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.446 HD12 ' HB3' ' A' ' 62' ' ' ALA . 5.7 mp -82.65 9.57 9.26 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 125.209 1.404 . . . . 0.0 111.658 -172.705 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.53 40.82 5.59 Favored Glycine 0 CA--C 1.532 1.138 0 C-N-CA 125.046 1.307 . . . . 0.0 113.274 177.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -112.28 143.65 43.01 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 121.507 -0.996 . . . . 0.0 112.273 -151.009 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? -92.54 79.87 4.86 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 125.8 1.64 . . . . 0.0 108.805 -173.306 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.427 ' OXT' HG22 ' A' ' 67' ' ' ILE . 39.2 mm . . . . . 0 CA--C 1.552 1.039 0 C-N-CA 128.81 2.844 . . . . 0.0 110.604 -161.487 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.26 0 N-CA-C 107.886 -2.085 . . . . 0.0 107.886 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.6 m -148.96 162.45 39.86 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 118.154 0.977 . . . . 0.0 110.875 -163.4 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 22.4 t80 -148.77 171.38 16.34 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.126 0.97 . . . . 0.0 110.458 169.704 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 15.3 m 64.95 -31.36 0.13 Allowed 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 127.411 2.284 . . . . 0.0 116.099 179.751 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.412 ' HB3' HD22 ' A' ' 8' ' ' LEU . 4.0 mpp? 38.02 54.42 3.95 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 127.398 2.279 . . . . 0.0 114.879 179.576 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -74.39 29.73 0.34 Allowed 'Trans proline' 0 CA--C 1.549 1.264 0 C-N-CA 124.153 3.235 . . . . 0.0 114.134 -176.826 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 171.08 -34.46 0.16 Allowed Glycine 0 CA--C 1.531 1.081 0 O-C-N 120.928 -1.107 . . . . 0.0 114.584 174.42 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.412 HD22 ' HB3' ' A' ' 5' ' ' MET 0.259 0.9 OUTLIER 38.05 32.12 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 118.513 2.783 . . . . 0.0 118.513 172.497 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 97.8 t -40.96 133.23 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 126.172 1.789 . . . . 0.0 111.0 163.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . 0.284 1.1 m-20 43.85 25.95 0.12 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 127.885 2.474 . . . . 0.0 116.777 -178.673 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 28.2 t -53.83 -32.65 53.64 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.635 1.174 . . . . 0.0 112.789 160.906 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -164.41 68.92 1.51 Allowed Pre-proline 0 CA--C 1.556 1.174 0 C-N-CA 125.13 1.372 . . . . 0.0 112.137 -172.64 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -77.44 -177.97 4.24 Favored 'Trans proline' 0 CA--C 1.542 0.916 0 C-N-CA 124.503 3.469 . . . . 0.0 111.89 178.191 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -140.65 159.38 63.02 Favored Pre-proline 0 CA--C 1.545 0.776 0 C-N-CA 124.937 1.295 . . . . 0.0 112.679 -174.79 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -69.1 157.69 60.71 Favored 'Trans proline' 0 CA--C 1.546 1.107 0 C-N-CA 123.002 2.468 . . . . 0.0 112.972 171.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -77.23 177.83 8.39 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 123.672 2.915 . . . . 0.0 112.799 171.37 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.0 tp10 -84.0 152.47 24.42 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 122.134 0.969 . . . . 0.0 111.86 168.359 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 21.9 m -177.18 -38.15 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 129.986 3.314 . . . . 0.0 109.479 159.387 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 51.07 159.44 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 131.24 3.816 . . . . 0.0 117.785 170.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.17 -175.18 0.2 Allowed 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 123.933 1.825 . . . . 0.0 111.458 158.5 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 34.8 mmtm -137.85 74.05 1.46 Allowed 'General case' 0 N--CA 1.438 -1.065 0 C-N-CA 128.591 2.757 . . . . 0.0 106.851 -171.098 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 31.3 mmtm -149.04 164.78 19.71 Favored Pre-proline 0 N--CA 1.475 0.793 0 C-N-CA 126.3 1.84 . . . . 0.0 113.21 -158.38 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -70.45 175.37 8.76 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 121.513 1.475 . . . . 0.0 111.747 166.204 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.537 HD23 ' H ' ' A' ' 25' ' ' LYS . 0.6 OUTLIER -139.42 160.12 40.57 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.941 0.897 . . . . 0.0 112.325 178.223 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.537 ' H ' HD23 ' A' ' 24' ' ' LEU . 0.3 OUTLIER -108.07 142.72 25.88 Favored Pre-proline 0 C--O 1.224 -0.276 0 C-N-CA 126.424 1.89 . . . . 0.0 107.314 -175.572 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_endo -77.87 -11.07 16.77 Favored 'Trans proline' 0 CA--C 1.55 1.306 0 C-N-CA 122.227 1.951 . . . . 0.0 112.413 -172.776 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 29.5 p -90.53 -18.0 26.05 Favored 'General case' 0 CA--C 1.556 1.199 0 C-N-CA 125.992 1.717 . . . . 0.0 112.047 171.355 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 76.3 m -105.82 -31.54 8.79 Favored 'General case' 0 CA--C 1.556 1.191 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 177.505 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.11 162.68 21.78 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.997 1.319 . . . . 0.0 110.173 178.3 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 28.5 m 38.77 50.97 2.82 Favored Pre-proline 0 CA--C 1.55 0.949 0 C-N-CA 124.02 0.928 . . . . 0.0 112.926 178.614 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.12 -17.2 36.06 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.521 2.148 . . . . 0.0 112.47 -156.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -82.87 -38.78 22.47 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.575 1.55 . . . . 0.0 112.019 -178.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.2 p -71.06 -31.43 67.84 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 121.055 -1.028 . . . . 0.0 111.51 161.752 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 10.3 tmtt? -59.15 -47.54 84.9 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 120.096 1.316 . . . . 0.0 111.785 172.118 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 44.2 mttt -52.81 -51.94 58.88 Favored 'General case' 0 C--O 1.225 -0.217 0 C-N-CA 126.901 2.08 . . . . 0.0 111.823 171.179 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.08 -37.17 83.51 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -179.739 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 13.1 ttp85 -59.45 -55.33 36.06 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 124.709 1.203 . . . . 0.0 109.865 174.604 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -72.4 -29.41 63.71 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 115.414 -0.812 . . . . 0.0 112.41 -174.576 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.88 -44.65 96.38 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 120.795 -1.19 . . . . 0.0 112.039 165.738 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.0 t -55.96 -34.61 65.85 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 122.275 1.036 . . . . 0.0 111.678 173.717 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 66.6 mt -76.42 -32.46 21.73 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 125.274 1.43 . . . . 0.0 112.613 178.736 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 83.4 mt -66.59 -38.33 81.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 123.878 0.871 . . . . 0.0 110.868 167.273 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -72.03 -38.82 69.48 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 114.49 1.292 . . . . 0.0 114.49 -179.376 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.7 mppt? -137.77 -33.84 0.7 Allowed 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 115.993 1.849 . . . . 0.0 115.993 -177.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 101.79 156.7 26.44 Favored Glycine 0 CA--C 1.532 1.149 0 C-N-CA 124.605 1.098 . . . . 0.0 111.738 -157.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.499 ' HB3' HD11 ' A' ' 53' ' ' ILE . 0.5 OUTLIER -69.96 -27.68 64.93 Favored 'General case' 0 N--CA 1.466 0.367 0 O-C-N 121.148 -1.207 . . . . 0.0 113.059 -166.837 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -56.12 -27.59 54.54 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 123.725 0.81 . . . . 0.0 112.843 176.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -96.3 8.72 43.21 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.368 1.067 . . . . 0.0 112.847 177.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 3.7 m -146.83 17.58 1.26 Allowed 'General case' 0 N--CA 1.443 -0.811 0 C-N-CA 125.547 1.539 . . . . 0.0 112.407 -155.405 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLY . . . . . 0.741 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -68.77 -25.72 74.99 Favored Glycine 0 C--O 1.217 -0.935 0 CA-C-O 116.918 -2.046 . . . . 0.0 114.905 -177.629 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 38.9 p-80 -56.07 -28.52 57.91 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 120.016 1.908 . . . . 0.0 112.978 165.224 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.42 -34.8 35.9 Favored 'General case' 0 C--N 1.34 0.172 0 C-N-CA 123.856 0.862 . . . . 0.0 110.459 175.016 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.741 HD12 ' HA2' ' A' ' 50' ' ' GLY . 36.1 mt -69.76 -40.75 79.5 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.663 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 176.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -64.52 -52.43 57.82 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 125.625 1.57 . . . . 0.0 111.173 179.123 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.25 -40.04 58.0 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 113.453 0.909 . . . . 0.0 113.453 174.342 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 11.2 t60 -71.19 -42.79 68.57 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 114.193 1.182 . . . . 0.0 114.193 173.357 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.32 -52.5 65.11 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.737 1.215 . . . . 0.0 111.978 177.147 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -69.54 -33.94 73.5 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 123.145 0.578 . . . . 0.0 111.318 -176.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 48.7 t -49.35 -60.97 2.36 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-O 118.62 -0.705 . . . . 0.0 111.795 161.807 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 78.9 mtm -54.13 -45.14 71.86 Favored 'General case' 0 N--CA 1.483 1.217 0 CA-C-N 120.03 1.286 . . . . 0.0 112.712 175.533 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 47.8 mtt180 -52.18 -35.31 48.65 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 121.028 1.74 . . . . 0.0 113.976 -179.234 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.558 ' HB3' HD12 ' A' ' 63' ' ' LEU . . . -47.74 -40.12 19.61 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 113.908 1.077 . . . . 0.0 113.908 168.495 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.558 HD12 ' HB3' ' A' ' 62' ' ' ALA . 4.0 mp -82.75 10.2 8.13 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 126.458 1.903 . . . . 0.0 112.029 -172.686 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.84 30.83 13.73 Favored Glycine 0 CA--C 1.535 1.333 0 C-N-CA 124.732 1.158 . . . . 0.0 114.348 176.385 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.432 ' C ' ' HE3' ' A' ' 66' ' ' LYS . 0.3 OUTLIER -100.14 152.36 20.35 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.793 1.237 . . . . 0.0 114.105 -154.3 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.432 ' HE3' ' C ' ' A' ' 65' ' ' PHE . 0.4 OUTLIER -92.39 75.96 5.2 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 125.866 1.666 . . . . 0.0 108.955 -174.905 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 28.5 mm . . . . . 0 C--O 1.249 1.059 0 C-N-CA 127.798 2.439 . . . . 0.0 111.113 -158.321 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.28 0 N-CA-C 108.778 -1.729 . . . . 0.0 108.778 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.2 t -148.02 179.3 7.84 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 125.793 1.637 . . . . 0.0 108.034 165.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 43.7 m-85 -133.2 147.63 52.02 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.235 1.014 . . . . 0.0 110.595 -169.471 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 3.0 m -148.35 -40.11 0.17 Allowed 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.262 0.625 . . . . 0.0 112.673 -176.429 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 1.3 mpt? 31.13 51.71 0.55 Allowed Pre-proline 0 CA--C 1.555 1.166 0 C-N-CA 128.318 2.647 . . . . 0.0 116.96 170.439 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -69.99 13.07 0.32 Allowed 'Trans proline' 0 CA--C 1.548 1.185 0 C-N-CA 124.895 3.73 . . . . 0.0 116.195 -167.614 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -175.83 21.08 0.05 OUTLIER Glycine 0 CA--C 1.536 1.344 0 C-N-CA 127.287 2.375 . . . . 0.0 112.803 176.407 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -158.37 34.23 0.24 Allowed 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 -168.086 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 78.1 t -43.07 131.21 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 125.819 1.647 . . . . 0.0 112.328 172.071 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -59.44 66.31 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 129.872 3.269 . . . . 0.0 115.898 -170.828 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.8 t -147.92 126.81 12.71 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 120.125 -1.609 . . . . 0.0 111.587 178.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -146.64 59.54 5.27 Favored Pre-proline 0 CA--C 1.55 0.973 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 178.727 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -71.34 168.83 22.34 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 123.745 2.963 . . . . 0.0 110.386 164.847 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -156.55 157.47 30.97 Favored Pre-proline 0 CA--C 1.546 0.795 0 C-N-CA 124.643 1.177 . . . . 0.0 111.48 172.702 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -72.79 170.75 18.84 Favored 'Trans proline' 0 CA--C 1.547 1.135 0 C-N-CA 123.143 2.562 . . . . 0.0 110.733 158.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -69.44 173.35 10.82 Favored 'Trans proline' 0 CA--C 1.538 0.685 0 C-N-CA 121.961 1.774 . . . . 0.0 111.518 163.044 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.501 ' H ' ' CD ' ' A' ' 17' ' ' GLU . 2.8 mp0 -52.06 -41.14 62.1 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 126.923 2.089 . . . . 0.0 113.31 -168.046 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.4 m 54.54 28.68 10.1 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 126.298 1.839 . . . . 0.0 114.29 173.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -124.39 24.51 7.96 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 114.861 1.43 . . . . 0.0 114.861 -160.297 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -55.71 150.28 12.89 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-O 123.818 1.771 . . . . 0.0 111.082 172.771 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 45.49 31.13 0.85 Allowed 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 128.11 2.564 . . . . 0.0 114.856 -171.764 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -124.2 158.93 59.22 Favored Pre-proline 0 N--CA 1.48 1.046 0 C-N-CA 126.477 1.911 . . . . 0.0 110.968 171.52 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -76.96 161.63 32.81 Favored 'Trans proline' 0 CA--C 1.535 0.571 0 C-N-CA 122.76 2.307 . . . . 0.0 112.331 166.6 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.548 ' CD1' ' H ' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -75.31 175.18 8.61 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-O 122.433 1.111 . . . . 0.0 112.487 170.06 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.548 ' H ' ' CD1' ' A' ' 24' ' ' LEU . 13.5 pttp -154.09 139.23 11.83 Favored Pre-proline 0 N--CA 1.468 0.46 0 C-N-CA 128.725 2.81 . . . . 0.0 107.503 -175.618 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_endo -76.74 -8.84 18.24 Favored 'Trans proline' 0 CA--C 1.544 0.983 0 C-N-CA 124.024 3.149 . . . . 0.0 113.601 -160.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 9.0 p -73.77 -22.2 59.92 Favored 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 127.247 2.219 . . . . 0.0 112.433 166.029 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.46 ' SG ' ' NZ ' ' A' ' 25' ' ' LYS . 69.7 m -113.31 -28.06 7.73 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 116.041 1.867 . . . . 0.0 116.041 -172.268 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.429 ' HB3' ' SD ' ' A' ' 60' ' ' MET . . . -61.32 158.44 14.39 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-N 118.99 0.813 . . . . 0.0 111.916 -173.203 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 56.9 m 40.22 59.3 7.35 Favored Pre-proline 0 CA--C 1.544 0.743 0 C-N-CA 124.862 1.265 . . . . 0.0 113.82 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_endo -69.19 -22.67 34.37 Favored 'Trans proline' 0 CA--C 1.534 0.509 0 C-N-CA 123.425 2.75 . . . . 0.0 112.552 -157.754 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -63.1 -62.45 1.69 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.967 2.107 . . . . 0.0 112.812 171.332 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.8 p -61.12 -30.83 70.61 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 118.187 -0.911 . . . . 0.0 111.694 170.592 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 8.1 tmtt? -59.09 -49.68 76.95 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 120.052 1.296 . . . . 0.0 111.659 171.891 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 16.1 tttp -63.26 -43.06 99.04 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.783 0.833 . . . . 0.0 111.436 176.767 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.19 -39.37 92.5 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.49 0.716 . . . . 0.0 112.86 176.082 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 8.2 ttp85 -58.26 -54.62 44.98 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.551 1.54 . . . . 0.0 109.405 173.637 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 78.5 m-20 -68.78 -33.56 74.09 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.039 0.936 . . . . 0.0 113.442 -176.556 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.4 -37.32 82.92 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 120.588 -1.32 . . . . 0.0 112.854 171.142 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.1 t -57.19 -38.54 73.82 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.723 0.773 . . . . 0.0 111.225 168.461 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 67.0 mt -75.43 -30.17 22.01 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 C-N-CA 124.95 1.3 . . . . 0.0 112.27 -176.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 67.2 mt -58.18 -45.38 88.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 CA-C-N 119.028 0.831 . . . . 0.0 110.377 163.743 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.67 -37.35 79.53 Favored 'General case' 0 CA--C 1.552 1.05 0 N-CA-C 115.024 1.491 . . . . 0.0 115.024 -174.284 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.87 -8.63 0.41 Allowed 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 117.57 2.433 . . . . 0.0 117.57 -176.555 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 82.96 165.62 37.88 Favored Glycine 0 CA--C 1.536 1.358 0 CA-C-N 119.773 1.17 . . . . 0.0 112.531 -164.335 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -76.69 -30.92 56.91 Favored 'General case' 0 CA--C 1.516 -0.349 0 O-C-N 120.311 -1.699 . . . . 0.0 114.401 -164.735 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -58.94 -35.87 73.83 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 123.229 0.33 . . . . 0.0 111.462 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 -82.83 4.42 25.51 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.967 1.707 . . . . 0.0 112.986 177.212 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.407 ' HA ' ' CE1' ' A' ' 51' ' ' HIS . 1.8 m -139.3 18.0 2.58 Favored 'General case' 0 N--CA 1.442 -0.86 0 C-N-CA 127.794 2.438 . . . . 0.0 112.154 -168.125 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLY . . . . . 0.712 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -69.93 -19.38 75.26 Favored Glycine 0 C--O 1.221 -0.658 0 O-C-N 119.751 -1.843 . . . . 0.0 115.56 -176.251 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' HIS . . . . . 0.407 ' CE1' ' HA ' ' A' ' 49' ' ' CYS . 38.4 p-80 -58.24 -34.65 70.68 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 120.18 1.99 . . . . 0.0 112.352 162.883 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.65 -32.87 60.38 Favored 'General case' 0 CA--C 1.52 -0.201 0 C-N-CA 125.326 1.45 . . . . 0.0 110.774 174.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.712 HD12 ' HA2' ' A' ' 50' ' ' GLY . 5.1 mt -66.72 -39.28 83.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 118.843 -1.143 . . . . 0.0 110.748 167.641 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -74.63 -47.98 28.96 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 -170.352 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.79 -39.99 72.05 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 121.597 0.713 . . . . 0.0 112.138 170.374 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 18.5 t60 -65.36 -48.96 71.12 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.73 0.812 . . . . 0.0 112.913 174.597 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 52.7 mttm -48.13 -47.18 34.84 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 124.885 1.274 . . . . 0.0 112.168 177.651 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -75.79 -25.95 56.87 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 117.844 -1.074 . . . . 0.0 113.045 -177.286 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 37.6 t -58.55 -58.31 9.12 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-O 118.376 -0.821 . . . . 0.0 111.545 160.523 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.429 ' SD ' ' HB3' ' A' ' 29' ' ' ALA . 9.3 mmm -47.15 -45.23 22.52 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-N 120.341 1.428 . . . . 0.0 111.36 174.351 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 1.9 mtt85 -63.07 -32.42 73.79 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 117.028 -1.463 . . . . 0.0 114.134 -171.147 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -50.48 -36.83 35.44 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 118.985 0.811 . . . . 0.0 112.613 170.212 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 4.9 mp -82.52 8.04 12.81 Favored 'General case' 0 CA--C 1.554 1.098 0 C-N-CA 125.817 1.647 . . . . 0.0 112.003 -173.018 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.75 41.21 5.42 Favored Glycine 0 CA--C 1.534 1.266 0 C-N-CA 124.864 1.221 . . . . 0.0 114.788 171.153 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -119.75 145.83 46.2 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 120.725 -1.456 . . . . 0.0 114.031 -142.868 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -91.64 89.56 7.19 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.429 1.892 . . . . 0.0 109.158 -176.198 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 23.9 mm . . . . . 0 C--O 1.25 1.114 0 C-N-CA 126.707 2.003 . . . . 0.0 111.848 -158.143 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.475 0 N-CA-C 109.279 -1.528 . . . . 0.0 109.279 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 77.8 p -160.84 178.73 9.13 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.258 1.423 . . . . 0.0 110.014 -176.012 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -62.31 161.29 11.68 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-O 121.052 0.453 . . . . 0.0 111.463 160.475 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 5.7 m -160.37 159.26 30.92 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 126.381 1.872 . . . . 0.0 108.327 171.02 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 8.3 ttt -130.9 72.88 81.62 Favored Pre-proline 0 CA--C 1.542 0.655 0 C-N-CA 124.188 0.995 . . . . 0.0 109.837 172.036 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -73.15 4.14 4.02 Favored 'Trans proline' 0 CA--C 1.543 0.952 0 C-N-CA 123.76 2.974 . . . . 0.0 115.104 -172.308 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -160.16 137.64 5.14 Favored Glycine 0 CA--C 1.527 0.797 0 C-N-CA 124.4 1.0 . . . . 0.0 110.62 173.64 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -170.7 144.28 2.29 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 127.269 2.227 . . . . 0.0 109.741 -176.574 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 23.2 t 60.86 156.16 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 O-C-N 125.739 1.9 . . . . 0.0 112.587 -165.614 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -137.52 -18.38 1.26 Allowed 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 115.525 1.676 . . . . 0.0 115.525 -165.513 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 97.2 p -160.87 172.28 17.26 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 -156.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 34.4 p-10 -139.51 60.25 16.09 Favored Pre-proline 0 CA--C 1.553 1.085 0 C-N-CA 126.425 1.89 . . . . 0.0 111.439 177.394 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.08 102.24 1.05 Allowed 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 123.834 3.023 . . . . 0.0 114.246 -160.711 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.95 153.17 56.35 Favored Pre-proline 0 CA--C 1.55 0.961 0 CA-C-N 113.743 -1.571 . . . . 0.0 114.334 -177.54 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -62.38 -177.82 0.32 Allowed 'Trans proline' 0 CA--C 1.549 1.263 0 C-N-CA 125.265 3.977 . . . . 0.0 113.581 172.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -73.43 -179.66 4.66 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 122.447 2.098 . . . . 0.0 111.595 158.598 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.4 ' CD ' ' H ' ' A' ' 19' ' ' GLN . 0.0 OUTLIER -73.98 168.48 19.4 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.032 1.333 . . . . 0.0 111.866 164.557 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 79.4 p -163.72 15.99 0.06 Allowed 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 116.946 2.202 . . . . 0.0 116.946 -176.314 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.4 ' H ' ' CD ' ' A' ' 17' ' ' GLU . 11.2 mm100 -108.67 -10.26 15.2 Favored 'General case' 0 N--CA 1.446 -0.644 0 O-C-N 119.008 -2.308 . . . . 0.0 113.86 -171.213 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -86.31 166.56 15.53 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 125.03 2.348 . . . . 0.0 114.049 163.725 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.19 76.83 1.6 Allowed 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 129.101 2.961 . . . . 0.0 108.682 -174.046 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.11 161.92 59.86 Favored Pre-proline 0 N--CA 1.473 0.699 0 C-N-CA 129.471 3.108 . . . . 0.0 108.126 177.296 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -68.8 144.11 58.06 Favored 'Trans proline' 0 N--CA 1.455 -0.774 0 C-N-CA 120.874 1.05 . . . . 0.0 110.894 164.762 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.57 ' CD1' ' H ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -77.24 162.29 27.47 Favored 'General case' 0 CA--C 1.552 1.024 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.23 163.355 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.57 ' H ' ' CD1' ' A' ' 24' ' ' LEU . 11.0 ptmm? -135.37 128.67 18.37 Favored Pre-proline 0 N--CA 1.466 0.336 0 C-N-CA 129.762 3.225 . . . . 0.0 106.156 -177.363 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_endo -68.27 -19.22 44.4 Favored 'Trans proline' 0 CA--C 1.542 0.909 0 C-N-CA 123.419 2.746 . . . . 0.0 114.207 -155.531 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 29.9 p -68.49 -21.46 64.6 Favored 'General case' 0 CA--C 1.559 1.315 0 C-N-CA 125.852 1.661 . . . . 0.0 113.132 171.119 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 83.2 m -105.97 -17.52 14.32 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 126.214 1.806 . . . . 0.0 114.645 -176.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.32 157.22 34.49 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.54 -0.725 . . . . 0.0 112.441 -167.692 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.6 m 40.91 58.03 8.4 Favored Pre-proline 0 CA--C 1.549 0.919 0 N-CA-C 114.21 1.189 . . . . 0.0 114.21 176.342 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -65.3 -24.35 58.08 Favored 'Trans proline' 0 CA--C 1.538 0.701 0 C-N-CA 122.483 2.122 . . . . 0.0 112.328 -160.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -58.37 -52.01 67.39 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 127.065 2.146 . . . . 0.0 111.843 177.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.9 p -76.5 -38.26 55.5 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.289 1.436 . . . . 0.0 111.565 170.247 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 6.4 tmtt? -52.73 -46.87 67.62 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 120.102 1.319 . . . . 0.0 112.057 179.048 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.5 tmmm? -51.97 -55.0 23.09 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 126.959 2.104 . . . . 0.0 112.183 171.094 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.5 -35.02 79.23 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 114.393 -1.276 . . . . 0.0 112.634 -177.004 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 7.5 ttp85 -62.6 -54.98 31.51 Favored 'General case' 0 C--O 1.222 -0.368 0 C-N-CA 125.766 1.626 . . . . 0.0 109.444 174.614 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -71.45 -28.16 63.77 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -175.843 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.86 -41.22 87.68 Favored 'General case' 0 CA--C 1.544 0.75 0 O-C-N 120.549 -1.344 . . . . 0.0 112.965 167.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 6.2 t -55.5 -37.39 67.8 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 122.271 1.034 . . . . 0.0 111.044 169.694 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 73.5 mt -75.39 -31.27 23.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 O-C-N 121.052 -1.03 . . . . 0.0 111.949 -179.374 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 86.0 mt -64.11 -35.76 74.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 CA-C-N 118.825 0.738 . . . . 0.0 111.641 166.796 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 27.2 mt-10 -75.03 -36.66 61.87 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 178.336 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.411 ' HG3' ' HB2' ' A' ' 48' ' ' HIS . 0.0 OUTLIER -148.68 -11.13 0.34 Allowed 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 118.083 2.623 . . . . 0.0 118.083 -173.666 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 86.78 166.7 42.82 Favored Glycine 0 CA--C 1.539 1.55 0 CA-C-N 120.035 1.289 . . . . 0.0 112.908 -163.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -76.44 -30.53 57.41 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 120.351 -1.676 . . . . 0.0 113.58 -168.388 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -58.25 -33.34 69.26 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 123.155 0.582 . . . . 0.0 112.258 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' HIS . . . . . 0.411 ' HB2' ' HG3' ' A' ' 44' ' ' LYS . 93.9 m-70 -88.58 10.9 18.82 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.715 1.606 . . . . 0.0 112.591 178.767 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 2.7 m -141.2 14.91 2.23 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 126.294 1.838 . . . . 0.0 113.85 -162.788 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -60.29 -32.73 77.78 Favored Glycine 0 C--O 1.213 -1.189 0 O-C-N 120.152 -1.593 . . . . 0.0 115.264 -176.713 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 41.8 p-80 -55.37 -25.55 36.01 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 121.963 2.881 . . . . 0.0 114.439 169.375 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -79.89 -36.56 36.35 Favored 'General case' 0 C--N 1.339 0.119 0 C-N-CA 123.948 0.899 . . . . 0.0 111.379 170.066 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 42.6 mt -75.89 -33.52 25.64 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.391 0 CA-C-O 119.092 -0.48 . . . . 0.0 110.184 -177.673 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.519 ' HG3' ' HE3' ' A' ' 57' ' ' LYS . 1.5 mp0 -70.24 -53.23 17.88 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 125.48 1.512 . . . . 0.0 112.781 177.382 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -53.37 -35.11 59.94 Favored 'General case' 0 CA--C 1.545 0.752 0 O-C-N 121.267 -0.895 . . . . 0.0 113.028 173.384 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 19.2 t60 -73.9 -43.18 59.27 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.535 1.134 . . . . 0.0 113.931 174.513 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.519 ' HE3' ' HG3' ' A' ' 54' ' ' GLU . 26.3 mtmt -53.16 -52.21 59.51 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 125.275 1.43 . . . . 0.0 111.339 175.302 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -66.56 -37.58 85.27 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 122.99 0.516 . . . . 0.0 111.586 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 18.6 t -52.57 -59.64 4.21 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-O 117.805 -1.093 . . . . 0.0 112.162 167.603 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 92.9 mtp -47.6 -51.6 20.63 Favored 'General case' 0 N--CA 1.488 1.464 0 CA-C-N 120.69 1.586 . . . . 0.0 110.821 171.833 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 37.5 mtt180 -54.91 -34.8 63.47 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 125.453 1.501 . . . . 0.0 114.0 -177.421 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -48.45 -39.09 21.61 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 119.203 0.91 . . . . 0.0 113.192 169.389 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.6 mp -81.0 8.86 7.47 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 124.84 1.256 . . . . 0.0 111.746 -173.704 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 86.65 18.81 57.82 Favored Glycine 0 CA--C 1.535 1.334 0 C-N-CA 125.278 1.418 . . . . 0.0 114.404 -178.363 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -72.59 170.67 13.95 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.538 1.535 . . . . 0.0 114.846 -166.039 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.31 88.93 3.01 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 125.103 1.361 . . . . 0.0 108.369 -177.158 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 26.0 mm . . . . . 0 C--O 1.244 0.765 0 C-N-CA 130.69 3.596 . . . . 0.0 107.458 -162.392 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.574 0 N-CA-C 109.313 -1.515 . . . . 0.0 109.313 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.9 m -64.57 -10.13 24.02 Favored 'General case' 0 N--CA 1.479 0.984 0 N-CA-C 117.784 2.512 . . . . 0.0 117.784 -162.767 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 8.7 t80 42.35 34.29 0.5 Allowed 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 126.951 2.1 . . . . 0.0 115.42 176.523 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.2 m -90.99 141.0 29.31 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 120.833 -1.167 . . . . 0.0 111.16 -167.75 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 8.0 tpt -122.21 76.2 42.01 Favored Pre-proline 0 CA--C 1.542 0.656 0 C-N-CA 124.397 1.079 . . . . 0.0 110.536 175.352 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -73.58 6.83 2.55 Favored 'Trans proline' 0 CA--C 1.543 0.956 0 C-N-CA 123.541 2.828 . . . . 0.0 114.349 177.91 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -79.62 34.25 2.07 Favored Glycine 0 CA--C 1.533 1.183 0 O-C-N 120.852 -1.155 . . . . 0.0 114.407 -176.419 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.7 mp -114.15 113.52 24.8 Favored 'General case' 0 C--O 1.224 -0.281 0 C-N-CA 125.919 1.688 . . . . 0.0 109.041 -171.863 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 63.0 t 50.66 95.31 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 126.455 1.902 . . . . 0.0 114.195 177.648 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -59.95 109.09 0.87 Allowed 'General case' 0 CA--C 1.54 0.567 0 O-C-N 121.414 -0.804 . . . . 0.0 110.815 159.425 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 31.5 p -67.37 130.67 43.81 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 121.977 0.894 . . . . 0.0 110.346 169.34 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -152.99 57.81 2.16 Favored Pre-proline 0 CA--C 1.544 0.721 0 N-CA-C 114.436 1.273 . . . . 0.0 114.436 -178.281 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -68.06 172.33 11.09 Favored 'Trans proline' 0 N--CA 1.451 -1.028 0 C-N-CA 124.255 3.303 . . . . 0.0 111.98 176.378 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -72.27 157.76 88.69 Favored Pre-proline 0 CA--C 1.546 0.793 0 CA-C-N 113.69 -1.595 . . . . 0.0 111.166 165.85 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -68.16 160.84 47.05 Favored 'Trans proline' 0 CA--C 1.545 1.025 0 C-N-CA 122.834 2.356 . . . . 0.0 110.967 163.805 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -71.17 174.41 10.75 Favored 'Trans proline' 0 CA--C 1.535 0.574 0 C-N-CA 122.697 2.265 . . . . 0.0 112.506 176.518 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -140.76 167.59 21.81 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.183 1.393 . . . . 0.0 111.258 -167.51 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.1 p -155.45 57.58 0.63 Allowed 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.857 1.263 . . . . 0.0 112.52 178.885 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -146.1 161.52 39.99 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.397 -0.814 . . . . 0.0 109.07 174.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -59.54 154.72 16.78 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 122.937 1.351 . . . . 0.0 112.61 163.347 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -163.71 146.96 10.0 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 127.489 2.316 . . . . 0.0 107.911 175.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 64.6 mttt -63.14 142.58 97.74 Favored Pre-proline 0 N--CA 1.474 0.769 0 O-C-N 121.324 -0.86 . . . . 0.0 110.604 170.042 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -79.65 163.25 24.08 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 121.891 1.728 . . . . 0.0 113.674 -160.825 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.75 158.96 32.62 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 113.439 -1.71 . . . . 0.0 113.12 169.595 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.05 147.64 37.63 Favored Pre-proline 0 N--CA 1.463 0.205 0 C-N-CA 124.734 1.213 . . . . 0.0 108.297 166.854 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -67.2 -35.42 24.73 Favored 'Trans proline' 0 CA--C 1.535 0.559 0 C-N-CA 121.625 1.55 . . . . 0.0 111.461 -178.505 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 29.7 p -77.69 -23.64 49.48 Favored 'General case' 0 CA--C 1.557 1.241 0 C-N-CA 125.507 1.523 . . . . 0.0 113.658 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 82.2 m -98.21 -17.43 18.99 Favored 'General case' 0 CA--C 1.553 1.094 0 N-CA-C 114.511 1.301 . . . . 0.0 114.511 -179.738 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.35 163.7 8.18 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.182 0.993 . . . . 0.0 112.87 -178.566 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 56.7 m 42.21 54.54 9.1 Favored Pre-proline 0 CA--C 1.547 0.852 0 C-N-CA 124.815 1.246 . . . . 0.0 113.328 -174.446 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -69.65 -24.09 30.57 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 123.319 2.679 . . . . 0.0 112.776 -158.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.41 ' HG3' ' H ' ' A' ' 33' ' ' THR . 0.1 OUTLIER -53.48 -69.83 0.11 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 127.785 2.434 . . . . 0.0 113.76 164.177 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.41 ' H ' ' HG3' ' A' ' 32' ' ' GLU . 0.0 OUTLIER -60.84 -35.28 76.13 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 126.129 1.771 . . . . 0.0 110.96 176.554 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 9.2 tmtm? -53.41 -52.01 60.74 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.969 1.708 . . . . 0.0 112.264 169.808 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 50.4 tttm -58.5 -47.89 82.6 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.806 0.842 . . . . 0.0 111.984 175.369 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.14 -39.76 95.61 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 114.731 -1.122 . . . . 0.0 112.209 -178.191 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 11.8 ttp85 -61.48 -57.12 13.44 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 125.729 1.612 . . . . 0.0 109.918 174.453 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -66.35 -28.51 68.72 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.851 0.861 . . . . 0.0 112.92 -176.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.97 -42.39 80.92 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 120.216 -1.552 . . . . 0.0 112.646 169.005 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.7 t -55.43 -34.41 64.42 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 122.173 0.987 . . . . 0.0 111.545 171.386 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 61.8 mt -77.36 -33.55 19.89 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 C-N-CA 125.381 1.472 . . . . 0.0 112.428 178.352 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 73.2 mt -66.05 -34.06 67.69 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 123.883 0.873 . . . . 0.0 111.44 168.207 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -74.01 -36.3 64.45 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.013 1.325 . . . . 0.0 114.509 178.595 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.7 mppt? -138.43 -55.97 0.64 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.162 1.385 . . . . 0.0 113.646 175.533 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 136.75 163.54 9.82 Favored Glycine 0 CA--C 1.532 1.103 0 C-N-CA 126.32 1.914 . . . . 0.0 109.6 -159.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.521 ' HB3' HD11 ' A' ' 53' ' ' ILE . 0.2 OUTLIER -74.1 -28.22 61.26 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 120.927 -1.337 . . . . 0.0 112.893 -169.091 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 -57.49 -32.49 67.06 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 178.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -84.79 5.22 29.46 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.941 1.296 . . . . 0.0 113.13 177.706 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 6.9 m -147.47 16.11 1.14 Allowed 'General case' 0 N--CA 1.441 -0.901 0 C-N-CA 125.067 1.347 . . . . 0.0 113.107 -154.299 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLY . . . . . 0.643 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -65.76 -27.59 72.84 Favored Glycine 0 C--O 1.216 -0.983 0 O-C-N 120.115 -1.615 . . . . 0.0 114.964 -179.549 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 40.8 p-80 -54.93 -25.58 30.34 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 120.973 2.386 . . . . 0.0 113.852 165.761 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.58 -34.04 31.24 Favored 'General case' 0 N--CA 1.462 0.135 0 C-N-CA 123.718 0.807 . . . . 0.0 110.956 173.081 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.643 HD12 ' HA2' ' A' ' 50' ' ' GLY . 35.9 mt -74.45 -38.57 46.77 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-O 119.202 -0.428 . . . . 0.0 110.626 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.68 -53.12 56.29 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 125.851 1.66 . . . . 0.0 111.404 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -56.37 -40.5 74.66 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.052 -1.03 . . . . 0.0 112.65 177.324 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 15.5 t60 -68.31 -48.12 65.75 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.937 1.295 . . . . 0.0 113.737 177.14 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 4.1 mtpp -48.97 -53.05 21.5 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 126.258 1.823 . . . . 0.0 111.498 174.635 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 34.8 mm-40 -72.9 -36.82 67.38 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.206 0.602 . . . . 0.0 111.564 -176.346 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 48.6 t -49.89 -56.49 10.31 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.594 0.757 . . . . 0.0 112.16 165.428 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 8.1 mtp -54.36 -53.59 51.96 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.89 1.276 . . . . 0.0 110.168 174.353 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 57.9 mtt180 -53.34 -30.93 41.93 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 126.137 1.775 . . . . 0.0 114.683 -176.362 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -47.56 -35.89 9.71 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.346 1.058 . . . . 0.0 112.911 169.847 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.3 mp -79.0 5.62 11.27 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.909 1.283 . . . . 0.0 112.381 -172.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.56 8.6 70.31 Favored Glycine 0 CA--C 1.535 1.291 0 C-N-CA 125.899 1.714 . . . . 0.0 113.049 -170.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -72.36 160.74 31.85 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 127.407 2.283 . . . . 0.0 112.74 -172.656 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.9 94.44 4.68 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.727 1.211 . . . . 0.0 108.131 -179.245 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.308 0 C-N-CA 127.469 2.308 . . . . 0.0 109.676 174.276 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.394 0 N-CA-C 108.321 -1.911 . . . . 0.0 108.321 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.1 m -148.21 161.88 40.59 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 118.238 1.019 . . . . 0.0 110.979 -167.464 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 85.2 t80 -149.76 157.75 43.51 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.322 1.449 . . . . 0.0 109.765 176.23 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.7 m -158.54 -50.33 0.06 Allowed 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 171.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 18.4 ttt 31.87 54.23 0.9 Allowed Pre-proline 0 N--CA 1.482 1.143 0 C-N-CA 126.932 2.093 . . . . 0.0 116.103 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -74.5 1.38 7.5 Favored 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 122.588 2.192 . . . . 0.0 115.903 -163.459 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 126.65 87.72 0.64 Allowed Glycine 0 N--CA 1.47 0.957 0 CA-C-N 118.928 0.786 . . . . 0.0 111.709 -176.651 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -159.2 148.58 18.59 Favored 'General case' 0 N--CA 1.463 0.176 0 C-N-CA 124.364 1.066 . . . . 0.0 112.175 -171.214 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 41.9 t 67.74 145.81 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 C-N-CA 128.191 2.596 . . . . 0.0 114.452 175.422 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -130.0 -37.4 1.5 Allowed 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 125.836 1.654 . . . . 0.0 113.768 -172.6 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.0 t 46.11 22.82 0.15 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 128.362 2.665 . . . . 0.0 115.831 -171.411 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 -148.78 61.08 5.3 Favored Pre-proline 0 CA--C 1.555 1.135 0 C-N-CA 126.432 1.893 . . . . 0.0 112.253 -172.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -65.86 162.8 33.39 Favored 'Trans proline' 0 N--CA 1.45 -1.072 0 C-N-CA 124.013 3.142 . . . . 0.0 110.51 166.011 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -75.6 148.94 83.27 Favored Pre-proline 0 CA--C 1.547 0.849 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -67.51 169.08 16.45 Favored 'Trans proline' 0 CA--C 1.546 1.118 0 C-N-CA 124.205 3.27 . . . . 0.0 112.404 167.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.81 176.51 8.85 Favored 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 123.252 2.635 . . . . 0.0 112.869 172.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -97.41 139.89 32.68 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 114.912 -1.04 . . . . 0.0 112.432 175.248 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.0 m -67.22 14.24 0.05 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 126.981 2.112 . . . . 0.0 115.787 -178.633 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 18.5 tp60 -66.02 -32.85 74.56 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.651 1.18 . . . . 0.0 113.735 -171.117 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -169.17 -159.69 0.24 Allowed 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.884 1.674 . . . . 0.0 109.554 174.787 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 40.1 mmtm -55.27 33.62 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 129.876 3.27 . . . . 0.0 117.123 173.831 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 44.7 mttt -57.97 153.24 34.85 Favored Pre-proline 0 N--CA 1.472 0.663 0 O-C-N 120.197 -1.564 . . . . 0.0 112.472 176.554 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -73.5 166.59 29.46 Favored 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 122.34 2.027 . . . . 0.0 112.635 -177.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.441 HD22 ' HB2' ' A' ' 29' ' ' ALA . 1.2 mt -122.6 167.09 13.83 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.762 1.225 . . . . 0.0 112.439 175.356 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 4.6 mttp -129.44 150.62 76.1 Favored Pre-proline 0 N--CA 1.472 0.664 0 C-N-CA 126.467 1.907 . . . . 0.0 107.772 174.845 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -78.41 -19.0 12.0 Favored 'Trans proline' 0 CA--C 1.55 1.297 0 C-N-CA 122.246 1.964 . . . . 0.0 112.425 -179.036 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 26.8 p -73.9 -14.6 61.09 Favored 'General case' 0 CA--C 1.557 1.217 0 C-N-CA 125.726 1.61 . . . . 0.0 112.629 165.788 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 64.6 m -111.77 -36.22 5.5 Favored 'General case' 0 CA--C 1.547 0.858 0 N-CA-C 114.622 1.342 . . . . 0.0 114.622 -177.281 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.441 ' HB2' HD22 ' A' ' 24' ' ' LEU . . . -63.26 157.15 23.46 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.901 0.88 . . . . 0.0 110.003 -179.769 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 53.6 m 43.55 55.16 11.62 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 123.567 0.747 . . . . 0.0 113.004 -179.261 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -68.98 -7.93 22.17 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 123.906 3.071 . . . . 0.0 113.578 -158.771 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 36.2 mm-40 -96.37 -43.54 7.62 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 125.215 1.406 . . . . 0.0 110.685 -176.605 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.1 p -66.58 -27.26 67.59 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 117.948 -1.025 . . . . 0.0 111.99 161.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 9.8 tmtt? -58.32 -55.43 35.11 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 120.276 1.398 . . . . 0.0 111.457 169.821 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.6 mttp -55.16 -43.38 74.19 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 125.355 1.462 . . . . 0.0 112.458 172.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.61 -39.8 80.67 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 177.493 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 12.0 ttp85 -58.49 -53.25 60.44 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.514 1.125 . . . . 0.0 109.106 176.825 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -74.37 -30.11 61.84 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 115.124 -0.944 . . . . 0.0 112.817 -174.752 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.49 -43.32 99.08 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 120.772 -1.205 . . . . 0.0 111.794 166.148 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.8 t -56.27 -33.45 65.5 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.952 0.901 . . . . 0.0 111.741 173.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 67.0 mt -77.88 -35.46 20.84 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 124.769 1.228 . . . . 0.0 112.482 177.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 84.4 mt -64.46 -36.29 76.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 124.375 1.07 . . . . 0.0 111.379 168.364 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -71.98 -37.84 69.82 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.761 1.625 . . . . 0.0 113.983 178.625 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.9 mppt? -139.12 -59.23 0.59 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.582 1.553 . . . . 0.0 113.706 178.043 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 135.61 158.24 8.17 Favored Glycine 0 CA--C 1.531 1.033 0 C-N-CA 126.104 1.811 . . . . 0.0 109.714 -159.102 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.505 ' HB3' HD11 ' A' ' 53' ' ' ILE . 0.4 OUTLIER -72.96 -27.48 61.85 Favored 'General case' 0 N--CA 1.465 0.28 0 O-C-N 120.746 -1.444 . . . . 0.0 113.011 -165.857 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -56.46 -36.18 68.77 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 122.76 0.424 . . . . 0.0 111.76 177.68 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -81.51 4.46 21.16 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.81 1.244 . . . . 0.0 113.1 177.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 6.0 m -147.81 15.84 1.09 Allowed 'General case' 0 N--CA 1.439 -0.994 0 C-N-CA 125.945 1.698 . . . . 0.0 112.473 -154.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLY . . . . . 0.756 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -75.33 -13.16 83.08 Favored Glycine 0 C--O 1.222 -0.652 0 O-C-N 119.707 -1.87 . . . . 0.0 115.378 -178.061 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 35.2 p-80 -60.65 -33.82 73.38 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.889 1.844 . . . . 0.0 112.214 158.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.84 -37.85 67.28 Favored 'General case' 0 CA--C 1.516 -0.332 0 C-N-CA 124.132 0.973 . . . . 0.0 108.944 177.147 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.756 HD12 ' HA2' ' A' ' 50' ' ' GLY . 17.6 mt -71.23 -43.05 74.91 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.614 0 CA-C-O 118.853 -0.594 . . . . 0.0 109.673 177.617 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -60.93 -46.67 89.75 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 119.43 1.014 . . . . 0.0 112.267 179.55 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -61.54 -44.52 96.89 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.501 0.72 . . . . 0.0 112.865 175.339 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 14.2 t60 -63.33 -45.42 91.36 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 121.142 -0.973 . . . . 0.0 112.643 174.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.6 mtmt -54.76 -48.29 72.83 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.598 0.759 . . . . 0.0 111.235 173.667 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 87.3 mt-10 -70.94 -28.29 64.38 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 117.929 -1.034 . . . . 0.0 113.112 -178.563 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 48.9 t -57.02 -60.24 3.88 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 119.183 0.901 . . . . 0.0 111.212 160.841 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 76.0 mtm -54.05 -45.51 71.69 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 119.576 1.08 . . . . 0.0 113.355 178.212 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 47.7 mtt180 -50.71 -37.28 40.6 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 126.636 1.974 . . . . 0.0 113.292 -178.196 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.57 ' HB3' HD12 ' A' ' 63' ' ' LEU . . . -47.45 -39.08 14.9 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 169.428 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.57 HD12 ' HB3' ' A' ' 62' ' ' ALA . 1.7 mp -84.1 10.26 10.55 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 126.367 1.867 . . . . 0.0 111.571 -172.397 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.11 33.46 10.76 Favored Glycine 0 CA--C 1.534 1.247 0 O-C-N 120.623 -1.298 . . . . 0.0 113.685 -179.313 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -99.07 156.46 16.92 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.038 1.735 . . . . 0.0 112.749 -168.578 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 3.1 mppt? -116.37 73.11 0.84 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.0 1.72 . . . . 0.0 109.504 -160.464 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.028 0 C-N-CA 125.801 1.64 . . . . 0.0 111.759 -165.691 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.5 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 7.8 t -157.8 -176.72 6.09 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.069 1.348 . . . . 0.0 109.541 173.438 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 24.9 p90 -141.05 172.4 12.73 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.718 1.607 . . . . 0.0 110.357 174.551 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 3.4 m -158.45 158.35 33.97 Favored 'General case' 0 N--CA 1.478 0.949 0 O-C-N 120.821 -1.175 . . . . 0.0 110.187 178.863 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.3 tpt -127.13 73.83 77.0 Favored Pre-proline 0 N--CA 1.471 0.593 0 C-N-CA 125.117 1.367 . . . . 0.0 108.947 167.312 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -68.1 0.74 4.11 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 123.768 2.979 . . . . 0.0 115.21 -169.167 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -104.46 -18.65 12.62 Favored Glycine 0 CA--C 1.533 1.206 0 CA-C-O 118.902 -0.943 . . . . 0.0 114.665 173.891 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 46.83 -165.73 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.821 1.249 . . . . 0.0 113.135 -165.388 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.4 p -158.69 147.5 8.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 O-C-N 121.159 -0.963 . . . . 0.0 112.673 179.505 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -137.05 162.54 33.06 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 127.531 2.332 . . . . 0.0 107.055 151.172 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 24.9 m -158.62 56.34 0.44 Allowed 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.697 1.199 . . . . 0.0 110.551 163.738 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -121.13 63.69 12.45 Favored Pre-proline 0 CA--C 1.552 1.041 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -176.37 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_endo -81.49 -169.99 0.89 Allowed 'Trans proline' 0 CA--C 1.544 0.994 0 C-N-CA 124.774 3.65 . . . . 0.0 111.515 170.387 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -127.29 156.37 74.92 Favored Pre-proline 0 CA--C 1.544 0.712 0 C-N-CA 124.339 1.056 . . . . 0.0 111.423 167.261 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -70.07 156.8 61.66 Favored 'Trans proline' 0 CA--C 1.543 0.956 0 C-N-CA 122.888 2.392 . . . . 0.0 112.706 171.613 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -75.28 175.52 11.16 Favored 'Trans proline' 0 CA--C 1.537 0.638 0 C-N-CA 123.031 2.487 . . . . 0.0 112.333 166.761 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -82.46 156.54 24.03 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.468 1.107 . . . . 0.0 113.519 -176.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 10.1 m -65.34 15.99 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 127.968 2.507 . . . . 0.0 116.858 -176.569 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -36.85 -52.33 0.92 Allowed 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 127.885 2.474 . . . . 0.0 114.344 -168.402 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -162.74 167.82 22.43 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.618 1.167 . . . . 0.0 108.281 148.572 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.28 51.75 0.17 Allowed 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 127.742 2.417 . . . . 0.0 111.894 175.286 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 41.1 mmtm -72.82 158.4 87.3 Favored Pre-proline 0 N--CA 1.474 0.745 0 C-N-CA 125.49 1.516 . . . . 0.0 113.083 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -83.13 171.51 11.43 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 123.372 2.715 . . . . 0.0 111.652 168.177 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.74 ' CD1' ' H ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -98.7 165.1 11.96 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-O 122.503 1.144 . . . . 0.0 111.246 172.244 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.74 ' H ' ' CD1' ' A' ' 24' ' ' LEU . 0.1 OUTLIER -147.46 120.51 4.81 Favored Pre-proline 0 CA--C 1.538 0.485 0 C-N-CA 131.505 3.922 . . . . 0.0 105.41 -168.497 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -62.18 -32.88 82.84 Favored 'Trans proline' 0 CA--C 1.536 0.6 0 C-N-CA 124.047 3.165 . . . . 0.0 114.401 -148.298 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 29.6 p -64.46 -19.4 65.54 Favored 'General case' 0 CA--C 1.555 1.169 0 C-N-CA 125.379 1.472 . . . . 0.0 113.81 179.813 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 61.5 m -110.01 -4.75 15.71 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.897 1.679 . . . . 0.0 114.457 -177.772 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.74 154.55 38.7 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.133 -0.979 . . . . 0.0 110.261 -177.657 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 55.6 m 42.31 59.75 10.0 Favored Pre-proline 0 CA--C 1.548 0.879 0 N-CA-C 113.777 1.028 . . . . 0.0 113.777 179.471 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -69.9 -18.22 36.48 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.642 2.228 . . . . 0.0 112.747 -156.519 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 27.5 mm-40 -85.37 -40.8 16.08 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.691 1.196 . . . . 0.0 112.295 -178.277 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.4 p -65.53 -30.28 71.01 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 120.725 -1.235 . . . . 0.0 111.328 161.134 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 9.6 tmtt? -60.85 -48.14 83.18 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 120.39 1.45 . . . . 0.0 111.836 171.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 42.4 mttt -55.04 -49.64 71.07 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 126.106 1.763 . . . . 0.0 111.694 171.297 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.17 -36.6 83.51 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 112.921 0.712 . . . . 0.0 112.921 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 8.3 ttp85 -58.87 -53.46 58.18 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.939 1.296 . . . . 0.0 109.6 174.219 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 60.6 m-20 -70.46 -30.39 67.2 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.78 0.832 . . . . 0.0 112.836 -176.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.42 -39.42 93.8 Favored 'General case' 0 CA--C 1.547 0.857 0 O-C-N 120.418 -1.426 . . . . 0.0 112.969 166.889 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.8 t -59.73 -32.38 70.49 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 122.773 1.273 . . . . 0.0 112.095 169.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 67.9 mt -75.57 -33.01 25.84 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 O-C-N 120.386 -1.446 . . . . 0.0 111.341 177.522 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 77.3 mt -62.48 -36.63 75.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.617 1.167 . . . . 0.0 112.173 166.511 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -64.88 -48.67 73.42 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 119.573 1.079 . . . . 0.0 113.269 175.599 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.4 pttm -155.5 -4.91 0.13 Allowed 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 116.407 2.003 . . . . 0.0 116.407 -160.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 83.71 158.42 26.76 Favored Glycine 0 CA--C 1.527 0.811 0 CA-C-N 119.057 0.844 . . . . 0.0 112.62 -167.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.09 -28.36 68.11 Favored 'General case' 0 C--N 1.334 -0.101 0 O-C-N 121.578 -0.954 . . . . 0.0 112.723 -169.782 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.416 ' HG3' ' CD2' ' A' ' 48' ' ' HIS . 11.3 pt-20 -59.69 -26.22 65.4 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-O 118.122 -0.942 . . . . 0.0 112.905 175.613 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' HIS . . . . . 0.416 ' CD2' ' HG3' ' A' ' 47' ' ' GLU . 82.5 m-70 -98.72 15.33 25.64 Favored 'General case' 0 C--N 1.352 0.683 0 CA-C-N 120.61 1.55 . . . . 0.0 110.528 -179.594 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 1.8 m -147.79 14.74 1.07 Allowed 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 125.973 1.709 . . . . 0.0 113.503 -157.695 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLY . . . . . 0.544 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -67.11 -17.63 68.15 Favored Glycine 0 C--O 1.215 -1.064 0 O-C-N 119.569 -1.957 . . . . 0.0 115.825 -175.508 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 35.2 p-80 -58.94 -33.69 70.89 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 121.572 2.686 . . . . 0.0 112.795 164.402 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.24 -34.64 61.43 Favored 'General case' 0 N--CA 1.462 0.175 0 C-N-CA 126.354 1.862 . . . . 0.0 111.453 173.737 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.544 HD12 ' HA2' ' A' ' 50' ' ' GLY . 3.5 mt -70.54 -43.44 77.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 118.911 -1.115 . . . . 0.0 110.914 171.058 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -63.02 -53.78 48.54 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.921 0.888 . . . . 0.0 112.278 -176.516 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -58.45 -32.69 68.95 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.34 -1.475 . . . . 0.0 113.646 178.082 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 10.7 t60 -74.02 -44.67 53.66 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.677 1.191 . . . . 0.0 113.043 175.053 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.519 ' HD3' HG22 ' A' ' 53' ' ' ILE . 35.0 mtpt -53.54 -53.1 56.46 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.162 1.385 . . . . 0.0 112.07 176.27 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -62.76 -40.62 97.83 Favored 'General case' 0 C--N 1.327 -0.405 0 O-C-N 123.318 0.386 . . . . 0.0 111.713 -176.285 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 44.0 t -51.5 -51.28 56.51 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 124.069 0.948 . . . . 0.0 112.844 169.269 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 72.8 mtm -62.06 -51.72 66.81 Favored 'General case' 0 N--CA 1.481 1.081 0 O-C-N 120.979 -1.076 . . . . 0.0 111.507 171.864 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 69.0 mtt180 -53.77 -32.37 52.1 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 126.981 2.112 . . . . 0.0 113.87 -175.44 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -44.86 -33.35 1.92 Allowed 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.047 1.339 . . . . 0.0 113.804 168.605 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.3 mp -82.19 5.63 19.2 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.195 0.998 . . . . 0.0 112.375 -173.286 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.29 17.9 75.3 Favored Glycine 0 CA--C 1.534 1.233 0 C-N-CA 125.039 1.304 . . . . 0.0 112.614 -166.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -70.49 144.24 51.45 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.999 1.72 . . . . 0.0 110.692 179.371 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? -106.34 101.72 11.17 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 125.084 1.354 . . . . 0.0 108.979 -175.124 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.252 1.207 0 C-N-CA 128.512 2.725 . . . . 0.0 109.191 -172.027 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.357 0 N-CA-C 108.251 -1.94 . . . . 0.0 108.251 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 12.8 m -147.61 158.79 44.16 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 118.391 1.096 . . . . 0.0 111.272 -164.92 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -56.22 137.4 52.05 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 160.283 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.9 m -147.66 141.09 25.34 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.55 1.14 . . . . 0.0 108.544 -178.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . 0.25 12.6 ptt? -134.0 65.58 69.99 Favored Pre-proline 0 CA--C 1.545 0.779 0 N-CA-C 113.577 0.955 . . . . 0.0 113.577 -173.707 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -73.62 -3.92 14.55 Favored 'Trans proline' 0 CA--C 1.546 1.103 0 C-N-CA 123.1 2.534 . . . . 0.0 115.464 -178.023 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -94.95 45.9 2.09 Favored Glycine 0 N--CA 1.473 1.146 0 C-N-CA 125.219 1.39 . . . . 0.0 113.883 -174.11 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 5.4 mp -112.17 138.6 48.62 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 125.335 1.454 . . . . 0.0 111.373 -172.381 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 24.8 t 46.49 65.45 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 C-N-CA 126.071 1.748 . . . . 0.0 112.093 161.651 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 14.2 t0 -123.22 164.91 17.82 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -153.391 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 61.6 m -67.13 126.04 27.94 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.444 1.098 . . . . 0.0 112.778 -179.312 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -126.92 79.9 71.97 Favored Pre-proline 0 CA--C 1.542 0.67 0 C-N-CA 125.56 1.544 . . . . 0.0 108.307 174.64 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -78.95 179.69 6.25 Favored 'Trans proline' 0 N--CA 1.454 -0.82 0 C-N-CA 123.938 3.092 . . . . 0.0 111.962 -175.657 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.27 153.53 75.01 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 123.739 0.816 . . . . 0.0 112.923 172.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -69.63 165.53 30.49 Favored 'Trans proline' 0 CA--C 1.545 1.029 0 C-N-CA 123.294 2.662 . . . . 0.0 111.884 166.8 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -70.72 176.08 7.99 Favored 'Trans proline' 0 CA--C 1.537 0.657 0 C-N-CA 122.847 2.365 . . . . 0.0 112.313 169.17 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -74.81 154.75 38.16 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.302 1.041 . . . . 0.0 113.207 -178.485 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.7 p -155.37 -3.24 0.14 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 126.946 2.098 . . . . 0.0 114.944 -179.156 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -142.61 170.29 15.99 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 119.42 1.009 . . . . 0.0 109.937 -174.805 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -56.97 137.13 56.0 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 120.09 -1.631 . . . . 0.0 111.492 157.833 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -134.86 -175.64 3.97 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 130.141 3.376 . . . . 0.0 109.839 171.124 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 35.4 mmtm -129.38 150.54 75.84 Favored Pre-proline 0 N--CA 1.474 0.734 0 O-C-N 121.197 -0.939 . . . . 0.0 110.184 162.735 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -82.57 166.49 15.58 Favored 'Trans proline' 0 CA--C 1.534 0.494 0 C-N-CA 122.356 2.037 . . . . 0.0 113.5 -162.399 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.617 ' CD1' ' H ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -135.96 163.8 29.44 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.153 1.381 . . . . 0.0 109.353 171.271 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.617 ' H ' ' CD1' ' A' ' 24' ' ' LEU . 12.4 ptmm? -139.01 130.71 15.3 Favored Pre-proline 0 CA--C 1.536 0.429 0 C-N-CA 129.781 3.232 . . . . 0.0 106.342 -176.665 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -61.43 -28.9 84.39 Favored 'Trans proline' 0 CA--C 1.541 0.836 0 C-N-CA 123.939 3.092 . . . . 0.0 114.714 -154.46 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 29.3 p -71.95 -21.36 61.61 Favored 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 125.461 1.504 . . . . 0.0 113.961 177.127 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 99.2 m -100.68 -12.57 19.05 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.737 1.615 . . . . 0.0 114.085 -178.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.31 151.74 43.02 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.267 0.627 . . . . 0.0 110.666 -174.679 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 57.4 m 42.04 58.4 10.12 Favored Pre-proline 0 CA--C 1.552 1.032 0 N-CA-C 114.1 1.148 . . . . 0.0 114.1 -176.377 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -65.57 -30.84 51.43 Favored 'Trans proline' 0 CA--C 1.534 0.495 0 C-N-CA 123.729 2.953 . . . . 0.0 112.041 -166.092 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -41.5 -70.04 0.12 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 127.349 2.26 . . . . 0.0 115.31 158.365 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -65.25 -28.7 69.53 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.007 -1.058 . . . . 0.0 111.726 177.046 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 5.0 tmtt? -58.12 -46.69 85.15 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 120.359 1.436 . . . . 0.0 111.088 171.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 4.5 tmtm? -63.34 -45.06 92.98 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 123.721 0.808 . . . . 0.0 110.716 176.434 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.78 -42.4 97.46 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 176.832 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 11.4 ttp85 -59.45 -53.72 54.93 Favored 'General case' 0 C--O 1.221 -0.429 0 C-N-CA 126.148 1.779 . . . . 0.0 110.247 175.581 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 56.8 m-20 -66.19 -31.97 73.12 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.014 0.926 . . . . 0.0 113.137 179.564 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -69.22 -37.08 77.87 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 120.728 -1.232 . . . . 0.0 112.447 172.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 9.3 t -55.91 -43.21 77.08 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 121.949 0.88 . . . . 0.0 110.89 169.24 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 71.4 mt -69.16 -29.01 41.24 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 C-N-CA 124.319 1.048 . . . . 0.0 111.272 -179.697 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 89.3 mt -70.31 -35.15 61.41 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 C-N-CA 123.509 0.724 . . . . 0.0 112.092 169.048 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -76.41 -32.58 58.59 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 114.561 1.319 . . . . 0.0 114.561 178.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.414 ' HG3' ' HB2' ' A' ' 48' ' ' HIS . 0.0 OUTLIER -146.2 -18.14 0.44 Allowed 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 117.238 2.31 . . . . 0.0 117.238 -175.413 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 91.33 174.66 43.47 Favored Glycine 0 CA--C 1.536 1.364 0 CA-C-N 118.868 0.758 . . . . 0.0 113.386 -167.179 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -79.6 -35.07 40.13 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 115.592 1.701 . . . . 0.0 115.592 -157.575 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -60.89 -34.38 74.56 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.086 0.954 . . . . 0.0 113.423 174.19 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' HIS . . . . . 0.414 ' HB2' ' HG3' ' A' ' 44' ' ' LYS . 99.4 m-70 -81.92 9.16 8.7 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.574 1.15 . . . . 0.0 112.514 -178.439 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 9.8 m -140.03 12.56 2.43 Favored 'General case' 0 N--CA 1.441 -0.906 0 C-N-CA 125.805 1.642 . . . . 0.0 113.949 -162.794 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -63.96 -30.11 76.78 Favored Glycine 0 C--O 1.213 -1.182 0 O-C-N 120.126 -1.609 . . . . 0.0 114.973 179.246 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 40.6 p-80 -57.14 -28.17 62.51 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 121.537 2.668 . . . . 0.0 113.523 167.44 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.83 -36.38 56.9 Favored 'General case' 0 CA--C 1.522 -0.13 0 C-N-CA 123.721 0.808 . . . . 0.0 110.757 171.856 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.532 HG22 ' HD3' ' A' ' 57' ' ' LYS . 27.9 mt -72.04 -39.68 66.31 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 CA-C-O 119.321 -0.371 . . . . 0.0 110.64 179.335 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.15 -49.12 63.06 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 125.464 1.506 . . . . 0.0 111.594 -177.029 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -58.23 -45.23 88.08 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.912 0.885 . . . . 0.0 112.563 172.819 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 11.9 t60 -60.49 -45.66 92.93 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 122.184 0.992 . . . . 0.0 112.644 174.142 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.532 ' HD3' HG22 ' A' ' 53' ' ' ILE . 17.0 mtpp -55.34 -48.53 74.07 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.851 1.261 . . . . 0.0 111.283 174.027 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 60.3 mm-40 -60.15 -41.58 93.08 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 120.934 1.697 . . . . 0.0 111.244 177.867 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 41.8 t -55.88 -52.88 62.54 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.353 0.661 . . . . 0.0 111.582 178.173 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 71.4 mtm -60.32 -45.25 94.05 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.503 0.721 . . . . 0.0 111.116 172.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 25.2 mtm180 -54.67 -32.81 59.88 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 119.821 -1.799 . . . . 0.0 114.051 -178.101 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -44.63 -36.06 2.9 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.12 0.968 . . . . 0.0 113.445 169.434 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.8 mp -79.33 6.62 9.55 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 123.919 0.888 . . . . 0.0 112.644 -173.638 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 82.93 23.98 54.02 Favored Glycine 0 CA--C 1.534 1.241 0 C-N-CA 125.994 1.759 . . . . 0.0 112.399 -172.875 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -87.05 154.09 21.03 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.047 1.739 . . . . 0.0 113.052 -156.749 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.5 mmpt? -92.91 72.72 4.8 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.366 1.866 . . . . 0.0 110.543 -172.576 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 12.5 mm . . . . . 0 C--O 1.252 1.214 0 N-CA-C 114.966 1.469 . . . . 0.0 114.966 -151.781 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.148 0 N-CA-C 106.284 -2.727 . . . . 0.0 106.284 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 30.4 m -76.92 -71.8 0.38 Allowed 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 106.127 -1.805 . . . . 0.0 106.127 136.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 33.8 p90 -44.15 129.05 6.16 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.055 1.342 . . . . 0.0 112.156 158.31 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 25.1 m -152.03 140.71 20.83 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.999 1.32 . . . . 0.0 108.511 -175.138 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.61 57.92 4.54 Favored Pre-proline 0 CA--C 1.549 0.921 0 N-CA-C 113.843 1.053 . . . . 0.0 113.843 -163.929 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -78.23 -4.62 14.45 Favored 'Trans proline' 0 CA--C 1.545 1.052 0 C-N-CA 122.498 2.132 . . . . 0.0 114.088 177.044 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -122.32 83.63 0.36 Allowed Glycine 0 N--CA 1.469 0.85 0 C-N-CA 125.537 1.542 . . . . 0.0 111.309 -174.147 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -118.2 139.71 50.88 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 124.842 1.257 . . . . 0.0 112.962 -170.879 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 93.5 t 57.09 88.4 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 C-N-CA 126.83 2.052 . . . . 0.0 111.862 169.477 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -147.53 160.58 42.46 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 126.085 1.754 . . . . 0.0 110.716 -172.462 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 33.4 m -158.27 55.86 0.46 Allowed 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.847 1.659 . . . . 0.0 108.669 176.732 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -123.35 85.84 52.01 Favored Pre-proline 0 CA--C 1.548 0.866 0 C-N-CA 125.438 1.495 . . . . 0.0 107.117 -163.788 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_endo -87.53 177.55 3.68 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 124.281 3.32 . . . . 0.0 112.614 -167.384 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -98.69 157.03 34.95 Favored Pre-proline 0 CA--C 1.545 0.776 0 C-N-CA 124.858 1.263 . . . . 0.0 110.838 167.244 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -68.72 162.22 42.1 Favored 'Trans proline' 0 CA--C 1.545 1.048 0 C-N-CA 122.876 2.384 . . . . 0.0 112.323 169.745 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -72.5 179.37 5.19 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 123.291 2.66 . . . . 0.0 112.228 166.258 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -104.96 161.18 14.42 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.97 0.908 . . . . 0.0 111.369 174.254 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.4 m -66.54 154.23 40.91 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 116.642 2.09 . . . . 0.0 116.642 -161.552 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -69.87 62.66 0.19 Allowed 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 125.579 1.552 . . . . 0.0 112.007 153.322 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -130.76 161.54 31.49 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 120.829 -1.169 . . . . 0.0 111.212 175.528 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 22.5 tptt -81.76 41.41 0.65 Allowed 'General case' 0 CA--C 1.545 0.761 0 O-C-N 120.683 -1.261 . . . . 0.0 112.917 -178.741 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 36.4 mtpt -111.46 164.94 13.79 Favored Pre-proline 0 N--CA 1.478 0.958 0 C-N-CA 125.736 1.615 . . . . 0.0 112.988 -164.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -85.38 156.46 10.84 Favored 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 122.407 2.071 . . . . 0.0 112.413 -176.802 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.531 HD13 ' H ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -64.38 156.35 29.54 Favored 'General case' 0 CA--C 1.556 1.18 0 CA-C-N 114.108 -1.405 . . . . 0.0 110.828 164.454 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.531 ' H ' HD13 ' A' ' 24' ' ' LEU . 23.5 pttm -121.4 130.15 24.93 Favored Pre-proline 0 CA--C 1.539 0.551 0 C-N-CA 128.785 2.834 . . . . 0.0 108.011 173.927 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -60.82 -27.83 85.43 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 124.264 3.31 . . . . 0.0 114.636 -156.435 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 31.8 p -66.47 -20.76 66.13 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 126.126 1.77 . . . . 0.0 113.501 176.585 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 57.9 m -114.52 1.93 14.45 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.401 1.481 . . . . 0.0 114.422 -179.575 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.457 ' HB2' ' CE2' ' A' ' 65' ' ' PHE . . . -64.25 150.59 45.64 Favored 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 121.83 -0.544 . . . . 0.0 110.952 -178.168 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.2 m 44.52 61.53 11.19 Favored Pre-proline 0 CA--C 1.549 0.91 0 N-CA-C 112.535 0.568 . . . . 0.0 112.535 -175.377 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -67.36 -9.29 24.76 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 123.722 2.948 . . . . 0.0 112.944 -162.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 40.6 mm-40 -90.66 -48.69 6.91 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 126.589 1.956 . . . . 0.0 111.888 -178.624 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 9.1 p -65.79 -28.22 68.85 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 119.761 1.164 . . . . 0.0 111.862 163.575 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 24.3 tttt -57.94 -57.76 11.38 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.934 0.893 . . . . 0.0 110.476 169.813 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.0 mtmp? -58.73 -37.63 76.6 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.132 0.973 . . . . 0.0 112.718 176.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.86 -39.3 87.5 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 174.19 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 4.3 ttp180 -60.2 -53.05 62.37 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.388 1.075 . . . . 0.0 109.564 171.717 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -62.05 -37.91 86.74 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.46 1.504 . . . . 0.0 112.352 -177.744 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.29 -37.98 84.28 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 120.839 -1.163 . . . . 0.0 112.882 171.312 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.2 t -57.68 -36.14 71.53 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 122.298 1.047 . . . . 0.0 111.848 173.467 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 92.0 mt -70.82 -35.21 59.21 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 O-C-N 120.828 -1.17 . . . . 0.0 110.565 177.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 97.2 mt -64.59 -36.99 78.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 123.633 0.773 . . . . 0.0 112.189 169.096 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 67.2 mt-10 -65.37 -47.03 77.82 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 119.777 1.172 . . . . 0.0 113.276 177.833 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -151.99 -8.35 0.21 Allowed 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 -165.417 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 87.88 159.81 34.89 Favored Glycine 0 CA--C 1.524 0.619 0 CA-C-O 122.47 1.039 . . . . 0.0 111.799 -172.689 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.484 ' HG2' HD11 ' A' ' 53' ' ' ILE . 39.5 tt0 -66.97 -28.53 68.34 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 -165.508 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -61.45 -25.55 67.3 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 113.828 1.048 . . . . 0.0 113.828 173.041 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 80.7 m-70 -96.71 18.06 15.17 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 120.646 1.567 . . . . 0.0 110.571 -177.116 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 5.9 m -146.99 14.27 1.15 Allowed 'General case' 0 N--CA 1.442 -0.863 0 N-CA-C 115.819 1.785 . . . . 0.0 115.819 -156.045 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLY . . . . . 0.846 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -69.93 -27.44 73.09 Favored Glycine 0 N--CA 1.474 1.194 0 CA-C-N 122.12 2.236 . . . . 0.0 116.809 -174.012 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 43.4 p-80 -54.54 -26.18 30.35 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 120.811 2.305 . . . . 0.0 113.833 163.595 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.17 -35.52 36.38 Favored 'General case' 0 CA--C 1.518 -0.262 0 C-N-CA 123.476 0.711 . . . . 0.0 110.968 173.88 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.846 HD12 ' HA2' ' A' ' 50' ' ' GLY . 15.5 mt -71.69 -38.23 65.72 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 CA-C-O 119.42 -0.324 . . . . 0.0 110.697 177.341 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.412 ' HG3' ' HE3' ' A' ' 57' ' ' LYS . 1.1 mp0 -73.53 -52.35 13.85 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 125.985 1.714 . . . . 0.0 114.619 -178.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -56.29 -35.68 67.76 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 122.005 0.907 . . . . 0.0 112.042 174.117 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 9.5 t60 -68.71 -48.41 63.91 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 113.589 0.959 . . . . 0.0 113.589 173.029 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.412 ' HE3' ' HG3' ' A' ' 54' ' ' GLU . 2.3 mtmt -46.99 -53.07 13.21 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.543 1.137 . . . . 0.0 111.395 172.008 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -65.15 -39.79 93.48 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.154 0.981 . . . . 0.0 112.101 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 18.8 t -54.21 -50.92 66.01 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 123.592 0.757 . . . . 0.0 112.149 172.623 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 71.0 mtm -60.15 -46.83 88.33 Favored 'General case' 0 N--CA 1.48 1.032 0 O-C-N 120.819 -1.176 . . . . 0.0 111.528 169.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 1.5 mtt180 -61.56 -25.82 67.56 Favored 'General case' 0 CA--C 1.53 0.197 0 O-C-N 119.943 -1.723 . . . . 0.0 113.641 -175.434 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -46.88 -33.0 4.16 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 124.724 1.21 . . . . 0.0 113.362 167.778 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.9 mp -81.74 9.65 7.54 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-O 121.64 0.733 . . . . 0.0 112.598 -174.434 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 71.2 25.89 74.69 Favored Glycine 0 CA--C 1.532 1.143 0 C-N-CA 125.947 1.737 . . . . 0.0 112.179 -169.426 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.457 ' CE2' ' HB2' ' A' ' 29' ' ' ALA . 0.1 OUTLIER -74.47 147.12 42.21 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 126.034 1.733 . . . . 0.0 112.22 -162.388 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.35 77.94 3.11 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.991 1.316 . . . . 0.0 110.619 -175.794 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.107 0 C-N-CA 128.527 2.731 . . . . 0.0 108.042 179.07 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.329 0 N-CA-C 107.908 -2.077 . . . . 0.0 107.908 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.3 m -56.39 157.24 5.16 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 118.503 1.151 . . . . 0.0 111.917 165.154 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -155.11 171.37 19.89 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.929 1.291 . . . . 0.0 110.219 173.513 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.446 HG22 ' H ' ' A' ' 5' ' ' MET . 6.6 m 66.48 171.6 0.24 Allowed 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 125.647 1.579 . . . . 0.0 112.052 -175.556 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.446 ' H ' HG22 ' A' ' 4' ' ' THR . 22.3 ptm -132.9 58.37 35.08 Favored Pre-proline 0 CA--C 1.547 0.845 0 C-N-CA 125.032 1.333 . . . . 0.0 112.181 -178.828 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -77.33 -5.47 15.68 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 123.427 2.751 . . . . 0.0 114.471 -177.506 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -77.56 42.6 2.0 Favored Glycine 0 N--CA 1.474 1.226 0 C-N-CA 124.854 1.216 . . . . 0.0 114.368 -176.099 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 8.3 mp -123.89 136.18 54.18 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 126.312 1.845 . . . . 0.0 109.385 -172.332 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 18.9 t 40.78 77.06 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 126.062 1.745 . . . . 0.0 114.763 158.136 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -51.51 150.62 3.58 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.941 1.696 . . . . 0.0 114.683 175.207 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.8 p -50.39 53.41 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 130.981 3.712 . . . . 0.0 115.126 157.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -128.55 73.27 80.69 Favored Pre-proline 0 CA--C 1.539 0.543 0 O-C-N 120.448 -1.407 . . . . 0.0 110.53 -159.654 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_endo -76.65 -160.37 0.11 Allowed 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 125.008 3.805 . . . . 0.0 112.607 -173.514 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -137.95 159.74 67.31 Favored Pre-proline 0 CA--C 1.547 0.834 0 C-N-CA 126.83 2.052 . . . . 0.0 109.687 165.203 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -68.52 164.74 31.7 Favored 'Trans proline' 0 CA--C 1.545 1.04 0 C-N-CA 122.27 1.98 . . . . 0.0 111.739 167.089 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -68.27 -176.91 1.21 Allowed 'Trans proline' 0 CA--C 1.537 0.637 0 C-N-CA 122.688 2.259 . . . . 0.0 111.487 160.797 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -58.13 146.25 33.98 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 122.665 1.221 . . . . 0.0 113.25 165.728 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 18.4 m 179.34 165.95 1.02 Allowed 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 128.778 2.831 . . . . 0.0 108.715 -178.091 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -154.09 143.18 21.23 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.167 -0.958 . . . . 0.0 112.108 178.048 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -138.22 149.39 45.74 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 124.641 1.176 . . . . 0.0 110.281 158.019 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -78.58 28.97 0.2 Allowed 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.654 1.582 . . . . 0.0 113.107 -179.872 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 29.5 mttt -70.39 168.41 19.42 Favored Pre-proline 0 N--CA 1.472 0.643 0 C-N-CA 127.967 2.507 . . . . 0.0 114.281 -172.07 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -82.38 162.9 17.21 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.806 2.338 . . . . 0.0 111.285 163.093 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.58 ' CD1' ' H ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -77.25 163.69 26.27 Favored 'General case' 0 CA--C 1.552 1.047 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.835 167.347 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.58 ' H ' ' CD1' ' A' ' 24' ' ' LEU . 12.5 ptmm? -139.53 128.77 13.87 Favored Pre-proline 0 CA--C 1.536 0.429 0 C-N-CA 130.293 3.437 . . . . 0.0 105.846 178.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -57.93 -40.09 80.97 Favored 'Trans proline' 0 CA--C 1.538 0.704 0 C-N-CA 123.864 3.043 . . . . 0.0 114.288 -152.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 28.7 p -60.62 -25.92 66.62 Favored 'General case' 0 CA--C 1.557 1.249 0 C-N-CA 125.754 1.621 . . . . 0.0 113.91 178.736 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 90.2 m -95.82 -7.44 36.98 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 126.0 1.72 . . . . 0.0 114.079 179.109 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.403 ' HB2' ' CE2' ' A' ' 65' ' ' PHE . . . -66.19 147.74 52.87 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 121.467 -0.771 . . . . 0.0 110.436 -175.288 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 33.5 m 42.66 59.78 10.47 Favored Pre-proline 0 CA--C 1.549 0.937 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -171.005 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -63.9 -29.9 67.49 Favored 'Trans proline' 0 CA--C 1.537 0.669 0 C-N-CA 122.843 2.362 . . . . 0.0 111.745 -170.401 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.487 ' HG3' ' H ' ' A' ' 33' ' ' THR . 0.3 OUTLIER -39.81 -69.76 0.12 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 127.064 2.146 . . . . 0.0 114.842 161.413 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.487 ' H ' ' HG3' ' A' ' 32' ' ' GLU . 0.0 OUTLIER -74.43 -23.74 58.97 Favored 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 124.939 1.296 . . . . 0.0 111.464 -178.842 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 4.7 tmtt? -58.31 -49.62 76.52 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 119.797 1.18 . . . . 0.0 111.207 167.347 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.1 tmtp? -62.52 -43.66 98.27 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.454 0.702 . . . . 0.0 111.309 177.355 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.44 -42.23 95.66 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 113.182 0.808 . . . . 0.0 113.182 174.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 8.1 ttp85 -59.8 -52.79 63.97 Favored 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 125.639 1.576 . . . . 0.0 110.326 174.695 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 61.8 m-20 -65.06 -32.14 73.71 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.63 0.772 . . . . 0.0 112.862 179.58 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -65.85 -36.37 83.27 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 120.781 -1.199 . . . . 0.0 113.015 170.762 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 11.3 t -59.62 -44.04 93.59 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 121.921 0.867 . . . . 0.0 111.121 168.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 58.4 mt -68.91 -32.5 54.87 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 C-N-CA 124.263 1.025 . . . . 0.0 110.966 -178.604 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 35.4 mt -60.82 -39.71 82.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 124.1 0.96 . . . . 0.0 112.328 167.514 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -70.26 -44.5 68.32 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 177.061 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.44 ' HG3' ' HB2' ' A' ' 48' ' ' HIS . 0.0 OUTLIER -140.37 -10.41 1.09 Allowed 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 117.133 2.271 . . . . 0.0 117.133 -165.477 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.25 175.96 49.35 Favored Glycine 0 CA--C 1.533 1.202 0 CA-C-N 119.203 0.911 . . . . 0.0 113.252 -165.757 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -83.81 -30.44 26.55 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 115.065 1.505 . . . . 0.0 115.065 -156.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -62.86 -32.61 73.88 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.079 0.952 . . . . 0.0 113.567 174.263 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' HIS . . . . . 0.44 ' HB2' ' HG3' ' A' ' 44' ' ' LYS . 95.1 m-70 -85.16 12.22 8.32 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.792 1.237 . . . . 0.0 112.595 -178.503 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 9.7 m -138.41 13.51 2.78 Favored 'General case' 0 N--CA 1.445 -0.701 0 C-N-CA 125.592 1.557 . . . . 0.0 114.354 -163.523 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLY . . . . . 0.406 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -62.77 -33.37 86.67 Favored Glycine 0 C--O 1.216 -1.029 0 CA-C-O 117.844 -1.531 . . . . 0.0 115.728 -176.927 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 41.1 p-80 -55.95 -29.97 60.98 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 121.095 2.447 . . . . 0.0 113.415 168.13 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.35 -33.45 42.96 Favored 'General case' 0 CA--C 1.519 -0.219 0 C-N-CA 124.428 1.091 . . . . 0.0 110.76 173.505 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.406 HD12 ' HA2' ' A' ' 50' ' ' GLY . 37.1 mt -72.51 -37.74 57.88 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.564 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 177.354 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -72.37 -53.07 13.37 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.818 1.647 . . . . 0.0 114.239 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.08 -31.95 53.36 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 118.951 0.796 . . . . 0.0 112.834 174.71 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 10.5 t60 -74.12 -51.13 16.59 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.719 1.608 . . . . 0.0 113.986 170.641 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -48.52 -54.44 14.36 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 125.346 1.459 . . . . 0.0 110.378 176.17 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -61.22 -39.03 88.77 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.526 0.73 . . . . 0.0 112.204 -177.329 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 34.5 t -53.64 -48.43 69.37 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 124.231 1.013 . . . . 0.0 113.122 169.402 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 23.8 mtp -62.87 -53.06 59.99 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 125.468 1.507 . . . . 0.0 110.389 172.465 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.409 ' HG3' ' HB ' ' A' ' 67' ' ' ILE . 22.1 mtp85 -52.52 -33.91 47.35 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 127.977 2.511 . . . . 0.0 115.21 -176.64 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -42.88 -35.07 1.08 Allowed 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.841 1.257 . . . . 0.0 114.025 167.45 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.2 mp -81.14 5.48 16.65 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.383 1.073 . . . . 0.0 112.784 -173.279 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.73 15.58 70.25 Favored Glycine 0 CA--C 1.536 1.352 0 C-N-CA 125.94 1.733 . . . . 0.0 112.797 -169.718 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.403 ' CE2' ' HB2' ' A' ' 29' ' ' ALA . 0.1 OUTLIER -75.09 142.92 43.61 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.946 2.098 . . . . 0.0 112.353 -168.591 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.1 mppt? -92.9 82.73 4.68 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.138 1.375 . . . . 0.0 108.909 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.409 ' HB ' ' HG3' ' A' ' 61' ' ' ARG . 4.3 mm . . . . . 0 C--O 1.254 1.328 0 C-N-CA 131.11 3.764 . . . . 0.0 107.801 -165.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.407 0 N-CA-C 109.476 -1.45 . . . . 0.0 109.476 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 24.2 p -155.78 -42.34 0.08 Allowed 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.146 0.979 . . . . 0.0 112.148 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 -130.54 171.91 12.5 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 125.828 1.651 . . . . 0.0 109.875 179.367 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 8.5 m -153.55 -45.71 0.09 Allowed 'General case' 0 N--CA 1.483 1.22 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 174.584 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.441 ' HG3' HD23 ' A' ' 8' ' ' LEU . 25.0 tpp 33.08 68.58 0.96 Allowed Pre-proline 0 N--CA 1.483 1.213 0 C-N-CA 125.531 1.532 . . . . 0.0 114.684 -172.998 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -80.39 42.43 1.32 Allowed 'Trans proline' 0 CA--C 1.548 1.22 0 C-N-CA 122.273 1.982 . . . . 0.0 112.296 176.381 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -130.78 -64.91 0.1 OUTLIER Glycine 0 N--CA 1.472 1.085 0 C-N-CA 124.261 0.934 . . . . 0.0 112.319 176.734 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.441 HD23 ' HG3' ' A' ' 5' ' ' MET . 7.3 mt 57.19 -144.85 0.63 Allowed 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.338 1.055 . . . . 0.0 112.338 173.943 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 25.6 t 70.82 -14.41 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 127.79 2.436 . . . . 0.0 116.689 165.46 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 26.95 46.26 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.955 1 C-N-CA 131.778 4.031 . . . . 0.0 116.67 158.417 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 4.7 t -161.33 -152.23 0.25 Allowed 'General case' 0 CA--C 1.543 0.675 0 O-C-N 120.596 -1.315 . . . . 0.0 112.314 -169.177 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 63.85 64.3 1.33 Allowed Pre-proline 0 CA--C 1.548 0.879 0 C-N-CA 127.08 2.152 . . . . 0.0 112.027 -171.731 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_endo -73.38 -179.75 4.73 Favored 'Trans proline' 0 CA--C 1.543 0.943 0 C-N-CA 123.851 3.034 . . . . 0.0 111.684 176.794 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -145.38 162.09 38.54 Favored Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 125.659 1.583 . . . . 0.0 111.35 -176.207 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -68.93 154.69 70.45 Favored 'Trans proline' 0 CA--C 1.547 1.146 0 C-N-CA 122.807 2.338 . . . . 0.0 112.418 169.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -81.82 -179.37 4.77 Favored 'Trans proline' 0 CA--C 1.542 0.916 0 C-N-CA 124.113 3.209 . . . . 0.0 113.703 175.279 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -74.78 -172.07 1.47 Allowed 'General case' 0 CA--C 1.557 1.236 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.514 155.356 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.2 m -51.51 159.83 0.68 Allowed 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 115.381 1.622 . . . . 0.0 115.381 176.179 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -126.73 -3.33 6.58 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 115.343 -0.844 . . . . 0.0 113.121 166.64 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -60.21 -179.02 0.09 Allowed 'General case' 0 CA--C 1.54 0.592 0 O-C-N 120.646 -1.284 . . . . 0.0 112.155 162.455 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -74.44 52.5 0.49 Allowed 'General case' 0 CA--C 1.542 0.654 0 O-C-N 120.21 -1.556 . . . . 0.0 113.706 171.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 10.8 mptt -65.43 166.25 14.85 Favored Pre-proline 0 CA--C 1.545 0.781 0 C-N-CA 125.522 1.529 . . . . 0.0 111.17 160.407 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -79.94 -174.93 2.46 Favored 'Trans proline' 0 N--CA 1.459 -0.511 0 C-N-CA 123.051 2.5 . . . . 0.0 111.299 160.12 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.418 HD23 ' H ' ' A' ' 25' ' ' LYS . 0.8 OUTLIER -127.33 156.74 41.5 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.567 170.149 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.418 ' H ' HD23 ' A' ' 24' ' ' LEU . 26.2 mtmm -93.49 143.04 25.99 Favored Pre-proline 0 CA--C 1.535 0.393 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 177.655 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_endo -71.88 -9.99 25.58 Favored 'Trans proline' 0 CA--C 1.535 0.571 0 C-N-CA 123.492 2.795 . . . . 0.0 113.165 -175.36 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . 0.251 22.2 p -101.03 -40.7 7.1 Favored 'General case' 0 N--CA 1.44 -0.956 0 C-N-CA 127.722 2.409 . . . . 0.0 111.063 179.735 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.425 ' HA ' ' HE3' ' A' ' 34' ' ' LYS . 64.4 m -97.7 -10.88 24.18 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 115.979 1.844 . . . . 0.0 115.979 -173.547 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.88 149.47 14.9 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 119.716 1.144 . . . . 0.0 110.047 162.835 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 83.6 m 52.4 54.27 13.51 Favored Pre-proline 0 CA--C 1.552 1.034 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -178.134 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -73.59 -5.47 17.14 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 123.169 2.579 . . . . 0.0 112.694 -162.795 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -101.37 -40.51 7.07 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 125.058 1.343 . . . . 0.0 112.521 -177.187 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.3 p -60.8 -34.62 74.78 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-O 117.765 -1.112 . . . . 0.0 110.278 157.664 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.425 ' HE3' ' HA ' ' A' ' 28' ' ' CYS . 2.0 ttmt -58.21 -54.86 42.26 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 119.598 1.09 . . . . 0.0 112.244 169.111 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.76 -49.22 58.64 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.819 0.847 . . . . 0.0 112.135 176.621 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.19 -37.05 84.66 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 114.674 -1.148 . . . . 0.0 113.268 176.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.408 ' CG ' HG13 ' A' ' 53' ' ' ILE . 3.4 ttp180 -58.1 -56.03 27.36 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.142 1.377 . . . . 0.0 109.126 173.632 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -65.41 -37.15 86.09 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.423 1.489 . . . . 0.0 111.265 -173.828 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.25 -43.4 98.11 Favored 'General case' 0 CA--C 1.545 0.788 0 O-C-N 120.983 -1.073 . . . . 0.0 113.255 170.381 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -58.74 -34.21 71.13 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.177 -0.952 . . . . 0.0 111.232 172.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 81.8 mt -75.55 -35.53 32.26 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 O-C-N 120.911 -1.118 . . . . 0.0 111.642 177.22 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 70.2 mt -62.29 -34.18 62.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 124.309 1.044 . . . . 0.0 111.587 169.325 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.426 ' HB3' ' HD2' ' A' ' 44' ' ' LYS . 45.9 mt-10 -70.87 -41.57 71.22 Favored 'General case' 0 CA--C 1.555 1.159 0 N-CA-C 114.183 1.179 . . . . 0.0 114.183 177.02 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.426 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -150.58 -11.59 0.24 Allowed 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 117.586 2.439 . . . . 0.0 117.586 -170.633 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 86.13 159.96 33.29 Favored Glycine 0 CA--C 1.534 1.266 0 CA-C-N 119.224 0.92 . . . . 0.0 112.525 -161.772 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -73.2 -33.97 65.7 Favored 'General case' 0 C--N 1.337 0.065 0 O-C-N 120.741 -1.446 . . . . 0.0 113.623 -166.397 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -53.82 -36.83 62.93 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.782 0.833 . . . . 0.0 112.534 176.583 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 79.8 m-70 -87.55 12.45 12.41 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.6 1.56 . . . . 0.0 112.937 178.375 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -146.38 5.08 0.93 Allowed 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.863 1.665 . . . . 0.0 113.831 -170.312 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLY . . . . . 0.403 ' HA2' ' CD1' ' A' ' 53' ' ' ILE . . . -60.73 -14.55 37.15 Favored Glycine 0 N--CA 1.474 1.178 0 N-CA-C 118.69 2.236 . . . . 0.0 118.69 -160.216 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 30.2 p-80 -55.3 -36.27 66.01 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 121.08 2.44 . . . . 0.0 112.87 164.434 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.41 -42.24 96.18 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 125.157 1.383 . . . . 0.0 110.75 172.402 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.408 HG13 ' CG ' ' A' ' 37' ' ' ARG . 4.2 mp -72.9 -37.98 55.57 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.344 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.177 -178.427 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.475 ' HA ' ' HE3' ' A' ' 57' ' ' LYS . 3.5 mm-40 -64.85 -52.65 55.51 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 123.511 0.725 . . . . 0.0 112.557 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.76 -39.97 86.63 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.628 0.771 . . . . 0.0 112.61 177.807 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 16.1 t60 -65.81 -48.13 72.77 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 123.438 0.695 . . . . 0.0 112.576 174.856 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.475 ' HE3' ' HA ' ' A' ' 54' ' ' GLU . 1.6 mtmp? -52.56 -46.47 66.84 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-O 118.968 -0.539 . . . . 0.0 111.669 171.467 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -65.15 -37.6 87.91 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 123.895 0.878 . . . . 0.0 112.793 177.862 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 49.7 t -56.97 -52.82 63.7 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 118.795 0.725 . . . . 0.0 111.912 169.367 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 77.6 mtm -56.94 -48.93 77.15 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.32 1.048 . . . . 0.0 111.714 173.018 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.531 ' HE ' ' C ' ' A' ' 67' ' ' ILE . 11.5 mtt-85 -56.49 -30.3 62.81 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.26 1.824 . . . . 0.0 114.374 -176.474 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -46.26 -31.61 2.61 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.166 0.986 . . . . 0.0 113.284 167.518 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.2 mp -84.47 4.75 30.29 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 123.802 0.841 . . . . 0.0 112.364 -173.347 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.58 19.35 71.3 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 124.507 1.051 . . . . 0.0 112.547 -168.399 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -74.94 141.74 44.03 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 126.607 1.963 . . . . 0.0 110.601 178.197 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.5 mppt? -100.15 76.8 1.93 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 125.077 1.351 . . . . 0.0 109.593 -171.371 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.531 ' C ' ' HE ' ' A' ' 61' ' ' ARG . 0.2 OUTLIER . . . . . 0 C--O 1.248 0.99 0 CA-C-O 116.913 -1.518 . . . . 0.0 111.076 -171.28 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.385 0 N-CA-C 108.614 -1.794 . . . . 0.0 108.614 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.6 m -141.24 138.71 33.45 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.308 1.043 . . . . 0.0 108.746 -173.208 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 45.8 m-85 -142.26 35.74 1.52 Allowed 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.235 0.614 . . . . 0.0 111.748 -159.415 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -139.05 143.28 38.3 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.353 1.061 . . . . 0.0 110.339 -165.852 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 12.3 tpt -128.12 70.24 78.33 Favored Pre-proline 0 CA--C 1.543 0.674 0 C-N-CA 124.537 1.135 . . . . 0.0 110.482 179.838 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -68.36 2.65 2.64 Favored 'Trans proline' 0 CA--C 1.543 0.948 0 C-N-CA 123.963 3.109 . . . . 0.0 115.904 -172.315 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -160.04 137.83 5.25 Favored Glycine 0 CA--C 1.53 0.997 0 C-N-CA 124.604 1.097 . . . . 0.0 110.531 170.26 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -168.02 171.87 9.31 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.924 1.689 . . . . 0.0 110.854 -173.212 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 10.7 p -149.29 155.9 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 C-N-CA 125.489 1.516 . . . . 0.0 109.527 177.449 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -62.5 137.88 58.35 Favored 'General case' 0 CA--C 1.548 0.87 0 O-C-N 121.567 -0.708 . . . . 0.0 111.415 172.302 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 58.7 m -82.35 136.57 34.97 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 121.563 -0.711 . . . . 0.0 112.025 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -138.4 71.65 45.37 Favored Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 124.594 1.158 . . . . 0.0 111.092 -174.396 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -73.88 128.65 12.6 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 123.177 2.585 . . . . 0.0 110.731 -176.662 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -148.8 161.57 32.45 Favored Pre-proline 0 CA--C 1.545 0.776 0 C-N-CA 126.314 1.846 . . . . 0.0 111.348 -177.312 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -72.11 151.44 55.47 Favored 'Trans proline' 0 CA--C 1.546 1.115 0 C-N-CA 122.515 2.144 . . . . 0.0 112.263 168.833 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -76.65 178.97 6.92 Favored 'Trans proline' 0 CA--C 1.537 0.666 0 C-N-CA 123.438 2.759 . . . . 0.0 112.183 164.692 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -91.01 -46.15 8.31 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.657 1.583 . . . . 0.0 112.351 170.146 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 58.3 m -169.94 -23.72 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 128.099 2.56 . . . . 0.0 114.62 -177.78 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 35.83 51.36 0.71 Allowed 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 128.256 2.622 . . . . 0.0 113.42 -175.677 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 5.0 tm-20 -90.88 -171.17 2.92 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.065 1.346 . . . . 0.0 112.466 -166.827 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 8.7 mtmp? -71.98 51.54 0.22 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 126.927 2.091 . . . . 0.0 113.3 -179.063 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 7.7 mtpp -100.99 152.83 37.95 Favored Pre-proline 0 N--CA 1.476 0.848 0 C-N-CA 124.5 1.12 . . . . 0.0 112.547 -164.269 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -74.88 176.86 9.31 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.337 2.025 . . . . 0.0 111.402 165.211 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.502 HD22 ' HB2' ' A' ' 29' ' ' ALA . 1.6 mt -135.51 165.49 25.39 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-O 122.294 1.045 . . . . 0.0 113.604 174.939 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.1 mtpt -122.79 136.59 26.91 Favored Pre-proline 0 N--CA 1.464 0.233 0 C-N-CA 127.541 2.337 . . . . 0.0 106.24 174.041 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -64.48 -42.3 17.23 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 C-N-CA 121.619 1.546 . . . . 0.0 111.016 -172.153 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 29.4 p -58.9 -36.31 74.46 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 126.268 1.827 . . . . 0.0 113.257 176.05 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 93.3 m -90.68 -10.45 43.11 Favored 'General case' 0 CA--C 1.554 1.097 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 177.728 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.502 ' HB2' HD22 ' A' ' 24' ' ' LEU . . . -80.76 -31.85 35.75 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 114.582 1.327 . . . . 0.0 114.582 -175.859 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 3.4 m -124.23 61.79 27.81 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 127.892 2.477 . . . . 0.0 110.441 168.362 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_endo -71.3 -18.17 30.34 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 122.634 2.223 . . . . 0.0 112.355 -170.268 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 36.9 mm-40 -81.57 -40.41 23.09 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.132 1.373 . . . . 0.0 112.554 -176.613 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.0 p -70.02 -30.45 67.75 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 120.879 -1.138 . . . . 0.0 111.741 161.946 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 10.1 tmtt? -58.85 -44.78 91.08 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 120.551 1.523 . . . . 0.0 112.201 170.486 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.1 mttt -52.95 -51.66 60.66 Favored 'General case' 0 C--O 1.223 -0.3 0 C-N-CA 127.52 2.328 . . . . 0.0 111.243 172.021 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.32 -37.77 80.91 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 178.942 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 6.5 ttp85 -57.95 -51.9 67.73 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.705 1.202 . . . . 0.0 109.566 174.83 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -73.25 -30.14 63.25 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.11 0.964 . . . . 0.0 113.14 -178.189 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.26 -39.27 92.35 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 120.644 -1.285 . . . . 0.0 111.946 167.103 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.8 t -60.35 -32.88 71.68 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 122.45 1.119 . . . . 0.0 112.322 172.6 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 70.4 mt -75.84 -33.83 26.55 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 124.528 1.131 . . . . 0.0 111.807 176.863 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 88.5 mt -66.34 -34.53 70.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 124.564 1.146 . . . . 0.0 111.724 168.318 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -71.18 -38.86 72.12 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 174.705 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.9 mppt? -140.87 -59.17 0.51 Allowed 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.384 1.473 . . . . 0.0 113.944 -177.027 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 137.54 160.73 8.66 Favored Glycine 0 CA--C 1.533 1.181 0 C-N-CA 126.144 1.83 . . . . 0.0 109.659 -158.019 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -73.8 -29.51 62.21 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 119.219 1.51 . . . . 0.0 112.529 -168.77 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 22.9 pt-20 -58.36 -34.02 70.21 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 123.274 0.63 . . . . 0.0 112.204 179.732 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 98.5 m-70 -82.71 5.4 21.43 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.136 1.374 . . . . 0.0 113.148 177.764 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 4.3 m -145.52 20.28 1.51 Allowed 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 125.541 1.536 . . . . 0.0 112.258 -154.873 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLY . . . . . 0.581 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -70.3 -17.0 73.81 Favored Glycine 0 C--O 1.219 -0.784 0 O-C-N 120.131 -1.606 . . . . 0.0 115.306 177.211 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 41.5 p-80 -61.17 -30.44 70.41 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 120.213 2.007 . . . . 0.0 112.35 161.196 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -80.29 -35.21 36.16 Favored 'General case' 0 C--O 1.232 0.177 0 C-N-CA 124.225 1.01 . . . . 0.0 111.073 174.637 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.655 HG22 ' HD3' ' A' ' 57' ' ' LYS . 10.4 mt -66.38 -42.47 90.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 CA-C-O 118.105 -0.95 . . . . 0.0 109.79 173.118 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.57 -53.96 49.41 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 118.526 0.603 . . . . 0.0 111.655 178.618 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.94 -39.27 68.7 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 120.952 -1.092 . . . . 0.0 113.271 179.459 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 13.5 t60 -69.49 -41.98 75.38 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 124.987 1.315 . . . . 0.0 114.253 173.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.655 ' HD3' HG22 ' A' ' 53' ' ' ILE . 39.5 mtpt -56.29 -52.7 63.55 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.49 1.116 . . . . 0.0 111.795 175.255 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -61.9 -39.62 92.61 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 123.093 0.557 . . . . 0.0 111.718 177.813 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 49.4 t -48.92 -59.74 3.34 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-O 118.709 -0.662 . . . . 0.0 111.503 170.28 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 74.2 mtm -56.43 -50.81 70.58 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.173 0.989 . . . . 0.0 111.763 174.663 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 74.3 mtt180 -54.04 -33.03 56.23 Favored 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 120.232 -1.542 . . . . 0.0 113.941 -174.707 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.528 ' HB3' HD12 ' A' ' 63' ' ' LEU . . . -44.19 -42.8 6.71 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.864 1.266 . . . . 0.0 113.837 166.874 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.528 HD12 ' HB3' ' A' ' 62' ' ' ALA . 1.4 mp -79.25 9.12 4.9 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.432 1.493 . . . . 0.0 111.777 -173.295 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 82.38 16.7 70.7 Favored Glycine 0 CA--C 1.532 1.135 0 C-N-CA 124.42 1.009 . . . . 0.0 113.636 -173.328 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -65.39 164.61 13.4 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 119.091 1.445 . . . . 0.0 112.385 -178.059 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.02 97.87 5.44 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 120.449 -1.407 . . . . 0.0 109.64 -177.838 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.15 0 C-N-CA 129.742 3.217 . . . . 0.0 107.735 -169.014 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.313 0 N-CA-C 105.557 -3.017 . . . . 0.0 105.557 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.6 m -50.15 157.72 0.63 Allowed 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 117.266 0.533 . . . . 0.0 110.751 140.38 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 37.4 p90 -159.66 -178.0 6.78 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.277 1.831 . . . . 0.0 109.331 179.285 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.2 m -135.94 148.53 48.56 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.679 0.791 . . . . 0.0 109.022 172.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 20.3 ptm -141.03 58.82 9.76 Favored Pre-proline 0 CA--C 1.546 0.799 0 C-N-CA 123.98 0.912 . . . . 0.0 113.146 -174.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -71.39 7.42 1.49 Allowed 'Trans proline' 0 CA--C 1.547 1.14 0 C-N-CA 123.914 3.076 . . . . 0.0 115.898 -170.793 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -82.83 41.19 2.84 Favored Glycine 0 CA--C 1.535 1.297 0 CA-C-N 119.876 1.216 . . . . 0.0 114.551 -175.078 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 5.9 mp -116.04 156.32 26.55 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 125.579 1.552 . . . . 0.0 112.7 -169.232 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 9.2 p -158.81 167.86 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 C-N-CA 127.1 2.16 . . . . 0.0 108.817 176.386 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -136.98 151.96 49.59 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.724 1.21 . . . . 0.0 109.598 165.18 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.9 t 54.39 -168.97 0.07 Allowed 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.854 1.661 . . . . 0.0 114.513 177.267 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -151.44 71.25 8.31 Favored Pre-proline 0 CA--C 1.544 0.741 0 C-N-CA 125.012 1.325 . . . . 0.0 109.914 169.228 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -70.24 102.67 1.13 Allowed 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 123.645 2.896 . . . . 0.0 111.766 -179.734 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -153.39 159.92 31.56 Favored Pre-proline 0 CA--C 1.544 0.716 0 C-N-CA 125.567 1.547 . . . . 0.0 112.053 -176.329 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -72.39 163.64 38.0 Favored 'Trans proline' 0 CA--C 1.546 1.084 0 C-N-CA 122.639 2.226 . . . . 0.0 111.168 161.41 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -76.01 176.84 9.51 Favored 'Trans proline' 0 CA--C 1.536 0.597 0 C-N-CA 122.699 2.266 . . . . 0.0 112.263 165.616 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -136.74 164.98 26.99 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.597 1.959 . . . . 0.0 111.545 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 93.9 p -53.43 151.21 5.79 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.313 1.845 . . . . 0.0 113.112 168.026 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.26 146.16 48.3 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 123.776 0.831 . . . . 0.0 110.526 173.361 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.05 -164.54 0.14 Allowed 'General case' 0 CA--C 1.543 0.677 0 CA-C-O 122.0 0.905 . . . . 0.0 111.029 168.969 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.21 45.79 1.09 Allowed 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.798 2.039 . . . . 0.0 109.208 178.971 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 26.1 mttp -145.84 167.84 13.24 Favored Pre-proline 0 N--CA 1.469 0.521 0 C-N-CA 126.364 1.865 . . . . 0.0 113.636 -165.29 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -63.15 109.53 0.98 Allowed 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 122.074 1.849 . . . . 0.0 107.716 158.755 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.814 HD12 ' H ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER 55.67 -162.56 0.16 Allowed 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 124.558 1.143 . . . . 0.0 112.591 -171.896 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.814 ' H ' HD12 ' A' ' 24' ' ' LEU . 5.4 ptmt -135.69 149.46 69.09 Favored Pre-proline 0 CA--C 1.543 0.683 1 C-N-CA 132.129 4.172 . . . . 0.0 106.038 169.122 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -71.15 -13.89 31.4 Favored 'Trans proline' 0 CA--C 1.535 0.558 0 C-N-CA 123.887 3.058 . . . . 0.0 115.168 -166.499 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.54 ' SG ' ' HE2' ' A' ' 25' ' ' LYS . 20.6 p -97.12 -33.92 11.33 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 126.74 2.016 . . . . 0.0 111.863 -174.313 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 99.0 m -87.43 -15.9 36.39 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.001 1.321 . . . . 0.0 114.051 177.249 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.36 142.85 30.65 Favored 'General case' 0 CA--C 1.533 0.291 0 O-C-N 121.738 -0.601 . . . . 0.0 111.902 -177.536 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 9.1 m 46.88 60.68 14.63 Favored Pre-proline 0 CA--C 1.548 0.886 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -173.947 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -66.63 -19.62 53.87 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.792 2.328 . . . . 0.0 111.555 -165.231 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.6 mm-40 -75.12 -49.3 20.04 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 125.951 1.701 . . . . 0.0 112.369 -179.143 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.7 p -69.09 -26.21 64.81 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 118.334 -0.841 . . . . 0.0 112.034 166.887 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 10.3 tmtt? -61.51 -50.96 70.61 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 119.969 1.259 . . . . 0.0 111.405 170.433 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 25.6 ttpt -54.22 -48.2 71.31 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 127.666 2.386 . . . . 0.0 111.485 172.754 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.74 -41.49 98.03 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 176.275 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 4.1 ttp180 -58.85 -55.59 33.11 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.736 1.214 . . . . 0.0 109.385 174.344 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -61.19 -37.32 82.51 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.169 1.388 . . . . 0.0 112.858 -179.081 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.65 -35.77 79.5 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.081 -1.012 . . . . 0.0 112.89 172.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.9 t -59.16 -41.59 88.74 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.339 -0.85 . . . . 0.0 111.298 170.488 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 78.5 mt -70.27 -31.36 46.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 C-N-CA 124.899 1.28 . . . . 0.0 111.267 -178.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 60.7 mt -60.56 -44.34 96.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 CA-C-N 118.765 0.712 . . . . 0.0 111.185 165.653 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -71.3 -35.18 71.18 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 115.218 1.562 . . . . 0.0 115.218 -174.563 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.4 -10.49 0.48 Allowed 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 117.061 2.245 . . . . 0.0 117.061 -177.7 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 84.63 172.25 48.9 Favored Glycine 0 CA--C 1.531 1.087 0 CA-C-N 119.367 0.985 . . . . 0.0 112.052 -165.612 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.46 ' CG ' HD11 ' A' ' 53' ' ' ILE . 45.3 tt0 -81.75 -35.54 29.54 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 114.981 1.475 . . . . 0.0 114.981 -159.198 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -55.05 -37.25 66.47 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 174.587 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -80.36 5.84 13.77 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.2 1.4 . . . . 0.0 113.008 -179.244 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 2.3 m -137.17 18.0 2.98 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 125.846 1.658 . . . . 0.0 113.589 -164.0 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLY . . . . . 0.826 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -75.99 -14.9 81.78 Favored Glycine 0 N--CA 1.467 0.742 0 O-C-N 119.706 -1.871 . . . . 0.0 117.52 -174.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 40.3 p-80 -59.3 -31.31 69.02 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.844 1.822 . . . . 0.0 112.321 157.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.19 -37.76 52.94 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 123.449 0.7 . . . . 0.0 109.923 177.162 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.826 HD12 ' HA2' ' A' ' 50' ' ' GLY . 14.7 mt -67.44 -40.73 85.12 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.358 0 CA-C-O 119.301 -0.381 . . . . 0.0 109.974 177.259 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -65.36 -54.33 30.38 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.209 1.004 . . . . 0.0 113.409 178.681 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -57.03 -35.6 69.47 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 119.008 0.822 . . . . 0.0 112.315 179.008 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 7.6 t60 -69.97 -47.36 62.6 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 173.661 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -50.32 -52.07 39.89 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 125.193 1.397 . . . . 0.0 112.051 177.331 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -66.4 -36.86 83.9 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.117 0.567 . . . . 0.0 111.964 -177.468 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 17.5 t -52.9 -56.02 18.96 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.522 0.729 . . . . 0.0 112.866 168.559 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 7.7 mtt -53.06 -52.2 59.32 Favored 'General case' 0 N--CA 1.487 1.387 0 CA-C-N 119.888 1.222 . . . . 0.0 110.983 170.438 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 30.3 mtt180 -55.42 -31.44 61.88 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 125.774 1.63 . . . . 0.0 114.69 -174.053 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -45.84 -36.29 5.13 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.338 1.055 . . . . 0.0 113.053 169.418 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.1 mp -80.5 4.26 18.88 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.559 1.143 . . . . 0.0 112.248 -172.311 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 94.62 4.39 62.14 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 125.546 1.546 . . . . 0.0 113.446 -171.466 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.462 ' C ' ' HE3' ' A' ' 66' ' ' LYS . 1.3 m-85 -70.64 150.41 46.04 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 126.353 1.861 . . . . 0.0 113.45 -171.833 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.462 ' HE3' ' C ' ' A' ' 65' ' ' PHE . 0.0 OUTLIER -114.32 76.67 1.0 Allowed 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.661 1.584 . . . . 0.0 108.893 -163.402 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.026 0 C-N-CA 127.395 2.278 . . . . 0.0 109.504 -173.356 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.447 0 N-CA-C 109.144 -1.582 . . . . 0.0 109.144 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 71.7 p -160.92 176.79 11.04 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.812 1.245 . . . . 0.0 110.701 -173.449 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 45.2 m-85 -51.94 142.85 14.76 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 153.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 4.3 m -150.89 150.38 30.81 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.807 1.243 . . . . 0.0 108.852 -177.044 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.7 tpt -132.03 73.19 78.47 Favored Pre-proline 0 N--CA 1.471 0.595 0 C-N-CA 124.367 1.067 . . . . 0.0 110.827 178.551 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -72.27 36.46 0.33 Allowed 'Trans proline' 0 CA--C 1.547 1.175 0 C-N-CA 124.243 3.295 . . . . 0.0 113.428 177.376 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -135.32 -87.79 0.26 Allowed Glycine 0 CA--C 1.53 0.973 0 O-C-N 121.584 -0.698 . . . . 0.0 114.054 176.686 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.7 mm? 51.41 -149.24 0.33 Allowed 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 117.365 0.582 . . . . 0.0 111.381 -157.259 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 75.1 t 65.54 41.67 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 CA-C-O 124.522 2.106 . . . . 0.0 110.74 167.515 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -38.5 131.84 1.2 Allowed 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 129.47 3.108 . . . . 0.0 115.082 -179.049 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.3 t -59.15 76.3 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 128.202 2.601 . . . . 0.0 114.407 -171.585 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -148.31 70.37 10.78 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 124.942 1.297 . . . . 0.0 110.575 -168.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_endo -78.99 -174.25 2.21 Favored 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 124.349 3.366 . . . . 0.0 110.909 170.306 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -137.32 156.52 75.2 Favored Pre-proline 0 CA--C 1.542 0.656 0 C-N-CA 124.547 1.139 . . . . 0.0 111.432 172.393 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -70.79 152.83 64.27 Favored 'Trans proline' 0 CA--C 1.543 0.944 0 C-N-CA 122.337 2.025 . . . . 0.0 110.978 165.477 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_endo -74.25 174.6 12.22 Favored 'Trans proline' 0 CA--C 1.536 0.584 0 C-N-CA 122.482 2.121 . . . . 0.0 111.884 169.49 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.04 142.54 36.44 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 161.606 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 16.6 p -54.18 135.03 44.45 Favored 'General case' 0 C--O 1.238 0.49 0 O-C-N 121.626 -0.671 . . . . 0.0 112.068 167.013 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -67.03 128.0 34.7 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 121.188 0.518 . . . . 0.0 111.02 174.488 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -158.25 176.12 12.87 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.069 1.348 . . . . 0.0 109.683 167.329 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.43 96.31 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 124.694 1.198 . . . . 0.0 112.387 160.344 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 2.0 tttt -161.05 163.18 21.09 Favored Pre-proline 0 N--CA 1.476 0.866 0 C-N-CA 125.477 1.511 . . . . 0.0 112.75 -177.127 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -84.48 179.05 4.67 Favored 'Trans proline' 0 N--CA 1.457 -0.632 0 C-N-CA 123.587 2.858 . . . . 0.0 110.699 149.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.583 HD23 ' H ' ' A' ' 25' ' ' LYS . 0.4 OUTLIER -100.14 160.39 14.36 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 114.86 -1.064 . . . . 0.0 110.595 172.384 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.583 ' H ' HD23 ' A' ' 24' ' ' LEU . 6.0 mtpt -89.01 141.19 29.31 Favored Pre-proline 0 N--CA 1.47 0.567 0 CA-C-O 117.539 -1.219 . . . . 0.0 108.03 178.393 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -79.32 -13.92 13.43 Favored 'Trans proline' 0 CA--C 1.548 1.187 0 C-N-CA 121.557 1.505 . . . . 0.0 111.684 -178.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.48 ' HA ' ' HE3' ' A' ' 34' ' ' LYS . 17.2 p -82.01 -20.83 37.61 Favored 'General case' 0 CA--C 1.557 1.237 0 C-N-CA 125.843 1.657 . . . . 0.0 111.734 175.156 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 90.8 m -119.06 -25.27 6.25 Favored 'General case' 0 CA--C 1.558 1.255 0 N-CA-C 115.457 1.651 . . . . 0.0 115.457 -178.241 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.58 154.98 30.95 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 120.981 -1.074 . . . . 0.0 110.6 177.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 42.6 m 44.54 50.21 6.77 Favored Pre-proline 0 CA--C 1.554 1.109 0 N-CA-C 113.264 0.838 . . . . 0.0 113.264 -175.74 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -64.93 -29.54 57.85 Favored 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 123.583 2.855 . . . . 0.0 112.432 -162.359 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -41.34 -69.4 0.14 Allowed 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 127.206 2.202 . . . . 0.0 115.275 158.202 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.5 p -69.11 -26.84 65.11 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 121.24 -0.913 . . . . 0.0 111.992 177.106 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.48 ' HE3' ' HA ' ' A' ' 27' ' ' CYS . 6.2 tmtt? -61.54 -51.01 70.38 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 119.54 1.064 . . . . 0.0 111.61 174.665 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 12.9 ttpt -62.26 -43.86 97.86 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.862 0.865 . . . . 0.0 111.385 176.522 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.34 -39.57 91.03 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 176.17 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 11.7 ttp85 -60.84 -54.24 47.51 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.733 1.213 . . . . 0.0 110.009 175.543 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 58.0 m-20 -71.73 -26.7 62.57 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 115.229 -0.896 . . . . 0.0 112.685 -175.482 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.22 -40.13 90.1 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 120.368 -1.458 . . . . 0.0 112.606 167.803 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 2.3 t -59.01 -33.83 71.17 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 122.695 1.236 . . . . 0.0 111.819 170.702 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 70.9 mt -76.53 -34.12 23.79 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 C-N-CA 124.619 1.168 . . . . 0.0 111.855 177.349 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 66.3 mt -64.63 -34.13 67.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 124.474 1.11 . . . . 0.0 111.734 167.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -70.79 -37.26 73.3 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 113.966 1.099 . . . . 0.0 113.966 174.543 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.2 mppt? -142.64 -60.65 0.44 Allowed 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 125.488 1.515 . . . . 0.0 113.488 -174.824 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 136.37 160.3 8.71 Favored Glycine 0 CA--C 1.531 1.072 0 C-N-CA 126.045 1.783 . . . . 0.0 109.374 -158.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.483 ' HB3' HD11 ' A' ' 53' ' ' ILE . 0.4 OUTLIER -73.05 -29.53 63.04 Favored 'General case' 0 N--CA 1.466 0.325 0 O-C-N 120.786 -1.42 . . . . 0.0 112.934 -167.581 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.6 pt-20 -56.1 -31.45 63.27 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 123.2 0.6 . . . . 0.0 112.583 178.104 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -85.94 3.31 42.56 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.045 1.338 . . . . 0.0 113.188 177.865 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 4.6 m -147.08 17.84 1.22 Allowed 'General case' 0 N--CA 1.441 -0.903 0 C-N-CA 125.423 1.489 . . . . 0.0 112.881 -154.877 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLY . . . . . 0.691 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -63.63 -30.95 79.15 Favored Glycine 0 C--O 1.215 -1.05 0 O-C-N 120.217 -1.552 . . . . 0.0 114.58 179.742 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 39.3 p-80 -53.36 -25.59 15.88 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 121.292 2.546 . . . . 0.0 113.944 168.38 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.85 -35.85 32.25 Favored 'General case' 0 C--N 1.341 0.196 0 C-N-CA 123.7 0.8 . . . . 0.0 111.138 172.266 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.691 HD12 ' HA2' ' A' ' 50' ' ' GLY . 34.4 mt -72.35 -37.43 58.15 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.444 0 CA-C-O 118.757 -0.64 . . . . 0.0 110.012 178.93 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.556 ' HG3' ' HE3' ' A' ' 57' ' ' LYS . 1.4 mp0 -67.17 -52.84 36.41 Favored 'General case' 0 N--CA 1.436 -1.157 0 C-N-CA 124.835 1.254 . . . . 0.0 112.818 176.665 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.41 -37.83 57.6 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 119.161 0.891 . . . . 0.0 112.95 174.881 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -72.52 -41.53 65.79 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 114.324 1.231 . . . . 0.0 114.324 173.753 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.556 ' HE3' ' HG3' ' A' ' 54' ' ' GLU . 23.7 mtmt -55.04 -52.62 62.61 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.942 1.297 . . . . 0.0 111.161 175.706 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -64.88 -38.44 90.97 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.408 0.683 . . . . 0.0 111.65 178.786 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 36.2 t -52.07 -60.69 2.9 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 118.284 -0.865 . . . . 0.0 111.741 169.458 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 79.3 mtm -49.64 -50.16 44.22 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 124.832 1.253 . . . . 0.0 111.474 172.437 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 22.3 mtt180 -53.11 -35.8 60.04 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 120.353 1.433 . . . . 0.0 114.133 -177.333 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.415 ' HB3' HD12 ' A' ' 63' ' ' LEU . . . -48.95 -37.03 18.86 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 119.272 0.942 . . . . 0.0 113.331 170.019 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.415 HD12 ' HB3' ' A' ' 62' ' ' ALA . 4.9 mp -82.87 8.74 11.62 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 125.154 1.381 . . . . 0.0 112.051 -172.825 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.53 22.55 43.19 Favored Glycine 0 CA--C 1.535 1.311 0 C-N-CA 124.931 1.253 . . . . 0.0 114.025 -179.058 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.501 ' C ' ' HE3' ' A' ' 66' ' ' LYS . 0.8 OUTLIER -84.49 153.67 23.19 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.494 1.518 . . . . 0.0 114.75 -163.265 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.501 ' HE3' ' C ' ' A' ' 65' ' ' PHE . 0.1 OUTLIER -94.97 81.34 3.71 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 126.441 1.897 . . . . 0.0 107.906 -174.32 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 29.4 mm . . . . . 0 C--O 1.245 0.862 0 C-N-CA 128.85 2.86 . . . . 0.0 108.896 -165.011 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.472 0 N-CA-C 109.441 -1.464 . . . . 0.0 109.441 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.5 p -135.67 8.16 3.3 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.143 1.377 . . . . 0.0 113.076 -176.539 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 53.7 p90 -157.43 177.9 10.91 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 127.589 2.356 . . . . 0.0 108.674 -178.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.9 m -127.26 148.5 50.22 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.603 1.161 . . . . 0.0 109.268 178.561 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 7.6 tpt -131.32 79.35 70.27 Favored Pre-proline 0 CA--C 1.539 0.552 0 C-N-CA 123.915 0.886 . . . . 0.0 110.15 175.509 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -73.61 -0.26 9.09 Favored 'Trans proline' 0 CA--C 1.543 0.962 0 C-N-CA 123.414 2.743 . . . . 0.0 114.574 177.333 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -79.65 44.82 2.79 Favored Glycine 0 CA--C 1.534 1.256 0 CA-C-N 119.661 1.118 . . . . 0.0 114.554 -174.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 6.3 mp -118.41 133.15 56.11 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 126.06 1.744 . . . . 0.0 110.593 -172.657 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.4 p -160.36 163.1 1.1 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 125.972 1.709 . . . . 0.0 109.152 178.119 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -138.46 158.41 44.32 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.47 1.108 . . . . 0.0 109.87 165.823 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 75.0 m -156.16 12.77 0.3 Allowed 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.534 1.933 . . . . 0.0 111.942 169.02 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -136.35 62.05 41.83 Favored Pre-proline 0 CA--C 1.55 0.979 0 CA-C-N 119.458 1.026 . . . . 0.0 112.612 -173.207 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -71.17 -176.91 2.06 Favored 'Trans proline' 0 CA--C 1.542 0.916 0 C-N-CA 123.725 2.95 . . . . 0.0 111.113 169.785 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -136.05 156.28 77.11 Favored Pre-proline 0 CA--C 1.542 0.636 0 C-N-CA 124.537 1.135 . . . . 0.0 111.682 -179.12 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -64.03 131.06 29.29 Favored 'Trans proline' 0 CA--C 1.545 1.03 0 C-N-CA 122.233 1.955 . . . . 0.0 111.175 172.285 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -77.72 -178.09 4.34 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.345 2.697 . . . . 0.0 112.305 172.07 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -123.99 165.12 17.99 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.805 1.242 . . . . 0.0 110.56 167.676 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 5.0 m -159.63 -1.17 0.08 Allowed 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 114.183 1.179 . . . . 0.0 114.183 175.752 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -152.92 98.24 2.3 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 114.257 1.206 . . . . 0.0 114.257 -174.347 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . 0.256 0.0 OUTLIER -140.36 -169.54 2.79 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.37 1.468 . . . . 0.0 109.007 151.599 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.82 -3.4 8.68 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 117.096 2.258 . . . . 0.0 117.096 -167.278 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 23.2 mtpp -89.92 167.27 17.59 Favored Pre-proline 0 N--CA 1.474 0.728 0 C-N-CA 126.861 2.065 . . . . 0.0 112.155 175.588 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -91.48 160.93 3.61 Favored 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 123.866 3.044 . . . . 0.0 112.052 170.545 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.583 ' CD1' ' H ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -71.99 165.54 24.02 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.32 166.744 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.583 ' H ' ' CD1' ' A' ' 24' ' ' LEU . 12.4 ptmm? -137.78 137.26 21.22 Favored Pre-proline 0 CA--C 1.536 0.42 0 C-N-CA 128.637 2.775 . . . . 0.0 107.209 -178.898 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -64.28 -20.08 66.38 Favored 'Trans proline' 0 CA--C 1.535 0.569 0 C-N-CA 124.646 3.564 . . . . 0.0 115.944 -154.55 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 26.9 p -84.36 -23.46 30.15 Favored 'General case' 0 CA--C 1.558 1.279 0 C-N-CA 125.265 1.426 . . . . 0.0 113.372 175.693 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 69.7 m -94.69 -13.06 26.15 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 115.307 1.595 . . . . 0.0 115.307 -174.123 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.55 156.58 32.19 Favored 'General case' 0 CA--C 1.545 0.767 0 O-C-N 121.625 -0.672 . . . . 0.0 111.506 -170.606 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 13.7 m 45.9 63.49 9.45 Favored Pre-proline 0 CA--C 1.55 0.965 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 177.082 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -68.7 -17.64 42.51 Favored 'Trans proline' 0 CA--C 1.536 0.577 0 C-N-CA 123.13 2.554 . . . . 0.0 113.176 -161.395 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -88.17 -41.09 13.22 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.93 1.292 . . . . 0.0 112.493 -174.85 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.7 p -64.01 -33.22 75.26 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 120.89 -1.131 . . . . 0.0 110.833 158.905 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 5.1 tmtt? -59.04 -47.89 83.59 Favored 'General case' 0 N--CA 1.478 0.962 0 CA-C-N 120.727 1.603 . . . . 0.0 111.691 173.284 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 26.9 mttt -54.29 -49.97 68.4 Favored 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 126.022 1.729 . . . . 0.0 111.772 173.27 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.83 -35.05 76.5 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.452 0.701 . . . . 0.0 112.756 179.89 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 3.1 ttp180 -57.96 -55.5 34.15 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 124.728 1.211 . . . . 0.0 109.914 172.848 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -62.46 -39.45 93.42 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.444 1.098 . . . . 0.0 111.98 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.1 -41.8 97.33 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 113.207 0.818 . . . . 0.0 113.207 172.031 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.9 t -59.38 -36.16 75.26 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 122.496 1.141 . . . . 0.0 111.584 174.088 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 68.6 mt -73.09 -29.53 28.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 O-C-N 120.657 -1.277 . . . . 0.0 111.279 177.793 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 96.8 mt -69.29 -36.36 72.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.435 1.094 . . . . 0.0 112.005 168.251 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -67.49 -42.1 83.46 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 124.507 1.123 . . . . 0.0 113.716 178.29 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.85 -17.42 0.31 Allowed 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 116.923 2.194 . . . . 0.0 116.923 -171.504 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 95.74 164.65 34.26 Favored Glycine 0 CA--C 1.535 1.318 0 C-N-CA 123.933 0.778 . . . . 0.0 112.815 -167.685 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -69.23 -39.67 78.41 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 -165.287 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -55.73 -34.44 65.16 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.513 1.525 . . . . 0.0 113.769 175.729 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 78.0 m-70 -91.13 15.11 12.37 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.823 1.249 . . . . 0.0 112.306 -176.471 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 1.2 m -143.2 1.22 1.22 Allowed 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 115.73 1.752 . . . . 0.0 115.73 -166.034 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -51.46 -27.35 17.29 Favored Glycine 0 N--CA 1.473 1.11 0 CA-C-O 115.979 -2.567 . . . . 0.0 118.068 -163.921 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 34.3 p-80 -51.77 -35.12 42.52 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 121.798 2.799 . . . . 0.0 113.255 170.143 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.59 -40.48 76.65 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 125.722 1.609 . . . . 0.0 112.056 171.283 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.473 HG22 ' HD3' ' A' ' 57' ' ' LYS . 3.3 mp -70.74 -36.32 64.37 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 C-N-CA 120.488 -0.485 . . . . 0.0 110.497 178.914 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -73.53 -51.19 17.87 Favored 'General case' 0 N--CA 1.444 -0.759 0 C-N-CA 126.741 2.016 . . . . 0.0 112.32 -174.936 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -56.89 -37.93 72.08 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 121.453 0.644 . . . . 0.0 112.294 172.628 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 20.9 t60 -69.02 -49.87 53.81 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 113.113 0.782 . . . . 0.0 113.113 175.244 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.473 ' HD3' HG22 ' A' ' 53' ' ' ILE . 13.7 mtpp -46.43 -49.94 17.46 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 125.736 1.614 . . . . 0.0 111.378 170.745 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 60.4 mm-40 -58.29 -48.32 80.83 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 119.433 1.015 . . . . 0.0 112.357 174.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 24.5 t -55.33 -47.84 75.07 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 123.558 0.743 . . . . 0.0 112.682 178.679 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 12.4 mtp -62.54 -49.68 74.37 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.535 1.134 . . . . 0.0 110.532 169.828 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 18.1 mtp180 -56.3 -30.6 62.73 Favored 'General case' 0 C--N 1.34 0.164 0 O-C-N 119.601 -1.937 . . . . 0.0 114.139 -175.64 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -42.31 -35.43 0.99 Allowed 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.319 1.447 . . . . 0.0 113.9 168.354 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.0 mp -79.52 3.69 17.97 Favored 'General case' 0 CA--C 1.548 0.894 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 -171.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.95 20.82 38.12 Favored Glycine 0 CA--C 1.536 1.346 0 C-N-CA 125.598 1.57 . . . . 0.0 112.381 -168.208 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.442 ' C ' ' HE3' ' A' ' 66' ' ' LYS . 0.0 OUTLIER -94.85 158.93 15.27 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 126.482 1.913 . . . . 0.0 112.815 -161.368 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.442 ' HE3' ' C ' ' A' ' 65' ' ' PHE . 0.1 OUTLIER -116.0 106.52 13.87 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 125.925 1.69 . . . . 0.0 107.477 -174.41 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.407 HG22 ' HG2' ' A' ' 57' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--O 1.246 0.889 0 C-N-CA 125.198 1.399 . . . . 0.0 111.046 -170.126 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.554 0 CA-C-O 117.931 -1.483 . . . . 0.0 109.448 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 12.9 p -139.97 -0.56 1.67 Allowed 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 114.781 1.4 . . . . 0.0 114.781 -171.131 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -72.31 110.86 7.03 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 118.853 0.751 . . . . 0.0 111.313 177.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.6 m -63.35 141.82 58.62 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.209 0.603 . . . . 0.0 110.472 168.68 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 24.5 ttt -126.59 63.15 52.26 Favored Pre-proline 0 N--CA 1.471 0.623 0 C-N-CA 123.914 0.886 . . . . 0.0 111.648 -178.445 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -76.63 -9.98 18.56 Favored 'Trans proline' 0 CA--C 1.537 0.655 0 C-N-CA 122.417 2.078 . . . . 0.0 115.96 -167.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 134.65 78.74 0.11 Allowed Glycine 0 N--CA 1.471 0.979 0 CA-C-N 118.953 0.797 . . . . 0.0 111.93 -170.607 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -152.68 151.99 31.22 Favored 'General case' 0 CA--C 1.518 -0.25 0 C-N-CA 124.437 1.095 . . . . 0.0 111.911 -170.068 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 70.8 t 64.81 102.91 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 C-N-CA 126.384 1.874 . . . . 0.0 112.27 175.357 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -68.89 50.01 0.08 Allowed 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 127.686 2.394 . . . . 0.0 113.061 177.035 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.4 t 52.03 20.57 1.29 Allowed 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 126.233 1.813 . . . . 0.0 114.497 -167.264 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 48.7 t-20 -132.8 84.08 50.91 Favored Pre-proline 0 CA--C 1.544 0.73 0 C-N-CA 125.339 1.456 . . . . 0.0 109.555 -163.466 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_endo -85.45 -167.01 0.37 Allowed 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 125.162 3.908 . . . . 0.0 112.665 -172.579 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -123.92 161.61 45.82 Favored Pre-proline 0 CA--C 1.544 0.728 0 C-N-CA 125.814 1.646 . . . . 0.0 109.901 168.884 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -67.46 154.23 74.36 Favored 'Trans proline' 0 CA--C 1.545 1.067 0 C-N-CA 121.996 1.797 . . . . 0.0 111.134 167.018 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -77.72 176.12 10.41 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 123.566 2.844 . . . . 0.0 113.094 176.18 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -67.76 138.36 56.16 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.462 1.905 . . . . 0.0 114.587 -168.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 57.9 p -167.16 152.06 7.25 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.46 1.104 . . . . 0.0 110.734 151.832 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -150.33 17.13 0.83 Allowed 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 115.091 1.515 . . . . 0.0 115.091 -162.634 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.8 -176.7 0.2 Allowed 'General case' 0 CA--C 1.545 0.759 0 O-C-N 119.51 -1.994 . . . . 0.0 112.182 165.312 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.8 tptp -70.91 55.56 0.18 Allowed 'General case' 0 CA--C 1.549 0.915 0 O-C-N 120.519 -1.363 . . . . 0.0 113.337 175.289 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -49.6 155.92 1.28 Allowed Pre-proline 0 CA--C 1.55 0.963 0 C-N-CA 128.05 2.54 . . . . 0.0 114.005 178.001 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -90.72 -174.78 0.75 Allowed 'Trans proline' 0 CA--C 1.535 0.565 0 C-N-CA 125.069 3.846 . . . . 0.0 110.627 159.74 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.7 ' CD1' ' H ' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -131.16 165.34 23.53 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 122.151 0.977 . . . . 0.0 110.634 165.647 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.7 ' H ' ' CD1' ' A' ' 24' ' ' LEU . 0.1 OUTLIER -152.77 122.33 3.34 Favored Pre-proline 0 C--N 1.327 -0.37 0 C-N-CA 129.923 3.289 . . . . 0.0 104.224 -163.949 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -64.71 -29.08 59.96 Favored 'Trans proline' 0 CA--C 1.534 0.49 0 C-N-CA 123.719 2.946 . . . . 0.0 114.325 -148.279 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 29.0 p -67.17 -18.36 65.24 Favored 'General case' 0 CA--C 1.555 1.141 0 C-N-CA 124.586 1.154 . . . . 0.0 113.342 177.617 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 56.2 m -111.96 -4.0 14.66 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 115.216 1.562 . . . . 0.0 115.216 -175.25 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.48 ' HB3' ' SD ' ' A' ' 60' ' ' MET . . . -64.43 158.41 23.87 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 120.0 1.273 . . . . 0.0 110.933 -179.376 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 33.5 m 36.33 62.25 2.94 Favored Pre-proline 0 CA--C 1.546 0.816 0 C-N-CA 124.717 1.207 . . . . 0.0 114.11 -179.467 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -69.16 -18.67 39.71 Favored 'Trans proline' 0 N--CA 1.459 -0.526 0 C-N-CA 122.38 2.054 . . . . 0.0 111.499 -161.462 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -76.46 -47.7 22.12 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.821 1.248 . . . . 0.0 111.726 -179.515 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.7 p -65.82 -31.62 72.69 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 117.841 -1.076 . . . . 0.0 111.612 165.704 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.2 tmtp? -58.76 -50.83 72.49 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 120.509 1.504 . . . . 0.0 112.112 171.548 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 23.6 ttpt -54.72 -47.42 73.77 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 126.898 2.079 . . . . 0.0 112.12 175.025 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.77 -39.02 90.6 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 114.398 -1.274 . . . . 0.0 113.591 174.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 14.4 ttp85 -60.73 -53.29 59.21 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.625 1.57 . . . . 0.0 110.124 177.293 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -74.76 -30.65 61.55 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 115.364 -0.834 . . . . 0.0 111.836 -175.64 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.89 -39.38 81.25 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 120.531 -1.356 . . . . 0.0 112.698 165.413 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.9 t -59.41 -37.89 79.19 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.744 0.818 . . . . 0.0 111.825 175.083 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 72.3 mt -71.35 -35.52 57.77 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 C-N-CA 124.946 1.298 . . . . 0.0 111.145 176.517 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 86.0 mt -67.04 -31.54 53.84 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 C-N-CA 124.451 1.1 . . . . 0.0 112.127 171.09 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -78.84 -35.62 43.72 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.285 1.434 . . . . 0.0 114.486 178.107 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.2 mppt? -134.62 -59.8 0.8 Allowed 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 125.078 1.351 . . . . 0.0 112.788 176.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 139.08 173.94 13.26 Favored Glycine 0 CA--C 1.531 1.091 0 C-N-CA 126.09 1.805 . . . . 0.0 110.281 -160.952 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -78.94 -32.54 45.53 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 114.601 1.334 . . . . 0.0 114.601 -162.582 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -58.73 -34.7 71.65 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.834 1.254 . . . . 0.0 113.742 173.952 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -81.08 6.9 12.26 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.183 0.993 . . . . 0.0 112.942 -176.652 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 21.7 m -145.57 13.25 1.36 Allowed 'General case' 0 N--CA 1.437 -1.093 0 C-N-CA 124.053 0.941 . . . . 0.0 113.413 -154.088 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLY . . . . . 0.455 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -67.88 -29.48 73.68 Favored Glycine 0 N--CA 1.469 0.864 0 O-C-N 119.791 -1.818 . . . . 0.0 115.605 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 29.6 p-80 -56.82 -30.58 63.88 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 120.208 2.004 . . . . 0.0 112.582 165.645 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.06 -34.96 59.6 Favored 'General case' 0 CA--C 1.522 -0.119 0 C-N-CA 124.054 0.942 . . . . 0.0 109.698 174.661 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.455 HD12 ' HA2' ' A' ' 50' ' ' GLY . 44.4 mt -72.99 -27.44 24.63 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 N-CA-C 110.554 -0.165 . . . . 0.0 110.554 177.567 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 67.3 mt-10 -89.1 -47.16 8.29 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 -169.158 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.42 -37.89 57.75 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-O 121.737 0.78 . . . . 0.0 112.124 165.208 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 14.1 t60 -68.43 -46.36 70.09 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 173.833 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 19.8 mtmt -51.75 -52.74 46.46 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.906 1.283 . . . . 0.0 110.918 177.047 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -61.47 -41.59 97.48 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.023 0.529 . . . . 0.0 112.333 178.71 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 23.7 t -54.59 -50.39 68.13 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 123.438 0.695 . . . . 0.0 112.83 173.636 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.48 ' SD ' ' HB3' ' A' ' 29' ' ' ALA . 0.4 OUTLIER -58.03 -53.4 58.69 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 125.535 1.534 . . . . 0.0 110.34 170.259 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 74.6 mtt180 -55.32 -31.42 61.66 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 126.579 1.952 . . . . 0.0 114.39 -175.046 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -45.78 -34.74 3.86 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.791 1.237 . . . . 0.0 113.497 169.158 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.9 mp -81.22 3.8 22.54 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.733 1.213 . . . . 0.0 112.244 -173.669 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.94 11.81 67.14 Favored Glycine 0 CA--C 1.535 1.305 0 C-N-CA 125.22 1.39 . . . . 0.0 113.286 -169.796 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.405 ' C ' ' HE3' ' A' ' 66' ' ' LYS . 0.9 OUTLIER -70.16 151.51 45.33 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 126.317 1.847 . . . . 0.0 113.506 -176.659 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.405 ' HE3' ' C ' ' A' ' 65' ' ' PHE . 0.0 OUTLIER -111.39 93.66 4.58 Favored 'General case' 0 C--N 1.341 0.198 0 C-N-CA 126.366 1.866 . . . . 0.0 109.502 -170.488 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.247 0.923 0 C-N-CA 127.471 2.308 . . . . 0.0 109.602 -173.266 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.175 0 N-CA-C 106.38 -2.688 . . . . 0.0 106.38 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.5 p 178.76 22.19 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.887 0 O-C-N 124.235 0.609 . . . . 0.0 112.183 -146.554 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -160.72 155.27 23.61 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.787 2.035 . . . . 0.0 108.487 -174.391 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -154.05 151.82 29.78 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.843 1.257 . . . . 0.0 109.158 178.683 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 9.2 tpt -133.96 60.18 43.54 Favored Pre-proline 0 N--CA 1.474 0.748 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 176.093 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -76.73 49.01 2.59 Favored 'Trans proline' 0 CA--C 1.547 1.148 0 C-N-CA 123.758 2.972 . . . . 0.0 110.85 170.064 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -126.72 34.4 3.16 Favored Glycine 0 CA--C 1.53 0.97 0 C-N-CA 125.458 1.504 . . . . 0.0 114.093 -167.186 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -151.7 171.5 17.58 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.978 1.311 . . . . 0.0 112.051 -179.475 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 14.8 p -146.96 138.72 18.69 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 124.576 1.151 . . . . 0.0 109.667 177.176 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 2.8 t0 54.32 -170.75 0.06 Allowed 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 124.5 1.12 . . . . 0.0 112.262 -159.419 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 54.3 p -121.22 -27.75 4.82 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.216 -0.928 . . . . 0.0 111.671 148.868 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -175.11 117.58 0.31 Allowed Pre-proline 0 CA--C 1.543 0.688 0 C-N-CA 125.655 1.582 . . . . 0.0 108.767 178.308 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -86.58 177.57 4.22 Favored 'Trans proline' 0 CA--C 1.543 0.948 0 C-N-CA 124.967 3.778 . . . . 0.0 110.99 172.869 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -152.17 158.42 33.69 Favored Pre-proline 0 CA--C 1.544 0.724 0 C-N-CA 124.12 0.968 . . . . 0.0 111.752 176.243 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -68.97 129.53 18.61 Favored 'Trans proline' 0 CA--C 1.546 1.11 0 C-N-CA 122.666 2.244 . . . . 0.0 111.457 169.239 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -84.65 -172.19 1.18 Allowed 'Trans proline' 0 CA--C 1.544 0.997 0 C-N-CA 124.085 3.19 . . . . 0.0 112.387 169.694 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 82.83 157.6 0.12 Allowed 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 127.56 2.344 . . . . 0.0 114.185 167.301 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 80.4 p -167.84 158.43 10.79 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 120.619 -1.301 . . . . 0.0 113.15 167.203 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -114.05 -63.29 1.47 Allowed 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 125.568 1.547 . . . . 0.0 109.506 178.176 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.01 -178.38 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 123.809 0.843 . . . . 0.0 111.515 147.009 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -135.15 161.75 34.46 Favored 'General case' 0 N--CA 1.455 -0.216 0 O-C-N 119.026 -2.297 . . . . 0.0 112.426 179.842 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.5 mmpt? -128.81 158.37 72.57 Favored Pre-proline 0 N--CA 1.474 0.739 0 C-N-CA 126.25 1.82 . . . . 0.0 109.831 -167.575 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_endo -71.45 169.2 21.46 Favored 'Trans proline' 0 N--CA 1.461 -0.413 0 C-N-CA 121.756 1.637 . . . . 0.0 110.638 155.353 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -75.87 158.6 31.9 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 122.295 1.045 . . . . 0.0 113.059 175.118 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.403 ' HD3' ' HB2' ' A' ' 28' ' ' CYS . 1.5 ptpt -132.12 137.6 30.45 Favored Pre-proline 0 CA--C 1.538 0.514 0 C-N-CA 126.836 2.055 . . . . 0.0 108.872 -174.44 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.452 ' HB3' ' CE1' ' A' ' 65' ' ' PHE . 24.6 Cg_endo -75.83 -18.88 16.67 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 124.617 3.545 . . . . 0.0 114.073 -161.114 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 30.3 p -77.01 -19.01 57.79 Favored 'General case' 0 CA--C 1.558 1.266 0 C-N-CA 125.731 1.612 . . . . 0.0 112.835 176.379 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.403 ' HB2' ' HD3' ' A' ' 25' ' ' LYS . 38.7 m -119.98 -20.38 7.51 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.945 1.698 . . . . 0.0 114.502 -172.773 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.97 147.52 19.5 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.724 0.81 . . . . 0.0 111.015 178.57 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 54.6 m 48.99 54.28 15.93 Favored Pre-proline 0 CA--C 1.553 1.087 0 N-CA-C 113.704 1.001 . . . . 0.0 113.704 -171.04 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -66.2 -31.9 43.7 Favored 'Trans proline' 0 CA--C 1.537 0.634 0 C-N-CA 123.696 2.931 . . . . 0.0 112.649 -168.549 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -39.98 -69.59 0.13 Allowed 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.598 1.959 . . . . 0.0 114.633 158.094 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.1 p -66.86 -28.55 68.43 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-O 117.636 -1.173 . . . . 0.0 111.935 176.184 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 12.1 tmtt? -57.25 -47.82 80.4 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 120.738 1.608 . . . . 0.0 112.163 176.001 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.5 mttp -83.86 -26.26 29.61 Favored 'General case' 0 CA--C 1.516 -0.34 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 -179.327 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.29 -41.46 97.0 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 123.343 0.402 . . . . 0.0 111.923 163.545 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 7.5 ttp85 -57.93 -53.53 57.18 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 125.505 1.522 . . . . 0.0 109.981 173.803 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 82.7 m-20 -69.32 -30.18 68.18 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 115.042 -0.981 . . . . 0.0 113.496 -175.093 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.53 -45.63 92.08 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 120.351 1.432 . . . . 0.0 111.96 168.495 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.3 t -55.75 -34.11 64.9 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.058 0.943 . . . . 0.0 111.296 171.656 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 69.2 mt -77.3 -35.89 23.15 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 O-C-N 120.404 -1.435 . . . . 0.0 112.068 178.743 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 87.5 mt -59.92 -36.5 67.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 124.315 1.046 . . . . 0.0 111.385 167.793 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -70.35 -45.74 65.52 Favored 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 124.352 1.061 . . . . 0.0 113.718 178.473 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.58 -13.81 0.67 Allowed 'General case' 0 N--CA 1.483 1.224 0 N-CA-C 116.936 2.198 . . . . 0.0 116.936 -169.689 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 89.39 165.95 41.48 Favored Glycine 0 CA--C 1.536 1.395 0 C-N-CA 124.893 1.235 . . . . 0.0 112.476 -163.064 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.4 -34.66 63.34 Favored 'General case' 0 N--CA 1.466 0.326 0 O-C-N 120.553 -1.557 . . . . 0.0 113.259 -168.727 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -55.94 -35.21 66.39 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 123.118 0.567 . . . . 0.0 112.414 -179.629 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 84.5 m-70 -86.3 9.47 17.72 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.732 1.613 . . . . 0.0 112.961 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 1.3 m -143.0 9.19 1.7 Allowed 'General case' 0 N--CA 1.443 -0.825 0 C-N-CA 124.95 1.3 . . . . 0.0 113.895 -166.71 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -55.26 -22.21 28.95 Favored Glycine 0 C--O 1.215 -1.054 0 CA-C-O 117.041 -1.977 . . . . 0.0 117.656 -169.974 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 33.4 p-80 -54.46 -36.71 64.38 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 121.952 2.876 . . . . 0.0 113.145 167.207 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -70.73 -37.33 73.49 Favored 'General case' 0 N--CA 1.462 0.127 0 C-N-CA 125.332 1.453 . . . . 0.0 111.627 172.319 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.718 HG22 ' HD3' ' A' ' 57' ' ' LYS . 2.6 mp -71.12 -38.23 70.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 CA-C-N 118.912 0.778 . . . . 0.0 110.427 177.121 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.65 -53.66 21.12 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 125.393 1.477 . . . . 0.0 111.787 -173.992 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -57.88 -36.24 72.1 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-O 121.799 0.809 . . . . 0.0 112.755 175.7 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 15.4 t60 -68.48 -47.44 67.07 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.865 0.866 . . . . 0.0 112.775 175.028 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.718 ' HD3' HG22 ' A' ' 53' ' ' ILE . 31.1 mtpt -51.46 -49.14 62.34 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.53 1.132 . . . . 0.0 111.58 172.067 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -61.57 -46.5 89.62 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 124.215 1.006 . . . . 0.0 112.491 175.361 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 42.4 t -51.58 -52.65 45.61 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.073 0.949 . . . . 0.0 112.08 175.347 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 76.2 mtm -57.89 -48.93 78.41 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.913 0.885 . . . . 0.0 111.457 170.5 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.2 mtt-85 -58.47 -29.17 65.99 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 120.518 1.508 . . . . 0.0 114.205 -171.419 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -45.94 -35.22 4.47 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.22 1.008 . . . . 0.0 113.61 167.685 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.6 mp -81.95 6.65 15.31 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.221 1.008 . . . . 0.0 112.945 -170.552 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.07 27.07 42.01 Favored Glycine 0 CA--C 1.533 1.207 0 C-N-CA 124.722 1.153 . . . . 0.0 112.29 -169.084 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.452 ' CE1' ' HB3' ' A' ' 26' ' ' PRO . 0.2 OUTLIER -89.35 167.59 12.91 Favored 'General case' 0 N--CA 1.461 0.109 0 CA-C-O 123.694 1.711 . . . . 0.0 113.426 -171.623 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 16.0 ptpt -128.96 44.35 2.99 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 113.468 -1.696 . . . . 0.0 112.725 -136.04 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.917 0 C-N-CA 130.413 3.485 . . . . 0.0 109.593 -163.216 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.493 0 N-CA-C 109.337 -1.505 . . . . 0.0 109.337 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.2 t -153.79 175.7 13.0 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.005 1.322 . . . . 0.0 109.463 171.577 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -152.18 157.12 41.06 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.13 1.372 . . . . 0.0 110.771 -179.439 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -147.14 148.28 31.41 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.086 0.955 . . . . 0.0 110.109 -176.414 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 35.9 tpp -138.26 73.3 44.13 Favored Pre-proline 0 CA--C 1.541 0.624 0 C-N-CA 123.952 0.901 . . . . 0.0 110.332 174.041 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 79.1 Cg_endo -71.99 0.11 7.68 Favored 'Trans proline' 0 CA--C 1.542 0.9 0 C-N-CA 123.477 2.785 . . . . 0.0 115.352 -171.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -161.49 136.33 4.36 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.468 -1.053 . . . . 0.0 110.468 172.165 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -164.68 163.87 21.5 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.828 1.651 . . . . 0.0 110.412 -173.391 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 14.7 p -157.38 161.7 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 124.963 1.305 . . . . 0.0 110.382 -175.59 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -61.76 160.45 11.78 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 123.685 0.794 . . . . 0.0 111.896 166.231 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.8 t -128.62 105.95 8.62 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 124.35 1.06 . . . . 0.0 109.749 179.068 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -142.52 61.84 12.07 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 124.211 1.005 . . . . 0.0 111.501 -170.159 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -72.52 179.12 5.42 Favored 'Trans proline' 0 CA--C 1.542 0.88 0 C-N-CA 124.959 3.773 . . . . 0.0 112.707 179.826 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -95.89 160.43 30.15 Favored Pre-proline 0 CA--C 1.547 0.834 0 C-N-CA 125.989 1.716 . . . . 0.0 111.588 173.252 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -70.71 156.06 61.58 Favored 'Trans proline' 0 CA--C 1.546 1.085 0 C-N-CA 123.199 2.599 . . . . 0.0 112.444 170.543 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -78.87 -178.95 5.03 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 123.73 2.953 . . . . 0.0 112.819 170.775 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -53.25 -22.92 7.65 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 126.196 1.798 . . . . 0.0 114.706 174.302 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.7 m -61.12 11.49 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 127.954 2.502 . . . . 0.0 116.297 -179.757 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 57.6 tp60 -49.14 107.58 0.15 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.15 1.78 . . . . 0.0 112.142 178.068 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.71 175.12 3.73 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 124.068 1.889 . . . . 0.0 113.29 175.235 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 8.5 mptt -124.68 62.59 1.13 Allowed 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 129.499 3.12 . . . . 0.0 108.275 -167.384 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.48 158.29 76.06 Favored Pre-proline 0 N--CA 1.476 0.861 0 C-N-CA 127.761 2.425 . . . . 0.0 110.277 -176.116 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -73.55 159.81 45.42 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 122.24 1.96 . . . . 0.0 111.856 173.828 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.562 HD22 ' CB ' ' A' ' 29' ' ' ALA . 1.0 OUTLIER -80.17 162.86 24.48 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.478 1.111 . . . . 0.0 113.995 -176.899 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.7 ptmt -131.57 132.06 23.22 Favored Pre-proline 0 N--CA 1.468 0.43 0 C-N-CA 126.13 1.772 . . . . 0.0 106.771 171.734 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -70.51 -39.05 5.43 Favored 'Trans proline' 0 CA--C 1.533 0.473 0 C-N-CA 122.883 2.389 . . . . 0.0 114.762 -150.258 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 20.3 p -63.08 -24.97 68.15 Favored 'General case' 0 CA--C 1.554 1.098 0 C-N-CA 123.521 0.728 . . . . 0.0 112.715 178.711 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 64.7 m -98.63 -5.73 31.21 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 126.265 1.826 . . . . 0.0 113.101 175.92 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.562 ' CB ' HD22 ' A' ' 24' ' ' LEU . . . -92.07 -36.71 13.2 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-O 122.301 1.048 . . . . 0.0 113.542 -176.066 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 43.5 m -113.36 61.86 0.84 Allowed Pre-proline 0 CA--C 1.549 0.927 0 C-N-CA 127.381 2.272 . . . . 0.0 112.075 162.67 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -74.83 -22.41 15.25 Favored 'Trans proline' 0 CA--C 1.54 0.785 0 C-N-CA 122.778 2.318 . . . . 0.0 112.446 -171.65 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -66.41 -52.86 42.18 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.209 1.404 . . . . 0.0 112.767 174.8 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.1 p -65.4 -30.33 71.13 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 120.967 -1.083 . . . . 0.0 111.375 170.025 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 8.2 tmtt? -57.66 -49.02 77.87 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 120.378 1.445 . . . . 0.0 112.426 169.716 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 48.1 tttt -54.5 -50.58 67.48 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 125.922 1.689 . . . . 0.0 111.159 174.374 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.97 -42.05 97.37 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 114.853 -1.067 . . . . 0.0 112.962 179.727 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 9.1 ttp85 -60.12 -51.97 67.33 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 125.102 1.361 . . . . 0.0 110.371 177.269 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 25.0 m-20 -72.31 -29.99 64.36 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 115.771 -0.65 . . . . 0.0 112.553 -175.514 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.91 -37.0 85.77 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 120.821 -1.175 . . . . 0.0 113.131 167.124 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.8 t -60.39 -39.76 88.49 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 121.053 -1.029 . . . . 0.0 111.651 168.939 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 73.7 mt -72.02 -29.95 34.82 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 O-C-N 121.001 -1.062 . . . . 0.0 111.468 -177.753 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 60.1 mt -58.01 -43.05 84.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 123.38 0.672 . . . . 0.0 111.489 163.591 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.9 -41.97 97.57 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.069 1.137 . . . . 0.0 114.069 -178.207 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -153.48 -9.34 0.16 Allowed 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 116.992 2.219 . . . . 0.0 116.992 -166.487 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 83.58 159.57 28.55 Favored Glycine 0 CA--C 1.53 1.017 0 CA-C-N 119.179 0.9 . . . . 0.0 112.895 -164.811 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.521 ' HB3' HD11 ' A' ' 53' ' ' ILE . 0.5 OUTLIER -67.53 -28.72 68.05 Favored 'General case' 0 N--CA 1.463 0.181 0 O-C-N 121.147 -1.207 . . . . 0.0 112.728 -169.564 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.438 ' HG3' ' CD2' ' A' ' 48' ' ' HIS . 10.4 pt-20 -58.41 -24.42 59.99 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.911 0.885 . . . . 0.0 113.258 177.018 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' HIS . . . . . 0.438 ' CD2' ' HG3' ' A' ' 47' ' ' GLU . 96.8 m-70 -104.21 11.97 34.33 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 120.345 1.429 . . . . 0.0 111.117 178.137 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 1.7 m -139.67 18.09 2.52 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 126.768 2.027 . . . . 0.0 113.051 -162.803 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLY . . . . . 0.47 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -63.81 -29.69 75.52 Favored Glycine 0 C--O 1.216 -1.001 0 CA-C-O 116.622 -2.21 . . . . 0.0 114.883 -175.728 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 41.0 p-80 -56.42 -24.75 47.26 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 120.358 2.079 . . . . 0.0 113.632 168.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -82.72 -33.63 27.47 Favored 'General case' 0 C--N 1.341 0.203 0 O-C-N 121.515 -0.74 . . . . 0.0 110.78 171.948 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.53 HG22 ' HD3' ' A' ' 57' ' ' LYS . 51.5 mt -75.11 -35.22 33.94 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-O 119.196 -0.43 . . . . 0.0 110.628 -179.18 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -67.84 -55.49 12.76 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 127.119 2.168 . . . . 0.0 110.94 -177.301 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.74 -40.76 72.96 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 173.138 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 13.6 t60 -66.3 -46.48 76.8 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 120.992 -1.067 . . . . 0.0 113.089 175.38 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.53 ' HD3' HG22 ' A' ' 53' ' ' ILE . 21.4 mtpp -54.06 -49.0 69.99 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.146 0.978 . . . . 0.0 111.269 172.658 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -61.74 -43.39 98.95 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 118.155 -0.926 . . . . 0.0 112.435 175.322 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 42.8 t -50.74 -58.2 6.47 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 119.016 0.825 . . . . 0.0 111.11 173.002 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 75.6 mtm -55.93 -45.89 78.62 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.203 0.601 . . . . 0.0 110.486 174.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 8.8 mtt-85 -58.91 -29.25 66.92 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 120.77 1.623 . . . . 0.0 115.232 -177.035 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -50.25 -31.32 13.79 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 118.9 0.773 . . . . 0.0 112.668 169.638 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.413 ' CD2' ' HB1' ' A' ' 29' ' ' ALA . 5.9 mp -85.21 26.74 0.85 Allowed 'General case' 0 CA--C 1.546 0.81 0 CA-C-O 122.732 1.253 . . . . 0.0 112.327 -172.195 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 68.09 30.1 73.75 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 127.156 2.312 . . . . 0.0 113.034 -174.714 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -102.35 170.35 8.12 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-O 124.03 1.871 . . . . 0.0 115.959 -148.578 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 13.0 ptpt -119.81 69.53 0.84 Allowed 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 124.1 1.905 . . . . 0.0 111.625 -152.273 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 17.8 mm . . . . . 0 C--O 1.254 1.313 0 CA-C-N 108.472 -3.967 . . . . 0.0 112.16 -147.72 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.402 0 N-CA-C 109.115 -1.594 . . . . 0.0 109.115 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.3 t -154.95 168.55 26.58 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.085 1.354 . . . . 0.0 108.972 169.244 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -142.78 152.53 42.35 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.355 1.462 . . . . 0.0 110.206 -179.882 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 3.2 m -160.58 145.17 14.21 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.405 1.082 . . . . 0.0 108.603 172.605 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 4.7 mpp? -129.46 66.44 76.92 Favored Pre-proline 0 CA--C 1.542 0.663 0 C-N-CA 123.734 0.813 . . . . 0.0 110.941 -177.555 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_endo -70.8 4.43 2.65 Favored 'Trans proline' 0 CA--C 1.544 1.019 0 C-N-CA 123.833 3.022 . . . . 0.0 116.477 -171.028 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -170.85 27.1 0.11 Allowed Glycine 0 CA--C 1.531 1.058 0 C-N-CA 124.213 0.911 . . . . 0.0 113.726 -179.589 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -163.16 -170.91 2.44 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.375 1.87 . . . . 0.0 109.657 -172.704 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 9.7 p -137.51 153.64 28.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 C-N-CA 124.24 1.016 . . . . 0.0 108.924 169.002 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -83.14 158.75 22.26 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 121.876 0.846 . . . . 0.0 111.194 172.756 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 75.1 m -157.12 0.79 0.12 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 126.429 1.892 . . . . 0.0 112.802 168.386 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -160.25 69.22 2.9 Favored Pre-proline 0 CA--C 1.551 1.002 0 C-N-CA 125.351 1.46 . . . . 0.0 109.93 -178.436 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -70.83 169.56 19.96 Favored 'Trans proline' 0 N--CA 1.45 -1.074 0 C-N-CA 123.527 2.818 . . . . 0.0 111.221 177.728 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -152.16 159.17 33.25 Favored Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 125.499 1.52 . . . . 0.0 110.417 175.246 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -68.38 158.76 56.22 Favored 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 121.471 1.447 . . . . 0.0 110.644 162.66 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -68.74 179.05 3.4 Favored 'Trans proline' 0 N--CA 1.459 -0.55 0 C-N-CA 121.569 1.513 . . . . 0.0 110.599 160.296 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -66.26 144.54 56.54 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-O 121.96 0.886 . . . . 0.0 111.673 162.541 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 77.8 p -161.44 43.5 0.16 Allowed 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 126.634 1.973 . . . . 0.0 111.533 174.365 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -152.4 -177.47 6.23 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 177.585 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -50.1 154.89 1.05 Allowed 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 124.343 2.021 . . . . 0.0 113.026 160.621 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 25.8 tttp 178.21 106.85 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 111.544 -2.571 . . . . 0.0 108.652 -161.237 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.1 mmpt? -61.87 145.47 92.45 Favored Pre-proline 0 N--CA 1.476 0.845 0 O-C-N 121.118 -0.989 . . . . 0.0 110.61 174.079 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.5 171.0 14.96 Favored 'Trans proline' 0 CA--C 1.534 0.517 0 C-N-CA 122.763 2.309 . . . . 0.0 112.427 -175.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.561 ' CD1' ' H ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -128.72 163.33 25.37 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.879 1.272 . . . . 0.0 109.182 177.014 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.561 ' H ' ' CD1' ' A' ' 24' ' ' LEU . 19.4 pttp -132.5 131.06 22.03 Favored Pre-proline 0 N--CA 1.465 0.299 0 C-N-CA 128.258 2.623 . . . . 0.0 107.373 179.18 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -64.14 -24.38 66.13 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 123.893 3.062 . . . . 0.0 114.226 -154.115 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 28.6 p -66.63 -21.26 66.12 Favored 'General case' 0 CA--C 1.558 1.269 0 C-N-CA 124.956 1.302 . . . . 0.0 113.418 175.734 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 40.4 m -111.13 -8.5 14.41 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.714 1.606 . . . . 0.0 114.973 -173.589 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.24 152.23 45.32 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 121.015 -1.053 . . . . 0.0 111.64 -170.113 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 64.9 m 42.77 57.18 11.4 Favored Pre-proline 0 CA--C 1.55 0.962 0 C-N-CA 124.7 1.2 . . . . 0.0 113.928 -173.014 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -63.68 -29.08 69.16 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 123.873 3.049 . . . . 0.0 112.63 -168.036 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -39.37 -72.19 0.07 Allowed 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.688 2.395 . . . . 0.0 115.753 156.299 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -68.72 -24.77 64.51 Favored 'General case' 0 N--CA 1.475 0.815 0 O-C-N 121.029 -1.044 . . . . 0.0 112.169 176.222 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 8.8 tmtt? -60.37 -43.74 96.28 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 120.419 1.463 . . . . 0.0 111.124 172.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 62.5 tttt -58.84 -49.74 76.58 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.858 1.263 . . . . 0.0 111.677 173.169 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.56 -37.17 86.29 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.332 -0.849 . . . . 0.0 112.739 178.131 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 6.6 ttp85 -59.35 -56.48 21.56 Favored 'General case' 0 C--O 1.223 -0.299 0 C-N-CA 125.619 1.568 . . . . 0.0 109.842 175.15 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -69.61 -27.4 65.05 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 115.315 -0.857 . . . . 0.0 112.572 -176.4 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.35 -44.31 91.85 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 120.768 -1.207 . . . . 0.0 112.971 166.356 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -57.76 -31.7 66.75 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 122.454 1.121 . . . . 0.0 111.57 171.964 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 72.3 mt -77.27 -34.33 21.07 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 O-C-N 120.524 -1.36 . . . . 0.0 111.726 177.259 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 70.2 mt -61.92 -34.72 64.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.2 1.0 . . . . 0.0 111.659 167.193 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -70.13 -43.03 71.79 Favored 'General case' 0 CA--C 1.556 1.181 0 N-CA-C 114.12 1.155 . . . . 0.0 114.12 177.104 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.87 -11.71 0.28 Allowed 'General case' 0 N--CA 1.485 1.297 0 N-CA-C 117.828 2.529 . . . . 0.0 117.828 -171.049 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 90.03 162.34 38.25 Favored Glycine 0 CA--C 1.536 1.36 0 CA-C-N 119.612 1.096 . . . . 0.0 112.663 -163.561 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.43 -34.99 68.22 Favored 'General case' 0 N--CA 1.465 0.3 0 O-C-N 120.707 -1.467 . . . . 0.0 113.422 -168.687 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -56.15 -34.9 66.56 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.765 0.826 . . . . 0.0 112.612 178.923 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 79.5 m-70 -90.21 12.15 18.93 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.698 1.599 . . . . 0.0 112.686 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -145.72 11.67 1.27 Allowed 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 124.954 1.302 . . . . 0.0 114.11 -169.286 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -53.73 -26.18 31.64 Favored Glycine 0 N--CA 1.472 1.038 0 CA-C-O 116.354 -2.359 . . . . 0.0 116.879 -169.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 37.1 p-80 -52.56 -33.67 46.79 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 120.997 2.399 . . . . 0.0 113.143 170.147 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -74.16 -38.5 63.69 Favored 'General case' 0 CA--C 1.522 -0.114 0 C-N-CA 125.117 1.367 . . . . 0.0 112.364 171.521 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 2.8 mp -67.91 -34.53 67.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 119.964 -0.695 . . . . 0.0 110.906 175.676 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -74.38 -53.63 9.23 Favored 'General case' 0 N--CA 1.44 -0.957 0 C-N-CA 125.28 1.432 . . . . 0.0 111.557 -176.211 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.23 -38.39 65.68 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.541 -0.724 . . . . 0.0 112.383 175.843 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 17.1 t60 -67.25 -49.81 62.97 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.593 1.157 . . . . 0.0 113.504 173.694 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -48.19 -49.78 31.51 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.632 1.573 . . . . 0.0 112.405 177.326 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -69.36 -39.81 77.86 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.366 0.666 . . . . 0.0 112.053 -176.214 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 48.8 t -50.13 -51.58 42.15 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 123.528 0.731 . . . . 0.0 112.493 167.314 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 36.0 mtp -57.95 -51.79 68.2 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.118 1.367 . . . . 0.0 110.787 172.782 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 45.9 mtt180 -54.9 -29.84 56.92 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 126.097 1.759 . . . . 0.0 114.392 -177.829 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -48.06 -22.06 0.56 Allowed 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 114.793 1.405 . . . . 0.0 114.793 168.071 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.8 mp -95.85 1.89 53.37 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.662 1.585 . . . . 0.0 112.186 -173.836 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 86.76 15.04 64.08 Favored Glycine 0 CA--C 1.535 1.33 0 C-N-CA 124.744 1.164 . . . . 0.0 113.07 -169.746 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -71.73 141.06 49.79 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 126.576 1.95 . . . . 0.0 111.524 -179.167 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -101.2 93.71 5.59 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.332 1.453 . . . . 0.0 108.344 -178.31 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.126 0 C-N-CA 127.544 2.338 . . . . 0.0 109.313 -177.683 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.319 0 N-CA-C 108.325 -1.91 . . . . 0.0 108.325 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 12.2 m -145.88 155.25 42.76 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.156 0.982 . . . . 0.0 109.792 -170.333 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 -143.27 154.5 43.87 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 123.881 0.872 . . . . 0.0 111.045 -172.414 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 4.0 m -148.88 157.94 43.8 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 125.41 1.484 . . . . 0.0 109.12 -174.278 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 35.8 tpp -127.59 72.52 78.0 Favored Pre-proline 0 N--CA 1.472 0.665 0 C-N-CA 123.671 0.789 . . . . 0.0 112.099 176.39 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -76.87 37.38 0.57 Allowed 'Trans proline' 0 CA--C 1.549 1.236 0 C-N-CA 124.0 3.134 . . . . 0.0 112.072 173.623 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -156.35 41.79 0.56 Allowed Glycine 0 CA--C 1.529 0.911 0 O-C-N 121.293 -0.879 . . . . 0.0 114.601 -163.725 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -138.23 170.23 16.39 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.384 1.074 . . . . 0.0 111.554 174.524 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 14.7 p -152.28 150.75 12.69 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 125.24 1.416 . . . . 0.0 109.407 173.219 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.4 p-10 -132.96 -9.08 3.06 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 126.177 1.791 . . . . 0.0 113.58 -172.092 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.3 m -86.66 29.44 0.79 Allowed 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 114.781 1.4 . . . . 0.0 114.781 -140.628 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -132.81 73.98 75.09 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 125.811 1.644 . . . . 0.0 110.022 -177.062 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -73.89 178.42 6.86 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 124.119 3.212 . . . . 0.0 112.367 -179.814 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -72.08 156.24 90.96 Favored Pre-proline 0 CA--C 1.547 0.837 0 C-N-CA 124.62 1.168 . . . . 0.0 112.236 172.509 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -70.24 162.06 43.71 Favored 'Trans proline' 0 CA--C 1.545 1.069 0 C-N-CA 122.884 2.39 . . . . 0.0 111.492 164.62 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -73.09 178.99 5.83 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 123.248 2.632 . . . . 0.0 112.534 171.23 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -66.34 149.26 50.64 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.869 1.268 . . . . 0.0 113.96 -178.742 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.3 m -65.48 27.38 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 127.512 2.325 . . . . 0.0 114.8 168.176 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 10.3 tm0? -65.1 128.45 35.84 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.157 1.383 . . . . 0.0 110.938 -174.091 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 62.93 171.83 0.15 Allowed 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 127.767 2.427 . . . . 0.0 116.694 176.322 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.544 ' HD3' ' H ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -70.68 137.48 49.84 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 113.897 -1.502 . . . . 0.0 109.404 156.419 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.8 mptt -133.03 161.11 65.78 Favored Pre-proline 0 N--CA 1.475 0.777 0 C-N-CA 125.003 1.321 . . . . 0.0 111.266 179.071 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -80.6 168.41 17.96 Favored 'Trans proline' 0 CA--C 1.535 0.546 0 C-N-CA 122.986 2.457 . . . . 0.0 112.131 175.196 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.601 ' CD1' ' H ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -100.48 163.62 12.28 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.193 0.997 . . . . 0.0 109.939 169.03 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.601 ' H ' ' CD1' ' A' ' 24' ' ' LEU . 19.1 pttp -139.39 129.93 14.53 Favored Pre-proline 0 CA--C 1.534 0.361 0 C-N-CA 129.668 3.187 . . . . 0.0 107.101 178.569 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -63.87 -24.49 67.92 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 124.121 3.214 . . . . 0.0 113.919 -155.43 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 19.1 p -65.96 -16.36 63.81 Favored 'General case' 0 CA--C 1.558 1.267 0 C-N-CA 125.488 1.515 . . . . 0.0 113.352 175.746 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 52.4 m -118.68 -6.31 10.64 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.358 1.863 . . . . 0.0 114.804 -176.549 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.421 ' HB2' ' CE2' ' A' ' 65' ' ' PHE . . . -65.47 151.67 45.8 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.183 -0.948 . . . . 0.0 110.968 -175.143 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 21.3 m 37.69 56.06 4.17 Favored Pre-proline 0 CA--C 1.549 0.92 0 N-CA-C 114.227 1.195 . . . . 0.0 114.227 -174.906 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -66.9 -11.47 32.27 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 123.149 2.566 . . . . 0.0 112.695 -166.24 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 38.0 mm-40 -88.02 -41.56 13.02 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.468 1.507 . . . . 0.0 112.44 -177.465 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -64.0 -35.31 80.28 Favored 'General case' 0 N--CA 1.48 1.049 0 O-C-N 120.635 -1.291 . . . . 0.0 110.674 158.297 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.432 ' HE2' ' OD2' ' A' ' 38' ' ' ASP . 17.3 tttt -59.82 -42.6 93.88 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 119.484 1.038 . . . . 0.0 112.656 175.475 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.4 mttt -55.43 -50.01 70.93 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 125.513 1.525 . . . . 0.0 110.552 176.432 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.46 -34.34 76.97 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.83 0.852 . . . . 0.0 113.018 174.645 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.408 ' CG ' HG13 ' A' ' 53' ' ' ILE . 4.3 ttp180 -59.48 -54.89 41.42 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.892 1.277 . . . . 0.0 109.943 176.568 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.432 ' OD2' ' HE2' ' A' ' 34' ' ' LYS . 84.2 m-20 -74.46 -28.69 61.14 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.526 1.13 . . . . 0.0 111.596 -175.4 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.01 -39.95 94.01 Favored 'General case' 0 CA--C 1.547 0.834 0 O-C-N 120.637 -1.289 . . . . 0.0 113.356 163.885 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.6 t -59.64 -34.07 72.33 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.007 -1.058 . . . . 0.0 111.435 173.467 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 91.4 mt -71.85 -35.14 53.71 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 O-C-N 120.62 -1.3 . . . . 0.0 111.183 176.172 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 87.6 mt -63.79 -35.45 73.14 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 124.05 0.94 . . . . 0.0 111.985 169.503 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -69.95 -43.62 71.2 Favored 'General case' 0 CA--C 1.556 1.21 0 N-CA-C 114.053 1.131 . . . . 0.0 114.053 177.611 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.51 -15.26 0.38 Allowed 'General case' 0 N--CA 1.485 1.31 0 N-CA-C 116.874 2.176 . . . . 0.0 116.874 -170.147 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 92.55 164.31 38.05 Favored Glycine 0 CA--C 1.536 1.36 0 CA-C-O 122.153 0.863 . . . . 0.0 113.148 -165.907 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -68.89 -41.99 77.56 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 -164.658 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -55.7 -34.83 65.44 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.771 1.228 . . . . 0.0 113.804 175.993 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 68.8 m-70 -87.64 12.23 13.13 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.561 1.145 . . . . 0.0 112.342 -176.592 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 1.2 m -141.41 2.59 1.66 Allowed 'General case' 0 N--CA 1.438 -1.064 0 C-N-CA 124.739 1.216 . . . . 0.0 114.163 -167.315 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -54.23 -21.16 17.94 Favored Glycine 0 N--CA 1.474 1.181 0 N-CA-C 118.136 2.014 . . . . 0.0 118.136 -167.427 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 30.1 p-80 -55.32 -36.79 66.6 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 121.72 2.76 . . . . 0.0 113.41 166.5 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.2 -41.6 85.54 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 125.377 1.471 . . . . 0.0 111.072 170.699 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.697 HG22 ' HD3' ' A' ' 57' ' ' LYS . 2.8 mp -70.04 -39.44 77.29 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 CA-C-N 118.73 0.695 . . . . 0.0 109.708 -178.683 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.08 -51.73 50.75 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 125.461 1.504 . . . . 0.0 112.62 -177.985 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.55 -38.58 84.95 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.479 0.657 . . . . 0.0 112.413 176.588 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 21.0 t60 -65.31 -48.29 73.59 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.648 0.779 . . . . 0.0 112.759 173.638 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.697 ' HD3' HG22 ' A' ' 53' ' ' ILE . 35.2 mtpt -52.11 -47.69 65.17 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.607 1.163 . . . . 0.0 112.617 171.833 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -57.74 -44.77 86.26 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.461 1.028 . . . . 0.0 112.375 172.863 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 38.1 t -56.09 -50.07 72.06 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 118.681 0.673 . . . . 0.0 112.299 175.868 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 71.8 mtm -59.06 -50.92 72.24 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 121.291 -0.88 . . . . 0.0 111.013 171.358 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 15.9 mtt180 -55.82 -30.89 62.12 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 126.068 1.747 . . . . 0.0 113.743 -174.929 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -44.66 -34.84 2.35 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.702 1.201 . . . . 0.0 113.749 168.304 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.1 mp -81.26 8.86 7.99 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 123.992 0.917 . . . . 0.0 112.744 -173.177 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 75.87 22.06 75.22 Favored Glycine 0 CA--C 1.533 1.194 0 C-N-CA 125.54 1.543 . . . . 0.0 112.408 -167.885 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.47 ' HB3' HG13 ' A' ' 67' ' ' ILE . 0.1 OUTLIER -78.06 129.25 35.0 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 126.354 1.862 . . . . 0.0 110.974 -172.427 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.4 mppt? -82.6 78.92 9.16 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.476 1.51 . . . . 0.0 109.391 -178.089 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.47 HG13 ' HB3' ' A' ' 65' ' ' PHE . 0.4 OUTLIER . . . . . 0 C--O 1.247 0.934 0 C-N-CA 125.898 1.679 . . . . 0.0 109.731 -176.041 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 38.7 m . . . . . 0 CA--C 1.553 1.085 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.6 -24.67 30.16 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.429 2.752 . . . . 0.0 112.309 -158.331 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -63.07 -48.3 79.25 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.458 1.903 . . . . 0.0 113.789 169.219 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.48 -34.27 74.1 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 119.483 1.038 . . . . 0.0 111.732 168.707 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 7.0 tmtt? -58.8 -45.49 89.79 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.895 1.278 . . . . 0.0 112.211 173.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 72.6 tttt -55.51 -51.22 67.73 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 126.427 1.891 . . . . 0.0 111.422 172.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.05 -37.97 89.36 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 114.796 -1.093 . . . . 0.0 112.641 178.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 10.2 ttp85 -59.94 -57.25 13.66 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.767 1.227 . . . . 0.0 110.178 174.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 62.0 m-20 -69.18 -29.74 67.79 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.163 0.985 . . . . 0.0 112.67 -175.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.61 -41.41 96.22 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 120.542 -1.349 . . . . 0.0 112.35 168.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.8 t -57.67 -34.53 69.49 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 122.21 1.005 . . . . 0.0 111.76 172.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 64.3 mt -77.11 -33.76 20.75 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 C-N-CA 125.182 1.393 . . . . 0.0 112.257 178.429 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 74.0 mt -64.99 -34.97 74.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 124.052 0.941 . . . . 0.0 111.395 168.365 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -72.92 -36.03 67.17 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 114.54 1.311 . . . . 0.0 114.54 177.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -139.24 -58.64 0.59 Allowed 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 125.078 1.351 . . . . 0.0 113.788 175.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 139.79 161.93 8.91 Favored Glycine 0 CA--C 1.53 1.003 0 C-N-CA 126.278 1.894 . . . . 0.0 109.558 -159.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.489 ' HB3' HD11 ' A' ' 53' ' ' ILE . 0.3 OUTLIER -73.45 -28.49 61.99 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 120.993 -1.298 . . . . 0.0 112.928 -169.102 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -55.98 -33.67 65.03 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 123.501 0.72 . . . . 0.0 112.444 177.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -85.81 5.82 30.89 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.989 1.316 . . . . 0.0 113.067 178.269 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 6.1 m -148.22 16.05 1.04 Allowed 'General case' 0 N--CA 1.441 -0.887 0 C-N-CA 125.307 1.443 . . . . 0.0 113.094 -154.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . 0.689 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -65.84 -27.83 73.1 Favored Glycine 0 C--O 1.213 -1.173 0 O-C-N 120.19 -1.568 . . . . 0.0 114.658 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 41.6 p-80 -56.54 -25.18 51.19 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 120.666 2.233 . . . . 0.0 113.933 166.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.85 -34.57 30.06 Favored 'General case' 0 C--O 1.231 0.113 0 C-N-CA 123.837 0.855 . . . . 0.0 110.664 172.551 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.689 HD12 ' HA2' ' A' ' 50' ' ' GLY . 33.2 mt -70.43 -40.38 77.49 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.598 0 CA-C-O 118.72 -0.657 . . . . 0.0 109.711 177.454 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.54 -50.74 49.66 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 125.004 1.322 . . . . 0.0 111.912 -175.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.99 -37.47 66.6 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 121.152 -0.968 . . . . 0.0 113.006 173.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 14.5 t60 -72.45 -44.26 62.61 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.508 1.123 . . . . 0.0 113.901 174.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.86 -54.75 25.53 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.769 1.628 . . . . 0.0 110.956 175.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.431 ' HA ' ' HB2' ' A' ' 61' ' ' ARG . 11.2 mm-40 -72.18 -33.85 67.98 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 122.773 0.429 . . . . 0.0 111.692 -174.041 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 48.8 t -48.51 -60.45 2.68 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-O 118.505 -0.76 . . . . 0.0 112.3 162.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 78.3 mtm -52.66 -45.61 66.83 Favored 'General case' 0 N--CA 1.486 1.331 0 CA-C-N 120.027 1.285 . . . . 0.0 111.388 171.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.431 ' HB2' ' HA ' ' A' ' 58' ' ' GLU . 2.4 ttt85 -51.91 -39.03 58.42 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 114.378 1.251 . . . . 0.0 114.378 -175.17 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.446 ' HB3' HD12 ' A' ' 63' ' ' LEU . . . -47.33 -36.24 9.16 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.619 1.167 . . . . 0.0 113.25 172.848 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.446 HD12 ' HB3' ' A' ' 62' ' ' ALA . 5.7 mp -82.65 9.57 9.26 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 125.209 1.404 . . . . 0.0 111.658 -172.705 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.53 40.82 5.59 Favored Glycine 0 CA--C 1.532 1.138 0 C-N-CA 125.046 1.307 . . . . 0.0 113.274 177.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -112.28 143.65 43.01 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 121.507 -0.996 . . . . 0.0 112.273 -151.009 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? -92.54 79.87 4.86 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 125.8 1.64 . . . . 0.0 108.805 -173.306 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.427 ' OXT' HG22 ' A' ' 67' ' ' ILE . 39.2 mm . . . . . 0 CA--C 1.552 1.039 0 C-N-CA 128.81 2.844 . . . . 0.0 110.604 -161.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 28.5 m . . . . . 0 CA--C 1.55 0.949 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.12 -17.2 36.06 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.521 2.148 . . . . 0.0 112.47 -156.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -82.87 -38.78 22.47 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.575 1.55 . . . . 0.0 112.019 -178.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.2 p -71.06 -31.43 67.84 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 121.055 -1.028 . . . . 0.0 111.51 161.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 10.3 tmtt? -59.15 -47.54 84.9 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 120.096 1.316 . . . . 0.0 111.785 172.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 44.2 mttt -52.81 -51.94 58.88 Favored 'General case' 0 C--O 1.225 -0.217 0 C-N-CA 126.901 2.08 . . . . 0.0 111.823 171.179 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.08 -37.17 83.51 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -179.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 13.1 ttp85 -59.45 -55.33 36.06 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 124.709 1.203 . . . . 0.0 109.865 174.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -72.4 -29.41 63.71 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 115.414 -0.812 . . . . 0.0 112.41 -174.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.88 -44.65 96.38 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 120.795 -1.19 . . . . 0.0 112.039 165.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.0 t -55.96 -34.61 65.85 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 122.275 1.036 . . . . 0.0 111.678 173.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 66.6 mt -76.42 -32.46 21.73 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 125.274 1.43 . . . . 0.0 112.613 178.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 83.4 mt -66.59 -38.33 81.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 123.878 0.871 . . . . 0.0 110.868 167.273 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -72.03 -38.82 69.48 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 114.49 1.292 . . . . 0.0 114.49 -179.376 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.7 mppt? -137.77 -33.84 0.7 Allowed 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 115.993 1.849 . . . . 0.0 115.993 -177.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 101.79 156.7 26.44 Favored Glycine 0 CA--C 1.532 1.149 0 C-N-CA 124.605 1.098 . . . . 0.0 111.738 -157.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.499 ' HB3' HD11 ' A' ' 53' ' ' ILE . 0.5 OUTLIER -69.96 -27.68 64.93 Favored 'General case' 0 N--CA 1.466 0.367 0 O-C-N 121.148 -1.207 . . . . 0.0 113.059 -166.837 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -56.12 -27.59 54.54 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 123.725 0.81 . . . . 0.0 112.843 176.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -96.3 8.72 43.21 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.368 1.067 . . . . 0.0 112.847 177.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 3.7 m -146.83 17.58 1.26 Allowed 'General case' 0 N--CA 1.443 -0.811 0 C-N-CA 125.547 1.539 . . . . 0.0 112.407 -155.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . 0.741 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -68.77 -25.72 74.99 Favored Glycine 0 C--O 1.217 -0.935 0 CA-C-O 116.918 -2.046 . . . . 0.0 114.905 -177.629 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 38.9 p-80 -56.07 -28.52 57.91 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 120.016 1.908 . . . . 0.0 112.978 165.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.42 -34.8 35.9 Favored 'General case' 0 C--N 1.34 0.172 0 C-N-CA 123.856 0.862 . . . . 0.0 110.459 175.016 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.741 HD12 ' HA2' ' A' ' 50' ' ' GLY . 36.1 mt -69.76 -40.75 79.5 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.663 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 176.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -64.52 -52.43 57.82 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 125.625 1.57 . . . . 0.0 111.173 179.123 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.25 -40.04 58.0 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 113.453 0.909 . . . . 0.0 113.453 174.342 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 11.2 t60 -71.19 -42.79 68.57 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 114.193 1.182 . . . . 0.0 114.193 173.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.32 -52.5 65.11 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.737 1.215 . . . . 0.0 111.978 177.147 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -69.54 -33.94 73.5 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 123.145 0.578 . . . . 0.0 111.318 -176.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 48.7 t -49.35 -60.97 2.36 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-O 118.62 -0.705 . . . . 0.0 111.795 161.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 78.9 mtm -54.13 -45.14 71.86 Favored 'General case' 0 N--CA 1.483 1.217 0 CA-C-N 120.03 1.286 . . . . 0.0 112.712 175.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 47.8 mtt180 -52.18 -35.31 48.65 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 121.028 1.74 . . . . 0.0 113.976 -179.234 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.558 ' HB3' HD12 ' A' ' 63' ' ' LEU . . . -47.74 -40.12 19.61 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 113.908 1.077 . . . . 0.0 113.908 168.495 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.558 HD12 ' HB3' ' A' ' 62' ' ' ALA . 4.0 mp -82.75 10.2 8.13 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 126.458 1.903 . . . . 0.0 112.029 -172.686 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.84 30.83 13.73 Favored Glycine 0 CA--C 1.535 1.333 0 C-N-CA 124.732 1.158 . . . . 0.0 114.348 176.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.432 ' C ' ' HE3' ' A' ' 66' ' ' LYS . 0.3 OUTLIER -100.14 152.36 20.35 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.793 1.237 . . . . 0.0 114.105 -154.3 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.432 ' HE3' ' C ' ' A' ' 65' ' ' PHE . 0.4 OUTLIER -92.39 75.96 5.2 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 125.866 1.666 . . . . 0.0 108.955 -174.905 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 28.5 mm . . . . . 0 C--O 1.249 1.059 0 C-N-CA 127.798 2.439 . . . . 0.0 111.113 -158.321 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 56.9 m . . . . . 0 CA--C 1.544 0.743 0 N-CA-C 113.82 1.045 . . . . 0.0 113.82 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_endo -69.19 -22.67 34.37 Favored 'Trans proline' 0 CA--C 1.534 0.509 0 C-N-CA 123.425 2.75 . . . . 0.0 112.552 -157.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -63.1 -62.45 1.69 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.967 2.107 . . . . 0.0 112.812 171.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.8 p -61.12 -30.83 70.61 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 118.187 -0.911 . . . . 0.0 111.694 170.592 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 8.1 tmtt? -59.09 -49.68 76.95 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 120.052 1.296 . . . . 0.0 111.659 171.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 16.1 tttp -63.26 -43.06 99.04 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.783 0.833 . . . . 0.0 111.436 176.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.19 -39.37 92.5 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.49 0.716 . . . . 0.0 112.86 176.082 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 8.2 ttp85 -58.26 -54.62 44.98 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.551 1.54 . . . . 0.0 109.405 173.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 78.5 m-20 -68.78 -33.56 74.09 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.039 0.936 . . . . 0.0 113.442 -176.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.4 -37.32 82.92 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 120.588 -1.32 . . . . 0.0 112.854 171.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.1 t -57.19 -38.54 73.82 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.723 0.773 . . . . 0.0 111.225 168.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 67.0 mt -75.43 -30.17 22.01 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 C-N-CA 124.95 1.3 . . . . 0.0 112.27 -176.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 67.2 mt -58.18 -45.38 88.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 CA-C-N 119.028 0.831 . . . . 0.0 110.377 163.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.67 -37.35 79.53 Favored 'General case' 0 CA--C 1.552 1.05 0 N-CA-C 115.024 1.491 . . . . 0.0 115.024 -174.284 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.87 -8.63 0.41 Allowed 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 117.57 2.433 . . . . 0.0 117.57 -176.555 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 82.96 165.62 37.88 Favored Glycine 0 CA--C 1.536 1.358 0 CA-C-N 119.773 1.17 . . . . 0.0 112.531 -164.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -76.69 -30.92 56.91 Favored 'General case' 0 CA--C 1.516 -0.349 0 O-C-N 120.311 -1.699 . . . . 0.0 114.401 -164.735 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -58.94 -35.87 73.83 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 123.229 0.33 . . . . 0.0 111.462 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 -82.83 4.42 25.51 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.967 1.707 . . . . 0.0 112.986 177.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.407 ' HA ' ' CE1' ' A' ' 51' ' ' HIS . 1.8 m -139.3 18.0 2.58 Favored 'General case' 0 N--CA 1.442 -0.86 0 C-N-CA 127.794 2.438 . . . . 0.0 112.154 -168.125 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . 0.712 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -69.93 -19.38 75.26 Favored Glycine 0 C--O 1.221 -0.658 0 O-C-N 119.751 -1.843 . . . . 0.0 115.56 -176.251 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . 0.407 ' CE1' ' HA ' ' A' ' 49' ' ' CYS . 38.4 p-80 -58.24 -34.65 70.68 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 120.18 1.99 . . . . 0.0 112.352 162.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.65 -32.87 60.38 Favored 'General case' 0 CA--C 1.52 -0.201 0 C-N-CA 125.326 1.45 . . . . 0.0 110.774 174.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.712 HD12 ' HA2' ' A' ' 50' ' ' GLY . 5.1 mt -66.72 -39.28 83.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 118.843 -1.143 . . . . 0.0 110.748 167.641 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -74.63 -47.98 28.96 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 -170.352 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.79 -39.99 72.05 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 121.597 0.713 . . . . 0.0 112.138 170.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 18.5 t60 -65.36 -48.96 71.12 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.73 0.812 . . . . 0.0 112.913 174.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 52.7 mttm -48.13 -47.18 34.84 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 124.885 1.274 . . . . 0.0 112.168 177.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -75.79 -25.95 56.87 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 117.844 -1.074 . . . . 0.0 113.045 -177.286 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 37.6 t -58.55 -58.31 9.12 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-O 118.376 -0.821 . . . . 0.0 111.545 160.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 9.3 mmm -47.15 -45.23 22.52 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-N 120.341 1.428 . . . . 0.0 111.36 174.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 1.9 mtt85 -63.07 -32.42 73.79 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 117.028 -1.463 . . . . 0.0 114.134 -171.147 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -50.48 -36.83 35.44 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 118.985 0.811 . . . . 0.0 112.613 170.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 4.9 mp -82.52 8.04 12.81 Favored 'General case' 0 CA--C 1.554 1.098 0 C-N-CA 125.817 1.647 . . . . 0.0 112.003 -173.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.75 41.21 5.42 Favored Glycine 0 CA--C 1.534 1.266 0 C-N-CA 124.864 1.221 . . . . 0.0 114.788 171.153 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -119.75 145.83 46.2 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 120.725 -1.456 . . . . 0.0 114.031 -142.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -91.64 89.56 7.19 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.429 1.892 . . . . 0.0 109.158 -176.198 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 23.9 mm . . . . . 0 C--O 1.25 1.114 0 C-N-CA 126.707 2.003 . . . . 0.0 111.848 -158.143 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.6 m . . . . . 0 CA--C 1.549 0.919 0 N-CA-C 114.21 1.189 . . . . 0.0 114.21 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -65.3 -24.35 58.08 Favored 'Trans proline' 0 CA--C 1.538 0.701 0 C-N-CA 122.483 2.122 . . . . 0.0 112.328 -160.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -58.37 -52.01 67.39 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 127.065 2.146 . . . . 0.0 111.843 177.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.9 p -76.5 -38.26 55.5 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.289 1.436 . . . . 0.0 111.565 170.247 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 6.4 tmtt? -52.73 -46.87 67.62 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 120.102 1.319 . . . . 0.0 112.057 179.048 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.5 tmmm? -51.97 -55.0 23.09 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 126.959 2.104 . . . . 0.0 112.183 171.094 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.5 -35.02 79.23 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 114.393 -1.276 . . . . 0.0 112.634 -177.004 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 7.5 ttp85 -62.6 -54.98 31.51 Favored 'General case' 0 C--O 1.222 -0.368 0 C-N-CA 125.766 1.626 . . . . 0.0 109.444 174.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -71.45 -28.16 63.77 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -175.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.86 -41.22 87.68 Favored 'General case' 0 CA--C 1.544 0.75 0 O-C-N 120.549 -1.344 . . . . 0.0 112.965 167.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 6.2 t -55.5 -37.39 67.8 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 122.271 1.034 . . . . 0.0 111.044 169.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 73.5 mt -75.39 -31.27 23.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 O-C-N 121.052 -1.03 . . . . 0.0 111.949 -179.374 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 86.0 mt -64.11 -35.76 74.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 CA-C-N 118.825 0.738 . . . . 0.0 111.641 166.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 27.2 mt-10 -75.03 -36.66 61.87 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 178.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.411 ' HG3' ' HB2' ' A' ' 48' ' ' HIS . 0.0 OUTLIER -148.68 -11.13 0.34 Allowed 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 118.083 2.623 . . . . 0.0 118.083 -173.666 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 86.78 166.7 42.82 Favored Glycine 0 CA--C 1.539 1.55 0 CA-C-N 120.035 1.289 . . . . 0.0 112.908 -163.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -76.44 -30.53 57.41 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 120.351 -1.676 . . . . 0.0 113.58 -168.388 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -58.25 -33.34 69.26 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 123.155 0.582 . . . . 0.0 112.258 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . 0.411 ' HB2' ' HG3' ' A' ' 44' ' ' LYS . 93.9 m-70 -88.58 10.9 18.82 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.715 1.606 . . . . 0.0 112.591 178.767 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 2.7 m -141.2 14.91 2.23 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 126.294 1.838 . . . . 0.0 113.85 -162.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -60.29 -32.73 77.78 Favored Glycine 0 C--O 1.213 -1.189 0 O-C-N 120.152 -1.593 . . . . 0.0 115.264 -176.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 41.8 p-80 -55.37 -25.55 36.01 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 121.963 2.881 . . . . 0.0 114.439 169.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -79.89 -36.56 36.35 Favored 'General case' 0 C--N 1.339 0.119 0 C-N-CA 123.948 0.899 . . . . 0.0 111.379 170.066 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 42.6 mt -75.89 -33.52 25.64 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.391 0 CA-C-O 119.092 -0.48 . . . . 0.0 110.184 -177.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.519 ' HG3' ' HE3' ' A' ' 57' ' ' LYS . 1.5 mp0 -70.24 -53.23 17.88 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 125.48 1.512 . . . . 0.0 112.781 177.382 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -53.37 -35.11 59.94 Favored 'General case' 0 CA--C 1.545 0.752 0 O-C-N 121.267 -0.895 . . . . 0.0 113.028 173.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 19.2 t60 -73.9 -43.18 59.27 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.535 1.134 . . . . 0.0 113.931 174.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.519 ' HE3' ' HG3' ' A' ' 54' ' ' GLU . 26.3 mtmt -53.16 -52.21 59.51 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 125.275 1.43 . . . . 0.0 111.339 175.302 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -66.56 -37.58 85.27 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 122.99 0.516 . . . . 0.0 111.586 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 18.6 t -52.57 -59.64 4.21 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-O 117.805 -1.093 . . . . 0.0 112.162 167.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 92.9 mtp -47.6 -51.6 20.63 Favored 'General case' 0 N--CA 1.488 1.464 0 CA-C-N 120.69 1.586 . . . . 0.0 110.821 171.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 37.5 mtt180 -54.91 -34.8 63.47 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 125.453 1.501 . . . . 0.0 114.0 -177.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -48.45 -39.09 21.61 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 119.203 0.91 . . . . 0.0 113.192 169.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.6 mp -81.0 8.86 7.47 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 124.84 1.256 . . . . 0.0 111.746 -173.704 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 86.65 18.81 57.82 Favored Glycine 0 CA--C 1.535 1.334 0 C-N-CA 125.278 1.418 . . . . 0.0 114.404 -178.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -72.59 170.67 13.95 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.538 1.535 . . . . 0.0 114.846 -166.039 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.31 88.93 3.01 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 125.103 1.361 . . . . 0.0 108.369 -177.158 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 26.0 mm . . . . . 0 C--O 1.244 0.765 0 C-N-CA 130.69 3.596 . . . . 0.0 107.458 -162.392 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 56.7 m . . . . . 0 CA--C 1.547 0.852 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -69.65 -24.09 30.57 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 123.319 2.679 . . . . 0.0 112.776 -158.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.41 ' HG3' ' H ' ' A' ' 33' ' ' THR . 0.1 OUTLIER -53.48 -69.83 0.11 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 127.785 2.434 . . . . 0.0 113.76 164.177 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.41 ' H ' ' HG3' ' A' ' 32' ' ' GLU . 0.0 OUTLIER -60.84 -35.28 76.13 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 126.129 1.771 . . . . 0.0 110.96 176.554 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 9.2 tmtm? -53.41 -52.01 60.74 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.969 1.708 . . . . 0.0 112.264 169.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 50.4 tttm -58.5 -47.89 82.6 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.806 0.842 . . . . 0.0 111.984 175.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.14 -39.76 95.61 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 114.731 -1.122 . . . . 0.0 112.209 -178.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 11.8 ttp85 -61.48 -57.12 13.44 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 125.729 1.612 . . . . 0.0 109.918 174.453 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -66.35 -28.51 68.72 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.851 0.861 . . . . 0.0 112.92 -176.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.97 -42.39 80.92 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 120.216 -1.552 . . . . 0.0 112.646 169.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.7 t -55.43 -34.41 64.42 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 122.173 0.987 . . . . 0.0 111.545 171.386 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 61.8 mt -77.36 -33.55 19.89 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 C-N-CA 125.381 1.472 . . . . 0.0 112.428 178.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 73.2 mt -66.05 -34.06 67.69 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 123.883 0.873 . . . . 0.0 111.44 168.207 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -74.01 -36.3 64.45 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.013 1.325 . . . . 0.0 114.509 178.595 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.7 mppt? -138.43 -55.97 0.64 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.162 1.385 . . . . 0.0 113.646 175.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 136.75 163.54 9.82 Favored Glycine 0 CA--C 1.532 1.103 0 C-N-CA 126.32 1.914 . . . . 0.0 109.6 -159.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.521 ' HB3' HD11 ' A' ' 53' ' ' ILE . 0.2 OUTLIER -74.1 -28.22 61.26 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 120.927 -1.337 . . . . 0.0 112.893 -169.091 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 -57.49 -32.49 67.06 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 178.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -84.79 5.22 29.46 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.941 1.296 . . . . 0.0 113.13 177.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 6.9 m -147.47 16.11 1.14 Allowed 'General case' 0 N--CA 1.441 -0.901 0 C-N-CA 125.067 1.347 . . . . 0.0 113.107 -154.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . 0.643 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -65.76 -27.59 72.84 Favored Glycine 0 C--O 1.216 -0.983 0 O-C-N 120.115 -1.615 . . . . 0.0 114.964 -179.549 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 40.8 p-80 -54.93 -25.58 30.34 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 120.973 2.386 . . . . 0.0 113.852 165.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.58 -34.04 31.24 Favored 'General case' 0 N--CA 1.462 0.135 0 C-N-CA 123.718 0.807 . . . . 0.0 110.956 173.081 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.643 HD12 ' HA2' ' A' ' 50' ' ' GLY . 35.9 mt -74.45 -38.57 46.77 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-O 119.202 -0.428 . . . . 0.0 110.626 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.68 -53.12 56.29 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 125.851 1.66 . . . . 0.0 111.404 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -56.37 -40.5 74.66 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.052 -1.03 . . . . 0.0 112.65 177.324 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 15.5 t60 -68.31 -48.12 65.75 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.937 1.295 . . . . 0.0 113.737 177.14 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 4.1 mtpp -48.97 -53.05 21.5 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 126.258 1.823 . . . . 0.0 111.498 174.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 34.8 mm-40 -72.9 -36.82 67.38 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.206 0.602 . . . . 0.0 111.564 -176.346 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 48.6 t -49.89 -56.49 10.31 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.594 0.757 . . . . 0.0 112.16 165.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 8.1 mtp -54.36 -53.59 51.96 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.89 1.276 . . . . 0.0 110.168 174.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 57.9 mtt180 -53.34 -30.93 41.93 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 126.137 1.775 . . . . 0.0 114.683 -176.362 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -47.56 -35.89 9.71 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.346 1.058 . . . . 0.0 112.911 169.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.3 mp -79.0 5.62 11.27 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.909 1.283 . . . . 0.0 112.381 -172.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.56 8.6 70.31 Favored Glycine 0 CA--C 1.535 1.291 0 C-N-CA 125.899 1.714 . . . . 0.0 113.049 -170.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -72.36 160.74 31.85 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 127.407 2.283 . . . . 0.0 112.74 -172.656 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.9 94.44 4.68 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.727 1.211 . . . . 0.0 108.131 -179.245 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.308 0 C-N-CA 127.469 2.308 . . . . 0.0 109.676 174.276 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 53.6 m . . . . . 0 CA--C 1.549 0.925 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -68.98 -7.93 22.17 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 123.906 3.071 . . . . 0.0 113.578 -158.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 36.2 mm-40 -96.37 -43.54 7.62 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 125.215 1.406 . . . . 0.0 110.685 -176.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.1 p -66.58 -27.26 67.59 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 117.948 -1.025 . . . . 0.0 111.99 161.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 9.8 tmtt? -58.32 -55.43 35.11 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 120.276 1.398 . . . . 0.0 111.457 169.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.6 mttp -55.16 -43.38 74.19 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 125.355 1.462 . . . . 0.0 112.458 172.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.61 -39.8 80.67 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 177.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 12.0 ttp85 -58.49 -53.25 60.44 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.514 1.125 . . . . 0.0 109.106 176.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -74.37 -30.11 61.84 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 115.124 -0.944 . . . . 0.0 112.817 -174.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.49 -43.32 99.08 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 120.772 -1.205 . . . . 0.0 111.794 166.148 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.8 t -56.27 -33.45 65.5 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.952 0.901 . . . . 0.0 111.741 173.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 67.0 mt -77.88 -35.46 20.84 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 124.769 1.228 . . . . 0.0 112.482 177.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 84.4 mt -64.46 -36.29 76.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 124.375 1.07 . . . . 0.0 111.379 168.364 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -71.98 -37.84 69.82 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.761 1.625 . . . . 0.0 113.983 178.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.9 mppt? -139.12 -59.23 0.59 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.582 1.553 . . . . 0.0 113.706 178.043 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 135.61 158.24 8.17 Favored Glycine 0 CA--C 1.531 1.033 0 C-N-CA 126.104 1.811 . . . . 0.0 109.714 -159.102 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.505 ' HB3' HD11 ' A' ' 53' ' ' ILE . 0.4 OUTLIER -72.96 -27.48 61.85 Favored 'General case' 0 N--CA 1.465 0.28 0 O-C-N 120.746 -1.444 . . . . 0.0 113.011 -165.857 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -56.46 -36.18 68.77 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 122.76 0.424 . . . . 0.0 111.76 177.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -81.51 4.46 21.16 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.81 1.244 . . . . 0.0 113.1 177.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 6.0 m -147.81 15.84 1.09 Allowed 'General case' 0 N--CA 1.439 -0.994 0 C-N-CA 125.945 1.698 . . . . 0.0 112.473 -154.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . 0.756 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -75.33 -13.16 83.08 Favored Glycine 0 C--O 1.222 -0.652 0 O-C-N 119.707 -1.87 . . . . 0.0 115.378 -178.061 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 35.2 p-80 -60.65 -33.82 73.38 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.889 1.844 . . . . 0.0 112.214 158.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.84 -37.85 67.28 Favored 'General case' 0 CA--C 1.516 -0.332 0 C-N-CA 124.132 0.973 . . . . 0.0 108.944 177.147 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.756 HD12 ' HA2' ' A' ' 50' ' ' GLY . 17.6 mt -71.23 -43.05 74.91 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.614 0 CA-C-O 118.853 -0.594 . . . . 0.0 109.673 177.617 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -60.93 -46.67 89.75 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 119.43 1.014 . . . . 0.0 112.267 179.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -61.54 -44.52 96.89 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.501 0.72 . . . . 0.0 112.865 175.339 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 14.2 t60 -63.33 -45.42 91.36 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 121.142 -0.973 . . . . 0.0 112.643 174.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.6 mtmt -54.76 -48.29 72.83 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.598 0.759 . . . . 0.0 111.235 173.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 87.3 mt-10 -70.94 -28.29 64.38 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 117.929 -1.034 . . . . 0.0 113.112 -178.563 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 48.9 t -57.02 -60.24 3.88 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 119.183 0.901 . . . . 0.0 111.212 160.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 76.0 mtm -54.05 -45.51 71.69 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 119.576 1.08 . . . . 0.0 113.355 178.212 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 47.7 mtt180 -50.71 -37.28 40.6 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 126.636 1.974 . . . . 0.0 113.292 -178.196 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.57 ' HB3' HD12 ' A' ' 63' ' ' LEU . . . -47.45 -39.08 14.9 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 169.428 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.57 HD12 ' HB3' ' A' ' 62' ' ' ALA . 1.7 mp -84.1 10.26 10.55 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 126.367 1.867 . . . . 0.0 111.571 -172.397 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.11 33.46 10.76 Favored Glycine 0 CA--C 1.534 1.247 0 O-C-N 120.623 -1.298 . . . . 0.0 113.685 -179.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -99.07 156.46 16.92 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.038 1.735 . . . . 0.0 112.749 -168.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 3.1 mppt? -116.37 73.11 0.84 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.0 1.72 . . . . 0.0 109.504 -160.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.028 0 C-N-CA 125.801 1.64 . . . . 0.0 111.759 -165.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 55.6 m . . . . . 0 CA--C 1.548 0.879 0 N-CA-C 113.777 1.028 . . . . 0.0 113.777 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -69.9 -18.22 36.48 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.642 2.228 . . . . 0.0 112.747 -156.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 27.5 mm-40 -85.37 -40.8 16.08 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.691 1.196 . . . . 0.0 112.295 -178.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.4 p -65.53 -30.28 71.01 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 120.725 -1.235 . . . . 0.0 111.328 161.134 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 9.6 tmtt? -60.85 -48.14 83.18 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 120.39 1.45 . . . . 0.0 111.836 171.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 42.4 mttt -55.04 -49.64 71.07 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 126.106 1.763 . . . . 0.0 111.694 171.297 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.17 -36.6 83.51 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 112.921 0.712 . . . . 0.0 112.921 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 8.3 ttp85 -58.87 -53.46 58.18 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.939 1.296 . . . . 0.0 109.6 174.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 60.6 m-20 -70.46 -30.39 67.2 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.78 0.832 . . . . 0.0 112.836 -176.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.42 -39.42 93.8 Favored 'General case' 0 CA--C 1.547 0.857 0 O-C-N 120.418 -1.426 . . . . 0.0 112.969 166.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.8 t -59.73 -32.38 70.49 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 122.773 1.273 . . . . 0.0 112.095 169.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 67.9 mt -75.57 -33.01 25.84 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 O-C-N 120.386 -1.446 . . . . 0.0 111.341 177.522 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 77.3 mt -62.48 -36.63 75.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.617 1.167 . . . . 0.0 112.173 166.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -64.88 -48.67 73.42 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 119.573 1.079 . . . . 0.0 113.269 175.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.4 pttm -155.5 -4.91 0.13 Allowed 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 116.407 2.003 . . . . 0.0 116.407 -160.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 83.71 158.42 26.76 Favored Glycine 0 CA--C 1.527 0.811 0 CA-C-N 119.057 0.844 . . . . 0.0 112.62 -167.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.09 -28.36 68.11 Favored 'General case' 0 C--N 1.334 -0.101 0 O-C-N 121.578 -0.954 . . . . 0.0 112.723 -169.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.416 ' HG3' ' CD2' ' A' ' 48' ' ' HIS . 11.3 pt-20 -59.69 -26.22 65.4 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-O 118.122 -0.942 . . . . 0.0 112.905 175.613 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . 0.416 ' CD2' ' HG3' ' A' ' 47' ' ' GLU . 82.5 m-70 -98.72 15.33 25.64 Favored 'General case' 0 C--N 1.352 0.683 0 CA-C-N 120.61 1.55 . . . . 0.0 110.528 -179.594 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 1.8 m -147.79 14.74 1.07 Allowed 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 125.973 1.709 . . . . 0.0 113.503 -157.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . 0.544 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -67.11 -17.63 68.15 Favored Glycine 0 C--O 1.215 -1.064 0 O-C-N 119.569 -1.957 . . . . 0.0 115.825 -175.508 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 35.2 p-80 -58.94 -33.69 70.89 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 121.572 2.686 . . . . 0.0 112.795 164.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.24 -34.64 61.43 Favored 'General case' 0 N--CA 1.462 0.175 0 C-N-CA 126.354 1.862 . . . . 0.0 111.453 173.737 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.544 HD12 ' HA2' ' A' ' 50' ' ' GLY . 3.5 mt -70.54 -43.44 77.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 118.911 -1.115 . . . . 0.0 110.914 171.058 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -63.02 -53.78 48.54 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.921 0.888 . . . . 0.0 112.278 -176.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -58.45 -32.69 68.95 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.34 -1.475 . . . . 0.0 113.646 178.082 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 10.7 t60 -74.02 -44.67 53.66 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.677 1.191 . . . . 0.0 113.043 175.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.519 ' HD3' HG22 ' A' ' 53' ' ' ILE . 35.0 mtpt -53.54 -53.1 56.46 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.162 1.385 . . . . 0.0 112.07 176.27 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -62.76 -40.62 97.83 Favored 'General case' 0 C--N 1.327 -0.405 0 O-C-N 123.318 0.386 . . . . 0.0 111.713 -176.285 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 44.0 t -51.5 -51.28 56.51 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 124.069 0.948 . . . . 0.0 112.844 169.269 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 72.8 mtm -62.06 -51.72 66.81 Favored 'General case' 0 N--CA 1.481 1.081 0 O-C-N 120.979 -1.076 . . . . 0.0 111.507 171.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 69.0 mtt180 -53.77 -32.37 52.1 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 126.981 2.112 . . . . 0.0 113.87 -175.44 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -44.86 -33.35 1.92 Allowed 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.047 1.339 . . . . 0.0 113.804 168.605 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.3 mp -82.19 5.63 19.2 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.195 0.998 . . . . 0.0 112.375 -173.286 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.29 17.9 75.3 Favored Glycine 0 CA--C 1.534 1.233 0 C-N-CA 125.039 1.304 . . . . 0.0 112.614 -166.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -70.49 144.24 51.45 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.999 1.72 . . . . 0.0 110.692 179.371 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? -106.34 101.72 11.17 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 125.084 1.354 . . . . 0.0 108.979 -175.124 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.252 1.207 0 C-N-CA 128.512 2.725 . . . . 0.0 109.191 -172.027 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 57.4 m . . . . . 0 CA--C 1.552 1.032 0 N-CA-C 114.1 1.148 . . . . 0.0 114.1 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -65.57 -30.84 51.43 Favored 'Trans proline' 0 CA--C 1.534 0.495 0 C-N-CA 123.729 2.953 . . . . 0.0 112.041 -166.092 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -41.5 -70.04 0.12 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 127.349 2.26 . . . . 0.0 115.31 158.365 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -65.25 -28.7 69.53 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.007 -1.058 . . . . 0.0 111.726 177.046 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 5.0 tmtt? -58.12 -46.69 85.15 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 120.359 1.436 . . . . 0.0 111.088 171.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 4.5 tmtm? -63.34 -45.06 92.98 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 123.721 0.808 . . . . 0.0 110.716 176.434 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.78 -42.4 97.46 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 176.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 11.4 ttp85 -59.45 -53.72 54.93 Favored 'General case' 0 C--O 1.221 -0.429 0 C-N-CA 126.148 1.779 . . . . 0.0 110.247 175.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 56.8 m-20 -66.19 -31.97 73.12 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.014 0.926 . . . . 0.0 113.137 179.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -69.22 -37.08 77.87 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 120.728 -1.232 . . . . 0.0 112.447 172.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 9.3 t -55.91 -43.21 77.08 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 121.949 0.88 . . . . 0.0 110.89 169.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 71.4 mt -69.16 -29.01 41.24 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 C-N-CA 124.319 1.048 . . . . 0.0 111.272 -179.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 89.3 mt -70.31 -35.15 61.41 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 C-N-CA 123.509 0.724 . . . . 0.0 112.092 169.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -76.41 -32.58 58.59 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 114.561 1.319 . . . . 0.0 114.561 178.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.414 ' HG3' ' HB2' ' A' ' 48' ' ' HIS . 0.0 OUTLIER -146.2 -18.14 0.44 Allowed 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 117.238 2.31 . . . . 0.0 117.238 -175.413 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 91.33 174.66 43.47 Favored Glycine 0 CA--C 1.536 1.364 0 CA-C-N 118.868 0.758 . . . . 0.0 113.386 -167.179 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -79.6 -35.07 40.13 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 115.592 1.701 . . . . 0.0 115.592 -157.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -60.89 -34.38 74.56 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.086 0.954 . . . . 0.0 113.423 174.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . 0.414 ' HB2' ' HG3' ' A' ' 44' ' ' LYS . 99.4 m-70 -81.92 9.16 8.7 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.574 1.15 . . . . 0.0 112.514 -178.439 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 9.8 m -140.03 12.56 2.43 Favored 'General case' 0 N--CA 1.441 -0.906 0 C-N-CA 125.805 1.642 . . . . 0.0 113.949 -162.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -63.96 -30.11 76.78 Favored Glycine 0 C--O 1.213 -1.182 0 O-C-N 120.126 -1.609 . . . . 0.0 114.973 179.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 40.6 p-80 -57.14 -28.17 62.51 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 121.537 2.668 . . . . 0.0 113.523 167.44 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.83 -36.38 56.9 Favored 'General case' 0 CA--C 1.522 -0.13 0 C-N-CA 123.721 0.808 . . . . 0.0 110.757 171.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.532 HG22 ' HD3' ' A' ' 57' ' ' LYS . 27.9 mt -72.04 -39.68 66.31 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 CA-C-O 119.321 -0.371 . . . . 0.0 110.64 179.335 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.15 -49.12 63.06 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 125.464 1.506 . . . . 0.0 111.594 -177.029 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -58.23 -45.23 88.08 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.912 0.885 . . . . 0.0 112.563 172.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 11.9 t60 -60.49 -45.66 92.93 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 122.184 0.992 . . . . 0.0 112.644 174.142 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.532 ' HD3' HG22 ' A' ' 53' ' ' ILE . 17.0 mtpp -55.34 -48.53 74.07 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.851 1.261 . . . . 0.0 111.283 174.027 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 60.3 mm-40 -60.15 -41.58 93.08 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 120.934 1.697 . . . . 0.0 111.244 177.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 41.8 t -55.88 -52.88 62.54 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.353 0.661 . . . . 0.0 111.582 178.173 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 71.4 mtm -60.32 -45.25 94.05 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.503 0.721 . . . . 0.0 111.116 172.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 25.2 mtm180 -54.67 -32.81 59.88 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 119.821 -1.799 . . . . 0.0 114.051 -178.101 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -44.63 -36.06 2.9 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.12 0.968 . . . . 0.0 113.445 169.434 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.8 mp -79.33 6.62 9.55 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 123.919 0.888 . . . . 0.0 112.644 -173.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 82.93 23.98 54.02 Favored Glycine 0 CA--C 1.534 1.241 0 C-N-CA 125.994 1.759 . . . . 0.0 112.399 -172.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -87.05 154.09 21.03 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.047 1.739 . . . . 0.0 113.052 -156.749 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.5 mmpt? -92.91 72.72 4.8 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.366 1.866 . . . . 0.0 110.543 -172.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 12.5 mm . . . . . 0 C--O 1.252 1.214 0 N-CA-C 114.966 1.469 . . . . 0.0 114.966 -151.781 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.2 m . . . . . 0 CA--C 1.549 0.91 0 N-CA-C 112.535 0.568 . . . . 0.0 112.535 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -67.36 -9.29 24.76 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 123.722 2.948 . . . . 0.0 112.944 -162.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 40.6 mm-40 -90.66 -48.69 6.91 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 126.589 1.956 . . . . 0.0 111.888 -178.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 9.1 p -65.79 -28.22 68.85 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 119.761 1.164 . . . . 0.0 111.862 163.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 24.3 tttt -57.94 -57.76 11.38 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.934 0.893 . . . . 0.0 110.476 169.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.0 mtmp? -58.73 -37.63 76.6 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.132 0.973 . . . . 0.0 112.718 176.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.86 -39.3 87.5 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 174.19 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 4.3 ttp180 -60.2 -53.05 62.37 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.388 1.075 . . . . 0.0 109.564 171.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -62.05 -37.91 86.74 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.46 1.504 . . . . 0.0 112.352 -177.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.29 -37.98 84.28 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 120.839 -1.163 . . . . 0.0 112.882 171.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.2 t -57.68 -36.14 71.53 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 122.298 1.047 . . . . 0.0 111.848 173.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 92.0 mt -70.82 -35.21 59.21 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 O-C-N 120.828 -1.17 . . . . 0.0 110.565 177.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 97.2 mt -64.59 -36.99 78.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 123.633 0.773 . . . . 0.0 112.189 169.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 67.2 mt-10 -65.37 -47.03 77.82 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 119.777 1.172 . . . . 0.0 113.276 177.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -151.99 -8.35 0.21 Allowed 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 -165.417 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 87.88 159.81 34.89 Favored Glycine 0 CA--C 1.524 0.619 0 CA-C-O 122.47 1.039 . . . . 0.0 111.799 -172.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.484 ' HG2' HD11 ' A' ' 53' ' ' ILE . 39.5 tt0 -66.97 -28.53 68.34 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 -165.508 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -61.45 -25.55 67.3 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 113.828 1.048 . . . . 0.0 113.828 173.041 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 80.7 m-70 -96.71 18.06 15.17 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 120.646 1.567 . . . . 0.0 110.571 -177.116 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 5.9 m -146.99 14.27 1.15 Allowed 'General case' 0 N--CA 1.442 -0.863 0 N-CA-C 115.819 1.785 . . . . 0.0 115.819 -156.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . 0.846 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -69.93 -27.44 73.09 Favored Glycine 0 N--CA 1.474 1.194 0 CA-C-N 122.12 2.236 . . . . 0.0 116.809 -174.012 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 43.4 p-80 -54.54 -26.18 30.35 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 120.811 2.305 . . . . 0.0 113.833 163.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.17 -35.52 36.38 Favored 'General case' 0 CA--C 1.518 -0.262 0 C-N-CA 123.476 0.711 . . . . 0.0 110.968 173.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.846 HD12 ' HA2' ' A' ' 50' ' ' GLY . 15.5 mt -71.69 -38.23 65.72 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 CA-C-O 119.42 -0.324 . . . . 0.0 110.697 177.341 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.412 ' HG3' ' HE3' ' A' ' 57' ' ' LYS . 1.1 mp0 -73.53 -52.35 13.85 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 125.985 1.714 . . . . 0.0 114.619 -178.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -56.29 -35.68 67.76 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 122.005 0.907 . . . . 0.0 112.042 174.117 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 9.5 t60 -68.71 -48.41 63.91 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 113.589 0.959 . . . . 0.0 113.589 173.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.412 ' HE3' ' HG3' ' A' ' 54' ' ' GLU . 2.3 mtmt -46.99 -53.07 13.21 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.543 1.137 . . . . 0.0 111.395 172.008 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -65.15 -39.79 93.48 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.154 0.981 . . . . 0.0 112.101 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 18.8 t -54.21 -50.92 66.01 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 123.592 0.757 . . . . 0.0 112.149 172.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 71.0 mtm -60.15 -46.83 88.33 Favored 'General case' 0 N--CA 1.48 1.032 0 O-C-N 120.819 -1.176 . . . . 0.0 111.528 169.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 1.5 mtt180 -61.56 -25.82 67.56 Favored 'General case' 0 CA--C 1.53 0.197 0 O-C-N 119.943 -1.723 . . . . 0.0 113.641 -175.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -46.88 -33.0 4.16 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 124.724 1.21 . . . . 0.0 113.362 167.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.9 mp -81.74 9.65 7.54 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-O 121.64 0.733 . . . . 0.0 112.598 -174.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 71.2 25.89 74.69 Favored Glycine 0 CA--C 1.532 1.143 0 C-N-CA 125.947 1.737 . . . . 0.0 112.179 -169.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -74.47 147.12 42.21 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 126.034 1.733 . . . . 0.0 112.22 -162.388 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.35 77.94 3.11 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.991 1.316 . . . . 0.0 110.619 -175.794 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.107 0 C-N-CA 128.527 2.731 . . . . 0.0 108.042 179.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 33.5 m . . . . . 0 CA--C 1.549 0.937 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -63.9 -29.9 67.49 Favored 'Trans proline' 0 CA--C 1.537 0.669 0 C-N-CA 122.843 2.362 . . . . 0.0 111.745 -170.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.487 ' HG3' ' H ' ' A' ' 33' ' ' THR . 0.3 OUTLIER -39.81 -69.76 0.12 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 127.064 2.146 . . . . 0.0 114.842 161.413 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.487 ' H ' ' HG3' ' A' ' 32' ' ' GLU . 0.0 OUTLIER -74.43 -23.74 58.97 Favored 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 124.939 1.296 . . . . 0.0 111.464 -178.842 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 4.7 tmtt? -58.31 -49.62 76.52 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 119.797 1.18 . . . . 0.0 111.207 167.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.1 tmtp? -62.52 -43.66 98.27 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.454 0.702 . . . . 0.0 111.309 177.355 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.44 -42.23 95.66 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 113.182 0.808 . . . . 0.0 113.182 174.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 8.1 ttp85 -59.8 -52.79 63.97 Favored 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 125.639 1.576 . . . . 0.0 110.326 174.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 61.8 m-20 -65.06 -32.14 73.71 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.63 0.772 . . . . 0.0 112.862 179.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -65.85 -36.37 83.27 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 120.781 -1.199 . . . . 0.0 113.015 170.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 11.3 t -59.62 -44.04 93.59 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 121.921 0.867 . . . . 0.0 111.121 168.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 58.4 mt -68.91 -32.5 54.87 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 C-N-CA 124.263 1.025 . . . . 0.0 110.966 -178.604 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 35.4 mt -60.82 -39.71 82.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 124.1 0.96 . . . . 0.0 112.328 167.514 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -70.26 -44.5 68.32 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 177.061 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.44 ' HG3' ' HB2' ' A' ' 48' ' ' HIS . 0.0 OUTLIER -140.37 -10.41 1.09 Allowed 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 117.133 2.271 . . . . 0.0 117.133 -165.477 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.25 175.96 49.35 Favored Glycine 0 CA--C 1.533 1.202 0 CA-C-N 119.203 0.911 . . . . 0.0 113.252 -165.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -83.81 -30.44 26.55 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 115.065 1.505 . . . . 0.0 115.065 -156.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -62.86 -32.61 73.88 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.079 0.952 . . . . 0.0 113.567 174.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . 0.44 ' HB2' ' HG3' ' A' ' 44' ' ' LYS . 95.1 m-70 -85.16 12.22 8.32 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.792 1.237 . . . . 0.0 112.595 -178.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 9.7 m -138.41 13.51 2.78 Favored 'General case' 0 N--CA 1.445 -0.701 0 C-N-CA 125.592 1.557 . . . . 0.0 114.354 -163.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . 0.406 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -62.77 -33.37 86.67 Favored Glycine 0 C--O 1.216 -1.029 0 CA-C-O 117.844 -1.531 . . . . 0.0 115.728 -176.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 41.1 p-80 -55.95 -29.97 60.98 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 121.095 2.447 . . . . 0.0 113.415 168.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.35 -33.45 42.96 Favored 'General case' 0 CA--C 1.519 -0.219 0 C-N-CA 124.428 1.091 . . . . 0.0 110.76 173.505 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.406 HD12 ' HA2' ' A' ' 50' ' ' GLY . 37.1 mt -72.51 -37.74 57.88 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.564 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 177.354 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -72.37 -53.07 13.37 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.818 1.647 . . . . 0.0 114.239 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.08 -31.95 53.36 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 118.951 0.796 . . . . 0.0 112.834 174.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 10.5 t60 -74.12 -51.13 16.59 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.719 1.608 . . . . 0.0 113.986 170.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -48.52 -54.44 14.36 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 125.346 1.459 . . . . 0.0 110.378 176.17 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -61.22 -39.03 88.77 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.526 0.73 . . . . 0.0 112.204 -177.329 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 34.5 t -53.64 -48.43 69.37 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 124.231 1.013 . . . . 0.0 113.122 169.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 23.8 mtp -62.87 -53.06 59.99 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 125.468 1.507 . . . . 0.0 110.389 172.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.409 ' HG3' ' HB ' ' A' ' 67' ' ' ILE . 22.1 mtp85 -52.52 -33.91 47.35 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 127.977 2.511 . . . . 0.0 115.21 -176.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -42.88 -35.07 1.08 Allowed 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.841 1.257 . . . . 0.0 114.025 167.45 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.2 mp -81.14 5.48 16.65 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.383 1.073 . . . . 0.0 112.784 -173.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.73 15.58 70.25 Favored Glycine 0 CA--C 1.536 1.352 0 C-N-CA 125.94 1.733 . . . . 0.0 112.797 -169.718 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -75.09 142.92 43.61 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.946 2.098 . . . . 0.0 112.353 -168.591 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.1 mppt? -92.9 82.73 4.68 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.138 1.375 . . . . 0.0 108.909 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.409 ' HB ' ' HG3' ' A' ' 61' ' ' ARG . 4.3 mm . . . . . 0 C--O 1.254 1.328 0 C-N-CA 131.11 3.764 . . . . 0.0 107.801 -165.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 83.6 m . . . . . 0 CA--C 1.552 1.034 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -73.59 -5.47 17.14 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 123.169 2.579 . . . . 0.0 112.694 -162.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -101.37 -40.51 7.07 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 125.058 1.343 . . . . 0.0 112.521 -177.187 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.3 p -60.8 -34.62 74.78 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-O 117.765 -1.112 . . . . 0.0 110.278 157.664 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 2.0 ttmt -58.21 -54.86 42.26 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 119.598 1.09 . . . . 0.0 112.244 169.111 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.76 -49.22 58.64 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.819 0.847 . . . . 0.0 112.135 176.621 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.19 -37.05 84.66 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 114.674 -1.148 . . . . 0.0 113.268 176.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.408 ' CG ' HG13 ' A' ' 53' ' ' ILE . 3.4 ttp180 -58.1 -56.03 27.36 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.142 1.377 . . . . 0.0 109.126 173.632 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -65.41 -37.15 86.09 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.423 1.489 . . . . 0.0 111.265 -173.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.25 -43.4 98.11 Favored 'General case' 0 CA--C 1.545 0.788 0 O-C-N 120.983 -1.073 . . . . 0.0 113.255 170.381 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -58.74 -34.21 71.13 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.177 -0.952 . . . . 0.0 111.232 172.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 81.8 mt -75.55 -35.53 32.26 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 O-C-N 120.911 -1.118 . . . . 0.0 111.642 177.22 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 70.2 mt -62.29 -34.18 62.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 124.309 1.044 . . . . 0.0 111.587 169.325 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.426 ' HB3' ' HD2' ' A' ' 44' ' ' LYS . 45.9 mt-10 -70.87 -41.57 71.22 Favored 'General case' 0 CA--C 1.555 1.159 0 N-CA-C 114.183 1.179 . . . . 0.0 114.183 177.02 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.426 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -150.58 -11.59 0.24 Allowed 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 117.586 2.439 . . . . 0.0 117.586 -170.633 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 86.13 159.96 33.29 Favored Glycine 0 CA--C 1.534 1.266 0 CA-C-N 119.224 0.92 . . . . 0.0 112.525 -161.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -73.2 -33.97 65.7 Favored 'General case' 0 C--N 1.337 0.065 0 O-C-N 120.741 -1.446 . . . . 0.0 113.623 -166.397 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -53.82 -36.83 62.93 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.782 0.833 . . . . 0.0 112.534 176.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 79.8 m-70 -87.55 12.45 12.41 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.6 1.56 . . . . 0.0 112.937 178.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -146.38 5.08 0.93 Allowed 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.863 1.665 . . . . 0.0 113.831 -170.312 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . 0.403 ' HA2' ' CD1' ' A' ' 53' ' ' ILE . . . -60.73 -14.55 37.15 Favored Glycine 0 N--CA 1.474 1.178 0 N-CA-C 118.69 2.236 . . . . 0.0 118.69 -160.216 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 30.2 p-80 -55.3 -36.27 66.01 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 121.08 2.44 . . . . 0.0 112.87 164.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.41 -42.24 96.18 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 125.157 1.383 . . . . 0.0 110.75 172.402 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.408 HG13 ' CG ' ' A' ' 37' ' ' ARG . 4.2 mp -72.9 -37.98 55.57 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.344 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.177 -178.427 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.475 ' HA ' ' HE3' ' A' ' 57' ' ' LYS . 3.5 mm-40 -64.85 -52.65 55.51 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 123.511 0.725 . . . . 0.0 112.557 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.76 -39.97 86.63 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.628 0.771 . . . . 0.0 112.61 177.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 16.1 t60 -65.81 -48.13 72.77 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 123.438 0.695 . . . . 0.0 112.576 174.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.475 ' HE3' ' HA ' ' A' ' 54' ' ' GLU . 1.6 mtmp? -52.56 -46.47 66.84 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-O 118.968 -0.539 . . . . 0.0 111.669 171.467 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -65.15 -37.6 87.91 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 123.895 0.878 . . . . 0.0 112.793 177.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 49.7 t -56.97 -52.82 63.7 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 118.795 0.725 . . . . 0.0 111.912 169.367 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 77.6 mtm -56.94 -48.93 77.15 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.32 1.048 . . . . 0.0 111.714 173.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.531 ' HE ' ' C ' ' A' ' 67' ' ' ILE . 11.5 mtt-85 -56.49 -30.3 62.81 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.26 1.824 . . . . 0.0 114.374 -176.474 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -46.26 -31.61 2.61 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.166 0.986 . . . . 0.0 113.284 167.518 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.2 mp -84.47 4.75 30.29 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 123.802 0.841 . . . . 0.0 112.364 -173.347 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.58 19.35 71.3 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 124.507 1.051 . . . . 0.0 112.547 -168.399 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -74.94 141.74 44.03 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 126.607 1.963 . . . . 0.0 110.601 178.197 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.5 mppt? -100.15 76.8 1.93 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 125.077 1.351 . . . . 0.0 109.593 -171.371 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.531 ' C ' ' HE ' ' A' ' 61' ' ' ARG . 0.2 OUTLIER . . . . . 0 C--O 1.248 0.99 0 CA-C-O 116.913 -1.518 . . . . 0.0 111.076 -171.28 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 3.4 m . . . . . 0 CA--C 1.545 0.774 0 CA-C-O 120.876 0.369 . . . . 0.0 110.441 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_endo -71.3 -18.17 30.34 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 122.634 2.223 . . . . 0.0 112.355 -170.268 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 36.9 mm-40 -81.57 -40.41 23.09 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.132 1.373 . . . . 0.0 112.554 -176.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.0 p -70.02 -30.45 67.75 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 120.879 -1.138 . . . . 0.0 111.741 161.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 10.1 tmtt? -58.85 -44.78 91.08 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 120.551 1.523 . . . . 0.0 112.201 170.486 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.1 mttt -52.95 -51.66 60.66 Favored 'General case' 0 C--O 1.223 -0.3 0 C-N-CA 127.52 2.328 . . . . 0.0 111.243 172.021 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.32 -37.77 80.91 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 178.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 6.5 ttp85 -57.95 -51.9 67.73 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.705 1.202 . . . . 0.0 109.566 174.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -73.25 -30.14 63.25 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.11 0.964 . . . . 0.0 113.14 -178.189 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.26 -39.27 92.35 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 120.644 -1.285 . . . . 0.0 111.946 167.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.8 t -60.35 -32.88 71.68 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 122.45 1.119 . . . . 0.0 112.322 172.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 70.4 mt -75.84 -33.83 26.55 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 124.528 1.131 . . . . 0.0 111.807 176.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 88.5 mt -66.34 -34.53 70.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 124.564 1.146 . . . . 0.0 111.724 168.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -71.18 -38.86 72.12 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 174.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.9 mppt? -140.87 -59.17 0.51 Allowed 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.384 1.473 . . . . 0.0 113.944 -177.027 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 137.54 160.73 8.66 Favored Glycine 0 CA--C 1.533 1.181 0 C-N-CA 126.144 1.83 . . . . 0.0 109.659 -158.019 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -73.8 -29.51 62.21 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 119.219 1.51 . . . . 0.0 112.529 -168.77 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 22.9 pt-20 -58.36 -34.02 70.21 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 123.274 0.63 . . . . 0.0 112.204 179.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 98.5 m-70 -82.71 5.4 21.43 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.136 1.374 . . . . 0.0 113.148 177.764 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 4.3 m -145.52 20.28 1.51 Allowed 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 125.541 1.536 . . . . 0.0 112.258 -154.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . 0.581 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -70.3 -17.0 73.81 Favored Glycine 0 C--O 1.219 -0.784 0 O-C-N 120.131 -1.606 . . . . 0.0 115.306 177.211 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 41.5 p-80 -61.17 -30.44 70.41 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 120.213 2.007 . . . . 0.0 112.35 161.196 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -80.29 -35.21 36.16 Favored 'General case' 0 C--O 1.232 0.177 0 C-N-CA 124.225 1.01 . . . . 0.0 111.073 174.637 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.655 HG22 ' HD3' ' A' ' 57' ' ' LYS . 10.4 mt -66.38 -42.47 90.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 CA-C-O 118.105 -0.95 . . . . 0.0 109.79 173.118 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.57 -53.96 49.41 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 118.526 0.603 . . . . 0.0 111.655 178.618 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.94 -39.27 68.7 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 120.952 -1.092 . . . . 0.0 113.271 179.459 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 13.5 t60 -69.49 -41.98 75.38 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 124.987 1.315 . . . . 0.0 114.253 173.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.655 ' HD3' HG22 ' A' ' 53' ' ' ILE . 39.5 mtpt -56.29 -52.7 63.55 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.49 1.116 . . . . 0.0 111.795 175.255 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -61.9 -39.62 92.61 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 123.093 0.557 . . . . 0.0 111.718 177.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 49.4 t -48.92 -59.74 3.34 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-O 118.709 -0.662 . . . . 0.0 111.503 170.28 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 74.2 mtm -56.43 -50.81 70.58 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.173 0.989 . . . . 0.0 111.763 174.663 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 74.3 mtt180 -54.04 -33.03 56.23 Favored 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 120.232 -1.542 . . . . 0.0 113.941 -174.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.528 ' HB3' HD12 ' A' ' 63' ' ' LEU . . . -44.19 -42.8 6.71 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.864 1.266 . . . . 0.0 113.837 166.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.528 HD12 ' HB3' ' A' ' 62' ' ' ALA . 1.4 mp -79.25 9.12 4.9 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.432 1.493 . . . . 0.0 111.777 -173.295 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 82.38 16.7 70.7 Favored Glycine 0 CA--C 1.532 1.135 0 C-N-CA 124.42 1.009 . . . . 0.0 113.636 -173.328 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -65.39 164.61 13.4 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 119.091 1.445 . . . . 0.0 112.385 -178.059 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.02 97.87 5.44 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 120.449 -1.407 . . . . 0.0 109.64 -177.838 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.15 0 C-N-CA 129.742 3.217 . . . . 0.0 107.735 -169.014 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 9.1 m . . . . . 0 CA--C 1.548 0.886 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -66.63 -19.62 53.87 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.792 2.328 . . . . 0.0 111.555 -165.231 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.6 mm-40 -75.12 -49.3 20.04 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 125.951 1.701 . . . . 0.0 112.369 -179.143 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.7 p -69.09 -26.21 64.81 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 118.334 -0.841 . . . . 0.0 112.034 166.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 10.3 tmtt? -61.51 -50.96 70.61 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 119.969 1.259 . . . . 0.0 111.405 170.433 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 25.6 ttpt -54.22 -48.2 71.31 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 127.666 2.386 . . . . 0.0 111.485 172.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.74 -41.49 98.03 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 176.275 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 4.1 ttp180 -58.85 -55.59 33.11 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.736 1.214 . . . . 0.0 109.385 174.344 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -61.19 -37.32 82.51 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.169 1.388 . . . . 0.0 112.858 -179.081 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.65 -35.77 79.5 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.081 -1.012 . . . . 0.0 112.89 172.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.9 t -59.16 -41.59 88.74 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.339 -0.85 . . . . 0.0 111.298 170.488 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 78.5 mt -70.27 -31.36 46.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 C-N-CA 124.899 1.28 . . . . 0.0 111.267 -178.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 60.7 mt -60.56 -44.34 96.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 CA-C-N 118.765 0.712 . . . . 0.0 111.185 165.653 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -71.3 -35.18 71.18 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 115.218 1.562 . . . . 0.0 115.218 -174.563 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.4 -10.49 0.48 Allowed 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 117.061 2.245 . . . . 0.0 117.061 -177.7 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 84.63 172.25 48.9 Favored Glycine 0 CA--C 1.531 1.087 0 CA-C-N 119.367 0.985 . . . . 0.0 112.052 -165.612 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.46 ' CG ' HD11 ' A' ' 53' ' ' ILE . 45.3 tt0 -81.75 -35.54 29.54 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 114.981 1.475 . . . . 0.0 114.981 -159.198 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -55.05 -37.25 66.47 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 174.587 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -80.36 5.84 13.77 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.2 1.4 . . . . 0.0 113.008 -179.244 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 2.3 m -137.17 18.0 2.98 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 125.846 1.658 . . . . 0.0 113.589 -164.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . 0.826 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -75.99 -14.9 81.78 Favored Glycine 0 N--CA 1.467 0.742 0 O-C-N 119.706 -1.871 . . . . 0.0 117.52 -174.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 40.3 p-80 -59.3 -31.31 69.02 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.844 1.822 . . . . 0.0 112.321 157.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.19 -37.76 52.94 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 123.449 0.7 . . . . 0.0 109.923 177.162 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.826 HD12 ' HA2' ' A' ' 50' ' ' GLY . 14.7 mt -67.44 -40.73 85.12 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.358 0 CA-C-O 119.301 -0.381 . . . . 0.0 109.974 177.259 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -65.36 -54.33 30.38 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.209 1.004 . . . . 0.0 113.409 178.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -57.03 -35.6 69.47 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 119.008 0.822 . . . . 0.0 112.315 179.008 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 7.6 t60 -69.97 -47.36 62.6 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 173.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -50.32 -52.07 39.89 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 125.193 1.397 . . . . 0.0 112.051 177.331 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -66.4 -36.86 83.9 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.117 0.567 . . . . 0.0 111.964 -177.468 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 17.5 t -52.9 -56.02 18.96 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.522 0.729 . . . . 0.0 112.866 168.559 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 7.7 mtt -53.06 -52.2 59.32 Favored 'General case' 0 N--CA 1.487 1.387 0 CA-C-N 119.888 1.222 . . . . 0.0 110.983 170.438 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 30.3 mtt180 -55.42 -31.44 61.88 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 125.774 1.63 . . . . 0.0 114.69 -174.053 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -45.84 -36.29 5.13 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.338 1.055 . . . . 0.0 113.053 169.418 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.1 mp -80.5 4.26 18.88 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.559 1.143 . . . . 0.0 112.248 -172.311 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 94.62 4.39 62.14 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 125.546 1.546 . . . . 0.0 113.446 -171.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.462 ' C ' ' HE3' ' A' ' 66' ' ' LYS . 1.3 m-85 -70.64 150.41 46.04 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 126.353 1.861 . . . . 0.0 113.45 -171.833 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.462 ' HE3' ' C ' ' A' ' 65' ' ' PHE . 0.0 OUTLIER -114.32 76.67 1.0 Allowed 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.661 1.584 . . . . 0.0 108.893 -163.402 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.026 0 C-N-CA 127.395 2.278 . . . . 0.0 109.504 -173.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 42.6 m . . . . . 0 CA--C 1.554 1.109 0 N-CA-C 113.264 0.838 . . . . 0.0 113.264 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -64.93 -29.54 57.85 Favored 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 123.583 2.855 . . . . 0.0 112.432 -162.359 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -41.34 -69.4 0.14 Allowed 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 127.206 2.202 . . . . 0.0 115.275 158.202 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.5 p -69.11 -26.84 65.11 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 121.24 -0.913 . . . . 0.0 111.992 177.106 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 6.2 tmtt? -61.54 -51.01 70.38 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 119.54 1.064 . . . . 0.0 111.61 174.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 12.9 ttpt -62.26 -43.86 97.86 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.862 0.865 . . . . 0.0 111.385 176.522 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.34 -39.57 91.03 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 176.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 11.7 ttp85 -60.84 -54.24 47.51 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.733 1.213 . . . . 0.0 110.009 175.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 58.0 m-20 -71.73 -26.7 62.57 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 115.229 -0.896 . . . . 0.0 112.685 -175.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.22 -40.13 90.1 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 120.368 -1.458 . . . . 0.0 112.606 167.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 2.3 t -59.01 -33.83 71.17 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 122.695 1.236 . . . . 0.0 111.819 170.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 70.9 mt -76.53 -34.12 23.79 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 C-N-CA 124.619 1.168 . . . . 0.0 111.855 177.349 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 66.3 mt -64.63 -34.13 67.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 124.474 1.11 . . . . 0.0 111.734 167.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -70.79 -37.26 73.3 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 113.966 1.099 . . . . 0.0 113.966 174.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.2 mppt? -142.64 -60.65 0.44 Allowed 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 125.488 1.515 . . . . 0.0 113.488 -174.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 136.37 160.3 8.71 Favored Glycine 0 CA--C 1.531 1.072 0 C-N-CA 126.045 1.783 . . . . 0.0 109.374 -158.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.483 ' HB3' HD11 ' A' ' 53' ' ' ILE . 0.4 OUTLIER -73.05 -29.53 63.04 Favored 'General case' 0 N--CA 1.466 0.325 0 O-C-N 120.786 -1.42 . . . . 0.0 112.934 -167.581 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.6 pt-20 -56.1 -31.45 63.27 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 123.2 0.6 . . . . 0.0 112.583 178.104 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -85.94 3.31 42.56 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.045 1.338 . . . . 0.0 113.188 177.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 4.6 m -147.08 17.84 1.22 Allowed 'General case' 0 N--CA 1.441 -0.903 0 C-N-CA 125.423 1.489 . . . . 0.0 112.881 -154.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . 0.691 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -63.63 -30.95 79.15 Favored Glycine 0 C--O 1.215 -1.05 0 O-C-N 120.217 -1.552 . . . . 0.0 114.58 179.742 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 39.3 p-80 -53.36 -25.59 15.88 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 121.292 2.546 . . . . 0.0 113.944 168.38 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.85 -35.85 32.25 Favored 'General case' 0 C--N 1.341 0.196 0 C-N-CA 123.7 0.8 . . . . 0.0 111.138 172.266 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.691 HD12 ' HA2' ' A' ' 50' ' ' GLY . 34.4 mt -72.35 -37.43 58.15 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.444 0 CA-C-O 118.757 -0.64 . . . . 0.0 110.012 178.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.556 ' HG3' ' HE3' ' A' ' 57' ' ' LYS . 1.4 mp0 -67.17 -52.84 36.41 Favored 'General case' 0 N--CA 1.436 -1.157 0 C-N-CA 124.835 1.254 . . . . 0.0 112.818 176.665 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.41 -37.83 57.6 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 119.161 0.891 . . . . 0.0 112.95 174.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -72.52 -41.53 65.79 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 114.324 1.231 . . . . 0.0 114.324 173.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.556 ' HE3' ' HG3' ' A' ' 54' ' ' GLU . 23.7 mtmt -55.04 -52.62 62.61 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.942 1.297 . . . . 0.0 111.161 175.706 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -64.88 -38.44 90.97 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.408 0.683 . . . . 0.0 111.65 178.786 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 36.2 t -52.07 -60.69 2.9 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 118.284 -0.865 . . . . 0.0 111.741 169.458 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 79.3 mtm -49.64 -50.16 44.22 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 124.832 1.253 . . . . 0.0 111.474 172.437 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 22.3 mtt180 -53.11 -35.8 60.04 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 120.353 1.433 . . . . 0.0 114.133 -177.333 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.415 ' HB3' HD12 ' A' ' 63' ' ' LEU . . . -48.95 -37.03 18.86 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 119.272 0.942 . . . . 0.0 113.331 170.019 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.415 HD12 ' HB3' ' A' ' 62' ' ' ALA . 4.9 mp -82.87 8.74 11.62 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 125.154 1.381 . . . . 0.0 112.051 -172.825 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.53 22.55 43.19 Favored Glycine 0 CA--C 1.535 1.311 0 C-N-CA 124.931 1.253 . . . . 0.0 114.025 -179.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.501 ' C ' ' HE3' ' A' ' 66' ' ' LYS . 0.8 OUTLIER -84.49 153.67 23.19 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.494 1.518 . . . . 0.0 114.75 -163.265 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.501 ' HE3' ' C ' ' A' ' 65' ' ' PHE . 0.1 OUTLIER -94.97 81.34 3.71 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 126.441 1.897 . . . . 0.0 107.906 -174.32 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 29.4 mm . . . . . 0 C--O 1.245 0.862 0 C-N-CA 128.85 2.86 . . . . 0.0 108.896 -165.011 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 13.7 m . . . . . 0 CA--C 1.55 0.965 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -68.7 -17.64 42.51 Favored 'Trans proline' 0 CA--C 1.536 0.577 0 C-N-CA 123.13 2.554 . . . . 0.0 113.176 -161.395 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -88.17 -41.09 13.22 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.93 1.292 . . . . 0.0 112.493 -174.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.7 p -64.01 -33.22 75.26 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 120.89 -1.131 . . . . 0.0 110.833 158.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 5.1 tmtt? -59.04 -47.89 83.59 Favored 'General case' 0 N--CA 1.478 0.962 0 CA-C-N 120.727 1.603 . . . . 0.0 111.691 173.284 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 26.9 mttt -54.29 -49.97 68.4 Favored 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 126.022 1.729 . . . . 0.0 111.772 173.27 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.83 -35.05 76.5 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.452 0.701 . . . . 0.0 112.756 179.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 3.1 ttp180 -57.96 -55.5 34.15 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 124.728 1.211 . . . . 0.0 109.914 172.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -62.46 -39.45 93.42 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.444 1.098 . . . . 0.0 111.98 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.1 -41.8 97.33 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 113.207 0.818 . . . . 0.0 113.207 172.031 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.9 t -59.38 -36.16 75.26 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 122.496 1.141 . . . . 0.0 111.584 174.088 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 68.6 mt -73.09 -29.53 28.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 O-C-N 120.657 -1.277 . . . . 0.0 111.279 177.793 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 96.8 mt -69.29 -36.36 72.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.435 1.094 . . . . 0.0 112.005 168.251 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -67.49 -42.1 83.46 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 124.507 1.123 . . . . 0.0 113.716 178.29 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.85 -17.42 0.31 Allowed 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 116.923 2.194 . . . . 0.0 116.923 -171.504 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 95.74 164.65 34.26 Favored Glycine 0 CA--C 1.535 1.318 0 C-N-CA 123.933 0.778 . . . . 0.0 112.815 -167.685 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -69.23 -39.67 78.41 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 -165.287 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -55.73 -34.44 65.16 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.513 1.525 . . . . 0.0 113.769 175.729 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 78.0 m-70 -91.13 15.11 12.37 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.823 1.249 . . . . 0.0 112.306 -176.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 1.2 m -143.2 1.22 1.22 Allowed 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 115.73 1.752 . . . . 0.0 115.73 -166.034 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -51.46 -27.35 17.29 Favored Glycine 0 N--CA 1.473 1.11 0 CA-C-O 115.979 -2.567 . . . . 0.0 118.068 -163.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 34.3 p-80 -51.77 -35.12 42.52 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 121.798 2.799 . . . . 0.0 113.255 170.143 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.59 -40.48 76.65 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 125.722 1.609 . . . . 0.0 112.056 171.283 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.473 HG22 ' HD3' ' A' ' 57' ' ' LYS . 3.3 mp -70.74 -36.32 64.37 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 C-N-CA 120.488 -0.485 . . . . 0.0 110.497 178.914 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -73.53 -51.19 17.87 Favored 'General case' 0 N--CA 1.444 -0.759 0 C-N-CA 126.741 2.016 . . . . 0.0 112.32 -174.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -56.89 -37.93 72.08 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 121.453 0.644 . . . . 0.0 112.294 172.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 20.9 t60 -69.02 -49.87 53.81 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 113.113 0.782 . . . . 0.0 113.113 175.244 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.473 ' HD3' HG22 ' A' ' 53' ' ' ILE . 13.7 mtpp -46.43 -49.94 17.46 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 125.736 1.614 . . . . 0.0 111.378 170.745 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 60.4 mm-40 -58.29 -48.32 80.83 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 119.433 1.015 . . . . 0.0 112.357 174.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 24.5 t -55.33 -47.84 75.07 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 123.558 0.743 . . . . 0.0 112.682 178.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 12.4 mtp -62.54 -49.68 74.37 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.535 1.134 . . . . 0.0 110.532 169.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 18.1 mtp180 -56.3 -30.6 62.73 Favored 'General case' 0 C--N 1.34 0.164 0 O-C-N 119.601 -1.937 . . . . 0.0 114.139 -175.64 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -42.31 -35.43 0.99 Allowed 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.319 1.447 . . . . 0.0 113.9 168.354 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.0 mp -79.52 3.69 17.97 Favored 'General case' 0 CA--C 1.548 0.894 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 -171.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.95 20.82 38.12 Favored Glycine 0 CA--C 1.536 1.346 0 C-N-CA 125.598 1.57 . . . . 0.0 112.381 -168.208 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.442 ' C ' ' HE3' ' A' ' 66' ' ' LYS . 0.0 OUTLIER -94.85 158.93 15.27 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 126.482 1.913 . . . . 0.0 112.815 -161.368 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.442 ' HE3' ' C ' ' A' ' 65' ' ' PHE . 0.1 OUTLIER -116.0 106.52 13.87 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 125.925 1.69 . . . . 0.0 107.477 -174.41 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.407 HG22 ' HG2' ' A' ' 57' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--O 1.246 0.889 0 C-N-CA 125.198 1.399 . . . . 0.0 111.046 -170.126 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 33.5 m . . . . . 0 CA--C 1.546 0.816 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -69.16 -18.67 39.71 Favored 'Trans proline' 0 N--CA 1.459 -0.526 0 C-N-CA 122.38 2.054 . . . . 0.0 111.499 -161.462 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -76.46 -47.7 22.12 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.821 1.248 . . . . 0.0 111.726 -179.515 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.7 p -65.82 -31.62 72.69 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 117.841 -1.076 . . . . 0.0 111.612 165.704 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.2 tmtp? -58.76 -50.83 72.49 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 120.509 1.504 . . . . 0.0 112.112 171.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 23.6 ttpt -54.72 -47.42 73.77 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 126.898 2.079 . . . . 0.0 112.12 175.025 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.77 -39.02 90.6 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 114.398 -1.274 . . . . 0.0 113.591 174.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 14.4 ttp85 -60.73 -53.29 59.21 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.625 1.57 . . . . 0.0 110.124 177.293 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -74.76 -30.65 61.55 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 115.364 -0.834 . . . . 0.0 111.836 -175.64 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.89 -39.38 81.25 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 120.531 -1.356 . . . . 0.0 112.698 165.413 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.9 t -59.41 -37.89 79.19 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.744 0.818 . . . . 0.0 111.825 175.083 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 72.3 mt -71.35 -35.52 57.77 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 C-N-CA 124.946 1.298 . . . . 0.0 111.145 176.517 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 86.0 mt -67.04 -31.54 53.84 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 C-N-CA 124.451 1.1 . . . . 0.0 112.127 171.09 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -78.84 -35.62 43.72 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.285 1.434 . . . . 0.0 114.486 178.107 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.2 mppt? -134.62 -59.8 0.8 Allowed 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 125.078 1.351 . . . . 0.0 112.788 176.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 139.08 173.94 13.26 Favored Glycine 0 CA--C 1.531 1.091 0 C-N-CA 126.09 1.805 . . . . 0.0 110.281 -160.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -78.94 -32.54 45.53 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 114.601 1.334 . . . . 0.0 114.601 -162.582 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -58.73 -34.7 71.65 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.834 1.254 . . . . 0.0 113.742 173.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -81.08 6.9 12.26 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.183 0.993 . . . . 0.0 112.942 -176.652 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 21.7 m -145.57 13.25 1.36 Allowed 'General case' 0 N--CA 1.437 -1.093 0 C-N-CA 124.053 0.941 . . . . 0.0 113.413 -154.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . 0.455 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -67.88 -29.48 73.68 Favored Glycine 0 N--CA 1.469 0.864 0 O-C-N 119.791 -1.818 . . . . 0.0 115.605 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 29.6 p-80 -56.82 -30.58 63.88 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 120.208 2.004 . . . . 0.0 112.582 165.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.06 -34.96 59.6 Favored 'General case' 0 CA--C 1.522 -0.119 0 C-N-CA 124.054 0.942 . . . . 0.0 109.698 174.661 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.455 HD12 ' HA2' ' A' ' 50' ' ' GLY . 44.4 mt -72.99 -27.44 24.63 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 N-CA-C 110.554 -0.165 . . . . 0.0 110.554 177.567 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 67.3 mt-10 -89.1 -47.16 8.29 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 -169.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.42 -37.89 57.75 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-O 121.737 0.78 . . . . 0.0 112.124 165.208 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 14.1 t60 -68.43 -46.36 70.09 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 173.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 19.8 mtmt -51.75 -52.74 46.46 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.906 1.283 . . . . 0.0 110.918 177.047 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -61.47 -41.59 97.48 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.023 0.529 . . . . 0.0 112.333 178.71 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 23.7 t -54.59 -50.39 68.13 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 123.438 0.695 . . . . 0.0 112.83 173.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -58.03 -53.4 58.69 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 125.535 1.534 . . . . 0.0 110.34 170.259 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 74.6 mtt180 -55.32 -31.42 61.66 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 126.579 1.952 . . . . 0.0 114.39 -175.046 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -45.78 -34.74 3.86 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.791 1.237 . . . . 0.0 113.497 169.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.9 mp -81.22 3.8 22.54 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.733 1.213 . . . . 0.0 112.244 -173.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.94 11.81 67.14 Favored Glycine 0 CA--C 1.535 1.305 0 C-N-CA 125.22 1.39 . . . . 0.0 113.286 -169.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.405 ' C ' ' HE3' ' A' ' 66' ' ' LYS . 0.9 OUTLIER -70.16 151.51 45.33 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 126.317 1.847 . . . . 0.0 113.506 -176.659 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.405 ' HE3' ' C ' ' A' ' 65' ' ' PHE . 0.0 OUTLIER -111.39 93.66 4.58 Favored 'General case' 0 C--N 1.341 0.198 0 C-N-CA 126.366 1.866 . . . . 0.0 109.502 -170.488 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.247 0.923 0 C-N-CA 127.471 2.308 . . . . 0.0 109.602 -173.266 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 54.6 m . . . . . 0 CA--C 1.553 1.087 0 N-CA-C 113.704 1.001 . . . . 0.0 113.704 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -66.2 -31.9 43.7 Favored 'Trans proline' 0 CA--C 1.537 0.634 0 C-N-CA 123.696 2.931 . . . . 0.0 112.649 -168.549 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -39.98 -69.59 0.13 Allowed 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.598 1.959 . . . . 0.0 114.633 158.094 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.1 p -66.86 -28.55 68.43 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-O 117.636 -1.173 . . . . 0.0 111.935 176.184 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 12.1 tmtt? -57.25 -47.82 80.4 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 120.738 1.608 . . . . 0.0 112.163 176.001 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.5 mttp -83.86 -26.26 29.61 Favored 'General case' 0 CA--C 1.516 -0.34 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 -179.327 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.29 -41.46 97.0 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 123.343 0.402 . . . . 0.0 111.923 163.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 7.5 ttp85 -57.93 -53.53 57.18 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 125.505 1.522 . . . . 0.0 109.981 173.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 82.7 m-20 -69.32 -30.18 68.18 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 115.042 -0.981 . . . . 0.0 113.496 -175.093 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.53 -45.63 92.08 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 120.351 1.432 . . . . 0.0 111.96 168.495 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.3 t -55.75 -34.11 64.9 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.058 0.943 . . . . 0.0 111.296 171.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 69.2 mt -77.3 -35.89 23.15 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 O-C-N 120.404 -1.435 . . . . 0.0 112.068 178.743 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 87.5 mt -59.92 -36.5 67.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 124.315 1.046 . . . . 0.0 111.385 167.793 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -70.35 -45.74 65.52 Favored 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 124.352 1.061 . . . . 0.0 113.718 178.473 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.58 -13.81 0.67 Allowed 'General case' 0 N--CA 1.483 1.224 0 N-CA-C 116.936 2.198 . . . . 0.0 116.936 -169.689 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 89.39 165.95 41.48 Favored Glycine 0 CA--C 1.536 1.395 0 C-N-CA 124.893 1.235 . . . . 0.0 112.476 -163.064 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.4 -34.66 63.34 Favored 'General case' 0 N--CA 1.466 0.326 0 O-C-N 120.553 -1.557 . . . . 0.0 113.259 -168.727 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -55.94 -35.21 66.39 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 123.118 0.567 . . . . 0.0 112.414 -179.629 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 84.5 m-70 -86.3 9.47 17.72 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.732 1.613 . . . . 0.0 112.961 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 1.3 m -143.0 9.19 1.7 Allowed 'General case' 0 N--CA 1.443 -0.825 0 C-N-CA 124.95 1.3 . . . . 0.0 113.895 -166.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -55.26 -22.21 28.95 Favored Glycine 0 C--O 1.215 -1.054 0 CA-C-O 117.041 -1.977 . . . . 0.0 117.656 -169.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 33.4 p-80 -54.46 -36.71 64.38 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 121.952 2.876 . . . . 0.0 113.145 167.207 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -70.73 -37.33 73.49 Favored 'General case' 0 N--CA 1.462 0.127 0 C-N-CA 125.332 1.453 . . . . 0.0 111.627 172.319 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.718 HG22 ' HD3' ' A' ' 57' ' ' LYS . 2.6 mp -71.12 -38.23 70.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 CA-C-N 118.912 0.778 . . . . 0.0 110.427 177.121 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.65 -53.66 21.12 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 125.393 1.477 . . . . 0.0 111.787 -173.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -57.88 -36.24 72.1 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-O 121.799 0.809 . . . . 0.0 112.755 175.7 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 15.4 t60 -68.48 -47.44 67.07 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.865 0.866 . . . . 0.0 112.775 175.028 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.718 ' HD3' HG22 ' A' ' 53' ' ' ILE . 31.1 mtpt -51.46 -49.14 62.34 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.53 1.132 . . . . 0.0 111.58 172.067 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -61.57 -46.5 89.62 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 124.215 1.006 . . . . 0.0 112.491 175.361 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 42.4 t -51.58 -52.65 45.61 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.073 0.949 . . . . 0.0 112.08 175.347 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 76.2 mtm -57.89 -48.93 78.41 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.913 0.885 . . . . 0.0 111.457 170.5 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.2 mtt-85 -58.47 -29.17 65.99 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 120.518 1.508 . . . . 0.0 114.205 -171.419 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -45.94 -35.22 4.47 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.22 1.008 . . . . 0.0 113.61 167.685 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.6 mp -81.95 6.65 15.31 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.221 1.008 . . . . 0.0 112.945 -170.552 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.07 27.07 42.01 Favored Glycine 0 CA--C 1.533 1.207 0 C-N-CA 124.722 1.153 . . . . 0.0 112.29 -169.084 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -89.35 167.59 12.91 Favored 'General case' 0 N--CA 1.461 0.109 0 CA-C-O 123.694 1.711 . . . . 0.0 113.426 -171.623 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 16.0 ptpt -128.96 44.35 2.99 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 113.468 -1.696 . . . . 0.0 112.725 -136.04 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.917 0 C-N-CA 130.413 3.485 . . . . 0.0 109.593 -163.216 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 43.5 m . . . . . 0 CA--C 1.549 0.927 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -74.83 -22.41 15.25 Favored 'Trans proline' 0 CA--C 1.54 0.785 0 C-N-CA 122.778 2.318 . . . . 0.0 112.446 -171.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -66.41 -52.86 42.18 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.209 1.404 . . . . 0.0 112.767 174.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.1 p -65.4 -30.33 71.13 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 120.967 -1.083 . . . . 0.0 111.375 170.025 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 8.2 tmtt? -57.66 -49.02 77.87 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 120.378 1.445 . . . . 0.0 112.426 169.716 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 48.1 tttt -54.5 -50.58 67.48 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 125.922 1.689 . . . . 0.0 111.159 174.374 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.97 -42.05 97.37 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 114.853 -1.067 . . . . 0.0 112.962 179.727 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 9.1 ttp85 -60.12 -51.97 67.33 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 125.102 1.361 . . . . 0.0 110.371 177.269 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 25.0 m-20 -72.31 -29.99 64.36 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 115.771 -0.65 . . . . 0.0 112.553 -175.514 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.91 -37.0 85.77 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 120.821 -1.175 . . . . 0.0 113.131 167.124 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.8 t -60.39 -39.76 88.49 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 121.053 -1.029 . . . . 0.0 111.651 168.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 73.7 mt -72.02 -29.95 34.82 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 O-C-N 121.001 -1.062 . . . . 0.0 111.468 -177.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 60.1 mt -58.01 -43.05 84.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 123.38 0.672 . . . . 0.0 111.489 163.591 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.9 -41.97 97.57 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.069 1.137 . . . . 0.0 114.069 -178.207 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -153.48 -9.34 0.16 Allowed 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 116.992 2.219 . . . . 0.0 116.992 -166.487 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 83.58 159.57 28.55 Favored Glycine 0 CA--C 1.53 1.017 0 CA-C-N 119.179 0.9 . . . . 0.0 112.895 -164.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.521 ' HB3' HD11 ' A' ' 53' ' ' ILE . 0.5 OUTLIER -67.53 -28.72 68.05 Favored 'General case' 0 N--CA 1.463 0.181 0 O-C-N 121.147 -1.207 . . . . 0.0 112.728 -169.564 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.438 ' HG3' ' CD2' ' A' ' 48' ' ' HIS . 10.4 pt-20 -58.41 -24.42 59.99 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.911 0.885 . . . . 0.0 113.258 177.018 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . 0.438 ' CD2' ' HG3' ' A' ' 47' ' ' GLU . 96.8 m-70 -104.21 11.97 34.33 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 120.345 1.429 . . . . 0.0 111.117 178.137 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 1.7 m -139.67 18.09 2.52 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 126.768 2.027 . . . . 0.0 113.051 -162.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . 0.47 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -63.81 -29.69 75.52 Favored Glycine 0 C--O 1.216 -1.001 0 CA-C-O 116.622 -2.21 . . . . 0.0 114.883 -175.728 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 41.0 p-80 -56.42 -24.75 47.26 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 120.358 2.079 . . . . 0.0 113.632 168.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -82.72 -33.63 27.47 Favored 'General case' 0 C--N 1.341 0.203 0 O-C-N 121.515 -0.74 . . . . 0.0 110.78 171.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.53 HG22 ' HD3' ' A' ' 57' ' ' LYS . 51.5 mt -75.11 -35.22 33.94 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-O 119.196 -0.43 . . . . 0.0 110.628 -179.18 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -67.84 -55.49 12.76 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 127.119 2.168 . . . . 0.0 110.94 -177.301 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.74 -40.76 72.96 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 173.138 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 13.6 t60 -66.3 -46.48 76.8 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 120.992 -1.067 . . . . 0.0 113.089 175.38 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.53 ' HD3' HG22 ' A' ' 53' ' ' ILE . 21.4 mtpp -54.06 -49.0 69.99 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.146 0.978 . . . . 0.0 111.269 172.658 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -61.74 -43.39 98.95 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 118.155 -0.926 . . . . 0.0 112.435 175.322 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 42.8 t -50.74 -58.2 6.47 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 119.016 0.825 . . . . 0.0 111.11 173.002 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 75.6 mtm -55.93 -45.89 78.62 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.203 0.601 . . . . 0.0 110.486 174.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 8.8 mtt-85 -58.91 -29.25 66.92 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 120.77 1.623 . . . . 0.0 115.232 -177.035 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -50.25 -31.32 13.79 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 118.9 0.773 . . . . 0.0 112.668 169.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.9 mp -85.21 26.74 0.85 Allowed 'General case' 0 CA--C 1.546 0.81 0 CA-C-O 122.732 1.253 . . . . 0.0 112.327 -172.195 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 68.09 30.1 73.75 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 127.156 2.312 . . . . 0.0 113.034 -174.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -102.35 170.35 8.12 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-O 124.03 1.871 . . . . 0.0 115.959 -148.578 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 13.0 ptpt -119.81 69.53 0.84 Allowed 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 124.1 1.905 . . . . 0.0 111.625 -152.273 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 17.8 mm . . . . . 0 C--O 1.254 1.313 0 CA-C-N 108.472 -3.967 . . . . 0.0 112.16 -147.72 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 64.9 m . . . . . 0 CA--C 1.55 0.962 0 N-CA-C 113.928 1.085 . . . . 0.0 113.928 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -63.68 -29.08 69.16 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 123.873 3.049 . . . . 0.0 112.63 -168.036 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -39.37 -72.19 0.07 Allowed 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.688 2.395 . . . . 0.0 115.753 156.299 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -68.72 -24.77 64.51 Favored 'General case' 0 N--CA 1.475 0.815 0 O-C-N 121.029 -1.044 . . . . 0.0 112.169 176.222 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 8.8 tmtt? -60.37 -43.74 96.28 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 120.419 1.463 . . . . 0.0 111.124 172.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 62.5 tttt -58.84 -49.74 76.58 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.858 1.263 . . . . 0.0 111.677 173.169 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.56 -37.17 86.29 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.332 -0.849 . . . . 0.0 112.739 178.131 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 6.6 ttp85 -59.35 -56.48 21.56 Favored 'General case' 0 C--O 1.223 -0.299 0 C-N-CA 125.619 1.568 . . . . 0.0 109.842 175.15 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -69.61 -27.4 65.05 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 115.315 -0.857 . . . . 0.0 112.572 -176.4 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.35 -44.31 91.85 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 120.768 -1.207 . . . . 0.0 112.971 166.356 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -57.76 -31.7 66.75 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 122.454 1.121 . . . . 0.0 111.57 171.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 72.3 mt -77.27 -34.33 21.07 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 O-C-N 120.524 -1.36 . . . . 0.0 111.726 177.259 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 70.2 mt -61.92 -34.72 64.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.2 1.0 . . . . 0.0 111.659 167.193 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -70.13 -43.03 71.79 Favored 'General case' 0 CA--C 1.556 1.181 0 N-CA-C 114.12 1.155 . . . . 0.0 114.12 177.104 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.87 -11.71 0.28 Allowed 'General case' 0 N--CA 1.485 1.297 0 N-CA-C 117.828 2.529 . . . . 0.0 117.828 -171.049 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 90.03 162.34 38.25 Favored Glycine 0 CA--C 1.536 1.36 0 CA-C-N 119.612 1.096 . . . . 0.0 112.663 -163.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.43 -34.99 68.22 Favored 'General case' 0 N--CA 1.465 0.3 0 O-C-N 120.707 -1.467 . . . . 0.0 113.422 -168.687 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -56.15 -34.9 66.56 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.765 0.826 . . . . 0.0 112.612 178.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 79.5 m-70 -90.21 12.15 18.93 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.698 1.599 . . . . 0.0 112.686 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -145.72 11.67 1.27 Allowed 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 124.954 1.302 . . . . 0.0 114.11 -169.286 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -53.73 -26.18 31.64 Favored Glycine 0 N--CA 1.472 1.038 0 CA-C-O 116.354 -2.359 . . . . 0.0 116.879 -169.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 37.1 p-80 -52.56 -33.67 46.79 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 120.997 2.399 . . . . 0.0 113.143 170.147 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -74.16 -38.5 63.69 Favored 'General case' 0 CA--C 1.522 -0.114 0 C-N-CA 125.117 1.367 . . . . 0.0 112.364 171.521 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 2.8 mp -67.91 -34.53 67.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 119.964 -0.695 . . . . 0.0 110.906 175.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -74.38 -53.63 9.23 Favored 'General case' 0 N--CA 1.44 -0.957 0 C-N-CA 125.28 1.432 . . . . 0.0 111.557 -176.211 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.23 -38.39 65.68 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.541 -0.724 . . . . 0.0 112.383 175.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 17.1 t60 -67.25 -49.81 62.97 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.593 1.157 . . . . 0.0 113.504 173.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -48.19 -49.78 31.51 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.632 1.573 . . . . 0.0 112.405 177.326 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -69.36 -39.81 77.86 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.366 0.666 . . . . 0.0 112.053 -176.214 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 48.8 t -50.13 -51.58 42.15 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 123.528 0.731 . . . . 0.0 112.493 167.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 36.0 mtp -57.95 -51.79 68.2 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.118 1.367 . . . . 0.0 110.787 172.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 45.9 mtt180 -54.9 -29.84 56.92 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 126.097 1.759 . . . . 0.0 114.392 -177.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -48.06 -22.06 0.56 Allowed 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 114.793 1.405 . . . . 0.0 114.793 168.071 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.8 mp -95.85 1.89 53.37 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.662 1.585 . . . . 0.0 112.186 -173.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 86.76 15.04 64.08 Favored Glycine 0 CA--C 1.535 1.33 0 C-N-CA 124.744 1.164 . . . . 0.0 113.07 -169.746 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -71.73 141.06 49.79 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 126.576 1.95 . . . . 0.0 111.524 -179.167 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -101.2 93.71 5.59 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.332 1.453 . . . . 0.0 108.344 -178.31 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.126 0 C-N-CA 127.544 2.338 . . . . 0.0 109.313 -177.683 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 21.3 m . . . . . 0 CA--C 1.549 0.92 0 N-CA-C 114.227 1.195 . . . . 0.0 114.227 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -66.9 -11.47 32.27 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 123.149 2.566 . . . . 0.0 112.695 -166.24 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 38.0 mm-40 -88.02 -41.56 13.02 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.468 1.507 . . . . 0.0 112.44 -177.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -64.0 -35.31 80.28 Favored 'General case' 0 N--CA 1.48 1.049 0 O-C-N 120.635 -1.291 . . . . 0.0 110.674 158.297 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.432 ' HE2' ' OD2' ' A' ' 38' ' ' ASP . 17.3 tttt -59.82 -42.6 93.88 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 119.484 1.038 . . . . 0.0 112.656 175.475 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.4 mttt -55.43 -50.01 70.93 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 125.513 1.525 . . . . 0.0 110.552 176.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.46 -34.34 76.97 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.83 0.852 . . . . 0.0 113.018 174.645 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.408 ' CG ' HG13 ' A' ' 53' ' ' ILE . 4.3 ttp180 -59.48 -54.89 41.42 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.892 1.277 . . . . 0.0 109.943 176.568 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.432 ' OD2' ' HE2' ' A' ' 34' ' ' LYS . 84.2 m-20 -74.46 -28.69 61.14 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.526 1.13 . . . . 0.0 111.596 -175.4 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.01 -39.95 94.01 Favored 'General case' 0 CA--C 1.547 0.834 0 O-C-N 120.637 -1.289 . . . . 0.0 113.356 163.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.6 t -59.64 -34.07 72.33 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.007 -1.058 . . . . 0.0 111.435 173.467 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 91.4 mt -71.85 -35.14 53.71 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 O-C-N 120.62 -1.3 . . . . 0.0 111.183 176.172 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 87.6 mt -63.79 -35.45 73.14 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 124.05 0.94 . . . . 0.0 111.985 169.503 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -69.95 -43.62 71.2 Favored 'General case' 0 CA--C 1.556 1.21 0 N-CA-C 114.053 1.131 . . . . 0.0 114.053 177.611 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.51 -15.26 0.38 Allowed 'General case' 0 N--CA 1.485 1.31 0 N-CA-C 116.874 2.176 . . . . 0.0 116.874 -170.147 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 92.55 164.31 38.05 Favored Glycine 0 CA--C 1.536 1.36 0 CA-C-O 122.153 0.863 . . . . 0.0 113.148 -165.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -68.89 -41.99 77.56 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 -164.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -55.7 -34.83 65.44 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.771 1.228 . . . . 0.0 113.804 175.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 68.8 m-70 -87.64 12.23 13.13 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.561 1.145 . . . . 0.0 112.342 -176.592 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 1.2 m -141.41 2.59 1.66 Allowed 'General case' 0 N--CA 1.438 -1.064 0 C-N-CA 124.739 1.216 . . . . 0.0 114.163 -167.315 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -54.23 -21.16 17.94 Favored Glycine 0 N--CA 1.474 1.181 0 N-CA-C 118.136 2.014 . . . . 0.0 118.136 -167.427 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 30.1 p-80 -55.32 -36.79 66.6 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 121.72 2.76 . . . . 0.0 113.41 166.5 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.2 -41.6 85.54 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 125.377 1.471 . . . . 0.0 111.072 170.699 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.697 HG22 ' HD3' ' A' ' 57' ' ' LYS . 2.8 mp -70.04 -39.44 77.29 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 CA-C-N 118.73 0.695 . . . . 0.0 109.708 -178.683 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.08 -51.73 50.75 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 125.461 1.504 . . . . 0.0 112.62 -177.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.55 -38.58 84.95 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.479 0.657 . . . . 0.0 112.413 176.588 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 21.0 t60 -65.31 -48.29 73.59 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.648 0.779 . . . . 0.0 112.759 173.638 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.697 ' HD3' HG22 ' A' ' 53' ' ' ILE . 35.2 mtpt -52.11 -47.69 65.17 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.607 1.163 . . . . 0.0 112.617 171.833 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -57.74 -44.77 86.26 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.461 1.028 . . . . 0.0 112.375 172.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 38.1 t -56.09 -50.07 72.06 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 118.681 0.673 . . . . 0.0 112.299 175.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 71.8 mtm -59.06 -50.92 72.24 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 121.291 -0.88 . . . . 0.0 111.013 171.358 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 15.9 mtt180 -55.82 -30.89 62.12 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 126.068 1.747 . . . . 0.0 113.743 -174.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -44.66 -34.84 2.35 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.702 1.201 . . . . 0.0 113.749 168.304 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.1 mp -81.26 8.86 7.99 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 123.992 0.917 . . . . 0.0 112.744 -173.177 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 75.87 22.06 75.22 Favored Glycine 0 CA--C 1.533 1.194 0 C-N-CA 125.54 1.543 . . . . 0.0 112.408 -167.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.47 ' HB3' HG13 ' A' ' 67' ' ' ILE . 0.1 OUTLIER -78.06 129.25 35.0 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 126.354 1.862 . . . . 0.0 110.974 -172.427 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.4 mppt? -82.6 78.92 9.16 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.476 1.51 . . . . 0.0 109.391 -178.089 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.47 HG13 ' HB3' ' A' ' 65' ' ' PHE . 0.4 OUTLIER . . . . . 0 C--O 1.247 0.934 0 C-N-CA 125.898 1.679 . . . . 0.0 109.731 -176.041 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.414 0 N-CA-C 107.573 -2.211 . . . . 0.0 107.573 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.2 m 52.37 -157.78 0.14 Allowed 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 118.932 1.366 . . . . 0.0 110.622 -153.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -51.04 132.72 27.71 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 119.714 1.143 . . . . 0.0 111.002 170.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 4.5 m -146.17 148.25 32.36 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.108 0.963 . . . . 0.0 109.3 -174.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 29.7 tpp -126.18 73.63 72.13 Favored Pre-proline 0 N--CA 1.471 0.583 0 C-N-CA 124.497 1.119 . . . . 0.0 110.744 176.28 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_endo -72.57 27.18 0.28 Allowed 'Trans proline' 0 CA--C 1.549 1.26 0 C-N-CA 124.273 3.315 . . . . 0.0 114.414 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -114.8 -64.75 0.41 Allowed Glycine 0 CA--C 1.531 1.091 0 CA-C-N 118.906 0.775 . . . . 0.0 113.618 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.3 mm? 53.75 -174.38 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.876 1.27 . . . . 0.0 113.513 -169.303 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 14.3 p -159.02 117.77 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 C-N-CA 125.369 1.468 . . . . 0.0 109.839 174.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -155.82 176.03 13.16 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 126.831 2.052 . . . . 0.0 111.081 -173.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 57.7 m -80.42 161.76 24.78 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.925 0.89 . . . . 0.0 112.935 176.27 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 21.0 p-10 -129.96 74.43 80.58 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 126.472 1.909 . . . . 0.0 110.742 -173.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_endo -81.57 -174.15 2.07 Favored 'Trans proline' 0 CA--C 1.543 0.943 0 C-N-CA 124.419 3.413 . . . . 0.0 113.04 -173.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -147.49 154.6 45.2 Favored Pre-proline 0 CA--C 1.549 0.937 0 C-N-CA 125.096 1.359 . . . . 0.0 112.112 174.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -64.1 162.49 29.37 Favored 'Trans proline' 0 CA--C 1.554 1.48 0 C-N-CA 124.538 3.492 . . . . 0.0 117.79 -171.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -88.21 -170.3 0.52 Allowed 'Trans proline' 0 CA--C 1.546 1.107 1 C-N-CA 126.161 4.574 . . . . 0.0 115.607 -177.152 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -46.75 105.88 0.07 Allowed 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.128 0.971 . . . . 0.0 112.064 157.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 35.7 m -173.77 103.76 0.12 Allowed 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 126.403 1.881 . . . . 0.0 113.24 163.166 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.32 39.62 0.83 Allowed 'General case' 0 CA--C 1.545 0.771 0 CA-C-O 122.149 0.976 . . . . 0.0 108.613 148.3 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -156.64 -162.85 1.32 Allowed 'General case' 0 CA--C 1.54 0.562 0 O-C-N 120.607 -1.308 . . . . 0.0 111.891 -146.164 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 7.3 mmtt -140.25 -0.88 1.58 Allowed 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 118.557 2.799 . . . . 0.0 118.557 -174.314 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.7 mtpm? -51.37 163.52 0.56 Allowed Pre-proline 0 N--CA 1.474 0.742 0 C-N-CA 128.462 2.705 . . . . 0.0 114.51 170.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -76.23 177.69 8.46 Favored 'Trans proline' 0 N--CA 1.453 -0.892 0 C-N-CA 122.258 1.972 . . . . 0.0 110.993 166.319 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.558 HD23 ' H ' ' A' ' 25' ' ' LYS . 0.5 OUTLIER -132.94 165.17 25.31 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 114.715 -1.13 . . . . 0.0 111.369 174.658 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.558 ' H ' HD23 ' A' ' 24' ' ' LEU . 0.6 OUTLIER -114.88 138.3 23.29 Favored Pre-proline 0 N--CA 1.47 0.565 0 C-N-CA 127.451 2.301 . . . . 0.0 107.223 -172.318 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo -79.16 -14.5 13.35 Favored 'Trans proline' 0 CA--C 1.548 1.211 0 C-N-CA 122.774 2.316 . . . . 0.0 112.449 -171.184 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.425 ' HA ' ' HE3' ' A' ' 34' ' ' LYS . 20.1 p -74.76 -21.6 59.25 Favored 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 126.42 1.888 . . . . 0.0 112.713 165.581 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 50.0 m -115.18 -31.16 6.1 Favored 'General case' 0 CA--C 1.554 1.113 0 N-CA-C 116.069 1.877 . . . . 0.0 116.069 -172.004 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.88 160.52 23.15 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.057 -1.027 . . . . 0.0 110.55 -178.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 38.7 m 42.4 50.37 5.2 Favored Pre-proline 0 CA--C 1.553 1.085 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 -178.064 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.6 -24.67 30.16 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.429 2.752 . . . . 0.0 112.309 -158.331 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -63.07 -48.3 79.25 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.458 1.903 . . . . 0.0 113.789 169.219 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.48 -34.27 74.1 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 119.483 1.038 . . . . 0.0 111.732 168.707 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.425 ' HE3' ' HA ' ' A' ' 27' ' ' CYS . 7.0 tmtt? -58.8 -45.49 89.79 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.895 1.278 . . . . 0.0 112.211 173.484 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 72.6 tttt -55.51 -51.22 67.73 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 126.427 1.891 . . . . 0.0 111.422 172.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.05 -37.97 89.36 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 114.796 -1.093 . . . . 0.0 112.641 178.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 10.2 ttp85 -59.94 -57.25 13.66 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.767 1.227 . . . . 0.0 110.178 174.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 62.0 m-20 -69.18 -29.74 67.79 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.163 0.985 . . . . 0.0 112.67 -175.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.61 -41.41 96.22 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 120.542 -1.349 . . . . 0.0 112.35 168.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.8 t -57.67 -34.53 69.49 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 122.21 1.005 . . . . 0.0 111.76 172.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 64.3 mt -77.11 -33.76 20.75 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 C-N-CA 125.182 1.393 . . . . 0.0 112.257 178.429 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 74.0 mt -64.99 -34.97 74.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 124.052 0.941 . . . . 0.0 111.395 168.365 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -72.92 -36.03 67.17 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 114.54 1.311 . . . . 0.0 114.54 177.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -139.24 -58.64 0.59 Allowed 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 125.078 1.351 . . . . 0.0 113.788 175.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 139.79 161.93 8.91 Favored Glycine 0 CA--C 1.53 1.003 0 C-N-CA 126.278 1.894 . . . . 0.0 109.558 -159.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.489 ' HB3' HD11 ' A' ' 53' ' ' ILE . 0.3 OUTLIER -73.45 -28.49 61.99 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 120.993 -1.298 . . . . 0.0 112.928 -169.102 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -55.98 -33.67 65.03 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 123.501 0.72 . . . . 0.0 112.444 177.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -85.81 5.82 30.89 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.989 1.316 . . . . 0.0 113.067 178.269 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 6.1 m -148.22 16.05 1.04 Allowed 'General case' 0 N--CA 1.441 -0.887 0 C-N-CA 125.307 1.443 . . . . 0.0 113.094 -154.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . 0.689 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -65.84 -27.83 73.1 Favored Glycine 0 C--O 1.213 -1.173 0 O-C-N 120.19 -1.568 . . . . 0.0 114.658 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 41.6 p-80 -56.54 -25.18 51.19 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 120.666 2.233 . . . . 0.0 113.933 166.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.85 -34.57 30.06 Favored 'General case' 0 C--O 1.231 0.113 0 C-N-CA 123.837 0.855 . . . . 0.0 110.664 172.551 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.689 HD12 ' HA2' ' A' ' 50' ' ' GLY . 33.2 mt -70.43 -40.38 77.49 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.598 0 CA-C-O 118.72 -0.657 . . . . 0.0 109.711 177.454 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.54 -50.74 49.66 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 125.004 1.322 . . . . 0.0 111.912 -175.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.99 -37.47 66.6 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 121.152 -0.968 . . . . 0.0 113.006 173.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 14.5 t60 -72.45 -44.26 62.61 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.508 1.123 . . . . 0.0 113.901 174.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.86 -54.75 25.53 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.769 1.628 . . . . 0.0 110.956 175.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.431 ' HA ' ' HB2' ' A' ' 61' ' ' ARG . 11.2 mm-40 -72.18 -33.85 67.98 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 122.773 0.429 . . . . 0.0 111.692 -174.041 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 48.8 t -48.51 -60.45 2.68 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-O 118.505 -0.76 . . . . 0.0 112.3 162.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 78.3 mtm -52.66 -45.61 66.83 Favored 'General case' 0 N--CA 1.486 1.331 0 CA-C-N 120.027 1.285 . . . . 0.0 111.388 171.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.431 ' HB2' ' HA ' ' A' ' 58' ' ' GLU . 2.4 ttt85 -51.91 -39.03 58.42 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 114.378 1.251 . . . . 0.0 114.378 -175.17 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.446 ' HB3' HD12 ' A' ' 63' ' ' LEU . . . -47.33 -36.24 9.16 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.619 1.167 . . . . 0.0 113.25 172.848 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.446 HD12 ' HB3' ' A' ' 62' ' ' ALA . 5.7 mp -82.65 9.57 9.26 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 125.209 1.404 . . . . 0.0 111.658 -172.705 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.53 40.82 5.59 Favored Glycine 0 CA--C 1.532 1.138 0 C-N-CA 125.046 1.307 . . . . 0.0 113.274 177.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -112.28 143.65 43.01 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 121.507 -0.996 . . . . 0.0 112.273 -151.009 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? -92.54 79.87 4.86 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 125.8 1.64 . . . . 0.0 108.805 -173.306 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.427 ' OXT' HG22 ' A' ' 67' ' ' ILE . 39.2 mm . . . . . 0 CA--C 1.552 1.039 0 C-N-CA 128.81 2.844 . . . . 0.0 110.604 -161.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.26 0 N-CA-C 107.886 -2.085 . . . . 0.0 107.886 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.6 m -148.96 162.45 39.86 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 118.154 0.977 . . . . 0.0 110.875 -163.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 22.4 t80 -148.77 171.38 16.34 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.126 0.97 . . . . 0.0 110.458 169.704 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 15.3 m 64.95 -31.36 0.13 Allowed 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 127.411 2.284 . . . . 0.0 116.099 179.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.412 ' HB3' HD22 ' A' ' 8' ' ' LEU . 4.0 mpp? 38.02 54.42 3.95 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 127.398 2.279 . . . . 0.0 114.879 179.576 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -74.39 29.73 0.34 Allowed 'Trans proline' 0 CA--C 1.549 1.264 0 C-N-CA 124.153 3.235 . . . . 0.0 114.134 -176.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 171.08 -34.46 0.16 Allowed Glycine 0 CA--C 1.531 1.081 0 O-C-N 120.928 -1.107 . . . . 0.0 114.584 174.42 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.412 HD22 ' HB3' ' A' ' 5' ' ' MET 0.259 0.9 OUTLIER 38.05 32.12 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 118.513 2.783 . . . . 0.0 118.513 172.497 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 97.8 t -40.96 133.23 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 126.172 1.789 . . . . 0.0 111.0 163.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . 0.284 1.1 m-20 43.85 25.95 0.12 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 127.885 2.474 . . . . 0.0 116.777 -178.673 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 28.2 t -53.83 -32.65 53.64 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.635 1.174 . . . . 0.0 112.789 160.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -164.41 68.92 1.51 Allowed Pre-proline 0 CA--C 1.556 1.174 0 C-N-CA 125.13 1.372 . . . . 0.0 112.137 -172.64 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -77.44 -177.97 4.24 Favored 'Trans proline' 0 CA--C 1.542 0.916 0 C-N-CA 124.503 3.469 . . . . 0.0 111.89 178.191 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -140.65 159.38 63.02 Favored Pre-proline 0 CA--C 1.545 0.776 0 C-N-CA 124.937 1.295 . . . . 0.0 112.679 -174.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -69.1 157.69 60.71 Favored 'Trans proline' 0 CA--C 1.546 1.107 0 C-N-CA 123.002 2.468 . . . . 0.0 112.972 171.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -77.23 177.83 8.39 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 123.672 2.915 . . . . 0.0 112.799 171.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.0 tp10 -84.0 152.47 24.42 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 122.134 0.969 . . . . 0.0 111.86 168.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 21.9 m -177.18 -38.15 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 129.986 3.314 . . . . 0.0 109.479 159.387 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 51.07 159.44 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 131.24 3.816 . . . . 0.0 117.785 170.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.17 -175.18 0.2 Allowed 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 123.933 1.825 . . . . 0.0 111.458 158.5 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 34.8 mmtm -137.85 74.05 1.46 Allowed 'General case' 0 N--CA 1.438 -1.065 0 C-N-CA 128.591 2.757 . . . . 0.0 106.851 -171.098 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 31.3 mmtm -149.04 164.78 19.71 Favored Pre-proline 0 N--CA 1.475 0.793 0 C-N-CA 126.3 1.84 . . . . 0.0 113.21 -158.38 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -70.45 175.37 8.76 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 121.513 1.475 . . . . 0.0 111.747 166.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.537 HD23 ' H ' ' A' ' 25' ' ' LYS . 0.6 OUTLIER -139.42 160.12 40.57 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.941 0.897 . . . . 0.0 112.325 178.223 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.537 ' H ' HD23 ' A' ' 24' ' ' LEU . 0.3 OUTLIER -108.07 142.72 25.88 Favored Pre-proline 0 C--O 1.224 -0.276 0 C-N-CA 126.424 1.89 . . . . 0.0 107.314 -175.572 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_endo -77.87 -11.07 16.77 Favored 'Trans proline' 0 CA--C 1.55 1.306 0 C-N-CA 122.227 1.951 . . . . 0.0 112.413 -172.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 29.5 p -90.53 -18.0 26.05 Favored 'General case' 0 CA--C 1.556 1.199 0 C-N-CA 125.992 1.717 . . . . 0.0 112.047 171.355 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 76.3 m -105.82 -31.54 8.79 Favored 'General case' 0 CA--C 1.556 1.191 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 177.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.11 162.68 21.78 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.997 1.319 . . . . 0.0 110.173 178.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 28.5 m 38.77 50.97 2.82 Favored Pre-proline 0 CA--C 1.55 0.949 0 C-N-CA 124.02 0.928 . . . . 0.0 112.926 178.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.12 -17.2 36.06 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.521 2.148 . . . . 0.0 112.47 -156.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -82.87 -38.78 22.47 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.575 1.55 . . . . 0.0 112.019 -178.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.2 p -71.06 -31.43 67.84 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 121.055 -1.028 . . . . 0.0 111.51 161.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 10.3 tmtt? -59.15 -47.54 84.9 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 120.096 1.316 . . . . 0.0 111.785 172.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 44.2 mttt -52.81 -51.94 58.88 Favored 'General case' 0 C--O 1.225 -0.217 0 C-N-CA 126.901 2.08 . . . . 0.0 111.823 171.179 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.08 -37.17 83.51 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -179.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 13.1 ttp85 -59.45 -55.33 36.06 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 124.709 1.203 . . . . 0.0 109.865 174.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -72.4 -29.41 63.71 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 115.414 -0.812 . . . . 0.0 112.41 -174.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.88 -44.65 96.38 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 120.795 -1.19 . . . . 0.0 112.039 165.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.0 t -55.96 -34.61 65.85 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 122.275 1.036 . . . . 0.0 111.678 173.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 66.6 mt -76.42 -32.46 21.73 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 125.274 1.43 . . . . 0.0 112.613 178.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 83.4 mt -66.59 -38.33 81.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 123.878 0.871 . . . . 0.0 110.868 167.273 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -72.03 -38.82 69.48 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 114.49 1.292 . . . . 0.0 114.49 -179.376 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.7 mppt? -137.77 -33.84 0.7 Allowed 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 115.993 1.849 . . . . 0.0 115.993 -177.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 101.79 156.7 26.44 Favored Glycine 0 CA--C 1.532 1.149 0 C-N-CA 124.605 1.098 . . . . 0.0 111.738 -157.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.499 ' HB3' HD11 ' A' ' 53' ' ' ILE . 0.5 OUTLIER -69.96 -27.68 64.93 Favored 'General case' 0 N--CA 1.466 0.367 0 O-C-N 121.148 -1.207 . . . . 0.0 113.059 -166.837 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -56.12 -27.59 54.54 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 123.725 0.81 . . . . 0.0 112.843 176.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -96.3 8.72 43.21 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.368 1.067 . . . . 0.0 112.847 177.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 3.7 m -146.83 17.58 1.26 Allowed 'General case' 0 N--CA 1.443 -0.811 0 C-N-CA 125.547 1.539 . . . . 0.0 112.407 -155.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . 0.741 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -68.77 -25.72 74.99 Favored Glycine 0 C--O 1.217 -0.935 0 CA-C-O 116.918 -2.046 . . . . 0.0 114.905 -177.629 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 38.9 p-80 -56.07 -28.52 57.91 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 120.016 1.908 . . . . 0.0 112.978 165.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.42 -34.8 35.9 Favored 'General case' 0 C--N 1.34 0.172 0 C-N-CA 123.856 0.862 . . . . 0.0 110.459 175.016 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.741 HD12 ' HA2' ' A' ' 50' ' ' GLY . 36.1 mt -69.76 -40.75 79.5 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.663 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 176.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -64.52 -52.43 57.82 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 125.625 1.57 . . . . 0.0 111.173 179.123 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.25 -40.04 58.0 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 113.453 0.909 . . . . 0.0 113.453 174.342 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 11.2 t60 -71.19 -42.79 68.57 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 114.193 1.182 . . . . 0.0 114.193 173.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.32 -52.5 65.11 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.737 1.215 . . . . 0.0 111.978 177.147 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -69.54 -33.94 73.5 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 123.145 0.578 . . . . 0.0 111.318 -176.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 48.7 t -49.35 -60.97 2.36 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-O 118.62 -0.705 . . . . 0.0 111.795 161.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 78.9 mtm -54.13 -45.14 71.86 Favored 'General case' 0 N--CA 1.483 1.217 0 CA-C-N 120.03 1.286 . . . . 0.0 112.712 175.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 47.8 mtt180 -52.18 -35.31 48.65 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 121.028 1.74 . . . . 0.0 113.976 -179.234 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.558 ' HB3' HD12 ' A' ' 63' ' ' LEU . . . -47.74 -40.12 19.61 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 113.908 1.077 . . . . 0.0 113.908 168.495 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.558 HD12 ' HB3' ' A' ' 62' ' ' ALA . 4.0 mp -82.75 10.2 8.13 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 126.458 1.903 . . . . 0.0 112.029 -172.686 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.84 30.83 13.73 Favored Glycine 0 CA--C 1.535 1.333 0 C-N-CA 124.732 1.158 . . . . 0.0 114.348 176.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.432 ' C ' ' HE3' ' A' ' 66' ' ' LYS . 0.3 OUTLIER -100.14 152.36 20.35 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.793 1.237 . . . . 0.0 114.105 -154.3 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.432 ' HE3' ' C ' ' A' ' 65' ' ' PHE . 0.4 OUTLIER -92.39 75.96 5.2 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 125.866 1.666 . . . . 0.0 108.955 -174.905 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 28.5 mm . . . . . 0 C--O 1.249 1.059 0 C-N-CA 127.798 2.439 . . . . 0.0 111.113 -158.321 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.28 0 N-CA-C 108.778 -1.729 . . . . 0.0 108.778 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.2 t -148.02 179.3 7.84 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 125.793 1.637 . . . . 0.0 108.034 165.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 43.7 m-85 -133.2 147.63 52.02 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.235 1.014 . . . . 0.0 110.595 -169.471 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 3.0 m -148.35 -40.11 0.17 Allowed 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.262 0.625 . . . . 0.0 112.673 -176.429 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 1.3 mpt? 31.13 51.71 0.55 Allowed Pre-proline 0 CA--C 1.555 1.166 0 C-N-CA 128.318 2.647 . . . . 0.0 116.96 170.439 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -69.99 13.07 0.32 Allowed 'Trans proline' 0 CA--C 1.548 1.185 0 C-N-CA 124.895 3.73 . . . . 0.0 116.195 -167.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -175.83 21.08 0.05 OUTLIER Glycine 0 CA--C 1.536 1.344 0 C-N-CA 127.287 2.375 . . . . 0.0 112.803 176.407 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -158.37 34.23 0.24 Allowed 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 -168.086 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 78.1 t -43.07 131.21 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 125.819 1.647 . . . . 0.0 112.328 172.071 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -59.44 66.31 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 129.872 3.269 . . . . 0.0 115.898 -170.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.8 t -147.92 126.81 12.71 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 120.125 -1.609 . . . . 0.0 111.587 178.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -146.64 59.54 5.27 Favored Pre-proline 0 CA--C 1.55 0.973 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 178.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -71.34 168.83 22.34 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 123.745 2.963 . . . . 0.0 110.386 164.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -156.55 157.47 30.97 Favored Pre-proline 0 CA--C 1.546 0.795 0 C-N-CA 124.643 1.177 . . . . 0.0 111.48 172.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -72.79 170.75 18.84 Favored 'Trans proline' 0 CA--C 1.547 1.135 0 C-N-CA 123.143 2.562 . . . . 0.0 110.733 158.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -69.44 173.35 10.82 Favored 'Trans proline' 0 CA--C 1.538 0.685 0 C-N-CA 121.961 1.774 . . . . 0.0 111.518 163.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.501 ' H ' ' CD ' ' A' ' 17' ' ' GLU . 2.8 mp0 -52.06 -41.14 62.1 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 126.923 2.089 . . . . 0.0 113.31 -168.046 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.4 m 54.54 28.68 10.1 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 126.298 1.839 . . . . 0.0 114.29 173.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -124.39 24.51 7.96 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 114.861 1.43 . . . . 0.0 114.861 -160.297 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -55.71 150.28 12.89 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-O 123.818 1.771 . . . . 0.0 111.082 172.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 45.49 31.13 0.85 Allowed 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 128.11 2.564 . . . . 0.0 114.856 -171.764 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -124.2 158.93 59.22 Favored Pre-proline 0 N--CA 1.48 1.046 0 C-N-CA 126.477 1.911 . . . . 0.0 110.968 171.52 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -76.96 161.63 32.81 Favored 'Trans proline' 0 CA--C 1.535 0.571 0 C-N-CA 122.76 2.307 . . . . 0.0 112.331 166.6 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.548 ' CD1' ' H ' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -75.31 175.18 8.61 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-O 122.433 1.111 . . . . 0.0 112.487 170.06 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.548 ' H ' ' CD1' ' A' ' 24' ' ' LEU . 13.5 pttp -154.09 139.23 11.83 Favored Pre-proline 0 N--CA 1.468 0.46 0 C-N-CA 128.725 2.81 . . . . 0.0 107.503 -175.618 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_endo -76.74 -8.84 18.24 Favored 'Trans proline' 0 CA--C 1.544 0.983 0 C-N-CA 124.024 3.149 . . . . 0.0 113.601 -160.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 9.0 p -73.77 -22.2 59.92 Favored 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 127.247 2.219 . . . . 0.0 112.433 166.029 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.46 ' SG ' ' NZ ' ' A' ' 25' ' ' LYS . 69.7 m -113.31 -28.06 7.73 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 116.041 1.867 . . . . 0.0 116.041 -172.268 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.429 ' HB3' ' SD ' ' A' ' 60' ' ' MET . . . -61.32 158.44 14.39 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-N 118.99 0.813 . . . . 0.0 111.916 -173.203 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 56.9 m 40.22 59.3 7.35 Favored Pre-proline 0 CA--C 1.544 0.743 0 C-N-CA 124.862 1.265 . . . . 0.0 113.82 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_endo -69.19 -22.67 34.37 Favored 'Trans proline' 0 CA--C 1.534 0.509 0 C-N-CA 123.425 2.75 . . . . 0.0 112.552 -157.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -63.1 -62.45 1.69 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.967 2.107 . . . . 0.0 112.812 171.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.8 p -61.12 -30.83 70.61 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 118.187 -0.911 . . . . 0.0 111.694 170.592 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 8.1 tmtt? -59.09 -49.68 76.95 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 120.052 1.296 . . . . 0.0 111.659 171.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 16.1 tttp -63.26 -43.06 99.04 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.783 0.833 . . . . 0.0 111.436 176.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.19 -39.37 92.5 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.49 0.716 . . . . 0.0 112.86 176.082 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 8.2 ttp85 -58.26 -54.62 44.98 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 125.551 1.54 . . . . 0.0 109.405 173.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 78.5 m-20 -68.78 -33.56 74.09 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.039 0.936 . . . . 0.0 113.442 -176.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.4 -37.32 82.92 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 120.588 -1.32 . . . . 0.0 112.854 171.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.1 t -57.19 -38.54 73.82 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.723 0.773 . . . . 0.0 111.225 168.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 67.0 mt -75.43 -30.17 22.01 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 C-N-CA 124.95 1.3 . . . . 0.0 112.27 -176.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 67.2 mt -58.18 -45.38 88.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 CA-C-N 119.028 0.831 . . . . 0.0 110.377 163.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.67 -37.35 79.53 Favored 'General case' 0 CA--C 1.552 1.05 0 N-CA-C 115.024 1.491 . . . . 0.0 115.024 -174.284 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.87 -8.63 0.41 Allowed 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 117.57 2.433 . . . . 0.0 117.57 -176.555 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 82.96 165.62 37.88 Favored Glycine 0 CA--C 1.536 1.358 0 CA-C-N 119.773 1.17 . . . . 0.0 112.531 -164.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -76.69 -30.92 56.91 Favored 'General case' 0 CA--C 1.516 -0.349 0 O-C-N 120.311 -1.699 . . . . 0.0 114.401 -164.735 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.7 pt-20 -58.94 -35.87 73.83 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 123.229 0.33 . . . . 0.0 111.462 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 -82.83 4.42 25.51 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.967 1.707 . . . . 0.0 112.986 177.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.407 ' HA ' ' CE1' ' A' ' 51' ' ' HIS . 1.8 m -139.3 18.0 2.58 Favored 'General case' 0 N--CA 1.442 -0.86 0 C-N-CA 127.794 2.438 . . . . 0.0 112.154 -168.125 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . 0.712 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -69.93 -19.38 75.26 Favored Glycine 0 C--O 1.221 -0.658 0 O-C-N 119.751 -1.843 . . . . 0.0 115.56 -176.251 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . 0.407 ' CE1' ' HA ' ' A' ' 49' ' ' CYS . 38.4 p-80 -58.24 -34.65 70.68 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 120.18 1.99 . . . . 0.0 112.352 162.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.65 -32.87 60.38 Favored 'General case' 0 CA--C 1.52 -0.201 0 C-N-CA 125.326 1.45 . . . . 0.0 110.774 174.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.712 HD12 ' HA2' ' A' ' 50' ' ' GLY . 5.1 mt -66.72 -39.28 83.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 118.843 -1.143 . . . . 0.0 110.748 167.641 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -74.63 -47.98 28.96 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 -170.352 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.79 -39.99 72.05 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 121.597 0.713 . . . . 0.0 112.138 170.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 18.5 t60 -65.36 -48.96 71.12 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.73 0.812 . . . . 0.0 112.913 174.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 52.7 mttm -48.13 -47.18 34.84 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 124.885 1.274 . . . . 0.0 112.168 177.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -75.79 -25.95 56.87 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 117.844 -1.074 . . . . 0.0 113.045 -177.286 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 37.6 t -58.55 -58.31 9.12 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-O 118.376 -0.821 . . . . 0.0 111.545 160.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.429 ' SD ' ' HB3' ' A' ' 29' ' ' ALA . 9.3 mmm -47.15 -45.23 22.52 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-N 120.341 1.428 . . . . 0.0 111.36 174.351 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 1.9 mtt85 -63.07 -32.42 73.79 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 117.028 -1.463 . . . . 0.0 114.134 -171.147 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -50.48 -36.83 35.44 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 118.985 0.811 . . . . 0.0 112.613 170.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 4.9 mp -82.52 8.04 12.81 Favored 'General case' 0 CA--C 1.554 1.098 0 C-N-CA 125.817 1.647 . . . . 0.0 112.003 -173.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.75 41.21 5.42 Favored Glycine 0 CA--C 1.534 1.266 0 C-N-CA 124.864 1.221 . . . . 0.0 114.788 171.153 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -119.75 145.83 46.2 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 120.725 -1.456 . . . . 0.0 114.031 -142.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -91.64 89.56 7.19 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.429 1.892 . . . . 0.0 109.158 -176.198 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 23.9 mm . . . . . 0 C--O 1.25 1.114 0 C-N-CA 126.707 2.003 . . . . 0.0 111.848 -158.143 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.475 0 N-CA-C 109.279 -1.528 . . . . 0.0 109.279 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 77.8 p -160.84 178.73 9.13 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.258 1.423 . . . . 0.0 110.014 -176.012 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -62.31 161.29 11.68 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-O 121.052 0.453 . . . . 0.0 111.463 160.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 5.7 m -160.37 159.26 30.92 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 126.381 1.872 . . . . 0.0 108.327 171.02 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 8.3 ttt -130.9 72.88 81.62 Favored Pre-proline 0 CA--C 1.542 0.655 0 C-N-CA 124.188 0.995 . . . . 0.0 109.837 172.036 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -73.15 4.14 4.02 Favored 'Trans proline' 0 CA--C 1.543 0.952 0 C-N-CA 123.76 2.974 . . . . 0.0 115.104 -172.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -160.16 137.64 5.14 Favored Glycine 0 CA--C 1.527 0.797 0 C-N-CA 124.4 1.0 . . . . 0.0 110.62 173.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -170.7 144.28 2.29 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 127.269 2.227 . . . . 0.0 109.741 -176.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 23.2 t 60.86 156.16 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 O-C-N 125.739 1.9 . . . . 0.0 112.587 -165.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -137.52 -18.38 1.26 Allowed 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 115.525 1.676 . . . . 0.0 115.525 -165.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 97.2 p -160.87 172.28 17.26 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 -156.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 34.4 p-10 -139.51 60.25 16.09 Favored Pre-proline 0 CA--C 1.553 1.085 0 C-N-CA 126.425 1.89 . . . . 0.0 111.439 177.394 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.08 102.24 1.05 Allowed 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 123.834 3.023 . . . . 0.0 114.246 -160.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.95 153.17 56.35 Favored Pre-proline 0 CA--C 1.55 0.961 0 CA-C-N 113.743 -1.571 . . . . 0.0 114.334 -177.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -62.38 -177.82 0.32 Allowed 'Trans proline' 0 CA--C 1.549 1.263 0 C-N-CA 125.265 3.977 . . . . 0.0 113.581 172.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -73.43 -179.66 4.66 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 122.447 2.098 . . . . 0.0 111.595 158.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.4 ' CD ' ' H ' ' A' ' 19' ' ' GLN . 0.0 OUTLIER -73.98 168.48 19.4 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.032 1.333 . . . . 0.0 111.866 164.557 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 79.4 p -163.72 15.99 0.06 Allowed 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 116.946 2.202 . . . . 0.0 116.946 -176.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.4 ' H ' ' CD ' ' A' ' 17' ' ' GLU . 4.2 mm-40 -108.67 -10.26 15.2 Favored 'General case' 0 N--CA 1.446 -0.644 0 O-C-N 119.008 -2.308 . . . . 0.0 113.86 -171.213 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -86.31 166.56 15.53 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 125.03 2.348 . . . . 0.0 114.049 163.725 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.19 76.83 1.6 Allowed 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 129.101 2.961 . . . . 0.0 108.682 -174.046 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.11 161.92 59.86 Favored Pre-proline 0 N--CA 1.473 0.699 0 C-N-CA 129.471 3.108 . . . . 0.0 108.126 177.296 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -68.8 144.11 58.06 Favored 'Trans proline' 0 N--CA 1.455 -0.774 0 C-N-CA 120.874 1.05 . . . . 0.0 110.894 164.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.57 ' CD1' ' H ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -77.24 162.29 27.47 Favored 'General case' 0 CA--C 1.552 1.024 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.23 163.355 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.57 ' H ' ' CD1' ' A' ' 24' ' ' LEU . 11.0 ptmm? -135.37 128.67 18.37 Favored Pre-proline 0 N--CA 1.466 0.336 0 C-N-CA 129.762 3.225 . . . . 0.0 106.156 -177.363 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_endo -68.27 -19.22 44.4 Favored 'Trans proline' 0 CA--C 1.542 0.909 0 C-N-CA 123.419 2.746 . . . . 0.0 114.207 -155.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 29.9 p -68.49 -21.46 64.6 Favored 'General case' 0 CA--C 1.559 1.315 0 C-N-CA 125.852 1.661 . . . . 0.0 113.132 171.119 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 83.2 m -105.97 -17.52 14.32 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 126.214 1.806 . . . . 0.0 114.645 -176.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.32 157.22 34.49 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.54 -0.725 . . . . 0.0 112.441 -167.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.6 m 40.91 58.03 8.4 Favored Pre-proline 0 CA--C 1.549 0.919 0 N-CA-C 114.21 1.189 . . . . 0.0 114.21 176.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -65.3 -24.35 58.08 Favored 'Trans proline' 0 CA--C 1.538 0.701 0 C-N-CA 122.483 2.122 . . . . 0.0 112.328 -160.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 28.0 mm-40 -58.37 -52.01 67.39 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 127.065 2.146 . . . . 0.0 111.843 177.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.9 p -76.5 -38.26 55.5 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.289 1.436 . . . . 0.0 111.565 170.247 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 6.4 tmtt? -52.73 -46.87 67.62 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 120.102 1.319 . . . . 0.0 112.057 179.048 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.5 tmmm? -51.97 -55.0 23.09 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 126.959 2.104 . . . . 0.0 112.183 171.094 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.5 -35.02 79.23 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 114.393 -1.276 . . . . 0.0 112.634 -177.004 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 7.5 ttp85 -62.6 -54.98 31.51 Favored 'General case' 0 C--O 1.222 -0.368 0 C-N-CA 125.766 1.626 . . . . 0.0 109.444 174.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -71.45 -28.16 63.77 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -175.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.86 -41.22 87.68 Favored 'General case' 0 CA--C 1.544 0.75 0 O-C-N 120.549 -1.344 . . . . 0.0 112.965 167.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 6.2 t -55.5 -37.39 67.8 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 122.271 1.034 . . . . 0.0 111.044 169.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 73.5 mt -75.39 -31.27 23.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 O-C-N 121.052 -1.03 . . . . 0.0 111.949 -179.374 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 86.0 mt -64.11 -35.76 74.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 CA-C-N 118.825 0.738 . . . . 0.0 111.641 166.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 27.2 mt-10 -75.03 -36.66 61.87 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 178.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.411 ' HG3' ' HB2' ' A' ' 48' ' ' HIS . 0.0 OUTLIER -148.68 -11.13 0.34 Allowed 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 118.083 2.623 . . . . 0.0 118.083 -173.666 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 86.78 166.7 42.82 Favored Glycine 0 CA--C 1.539 1.55 0 CA-C-N 120.035 1.289 . . . . 0.0 112.908 -163.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -76.44 -30.53 57.41 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 120.351 -1.676 . . . . 0.0 113.58 -168.388 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -58.25 -33.34 69.26 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 123.155 0.582 . . . . 0.0 112.258 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.411 ' HB2' ' HG3' ' A' ' 44' ' ' LYS . 93.9 m-70 -88.58 10.9 18.82 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.715 1.606 . . . . 0.0 112.591 178.767 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 2.7 m -141.2 14.91 2.23 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 126.294 1.838 . . . . 0.0 113.85 -162.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -60.29 -32.73 77.78 Favored Glycine 0 C--O 1.213 -1.189 0 O-C-N 120.152 -1.593 . . . . 0.0 115.264 -176.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 41.8 p-80 -55.37 -25.55 36.01 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 121.963 2.881 . . . . 0.0 114.439 169.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -79.89 -36.56 36.35 Favored 'General case' 0 C--N 1.339 0.119 0 C-N-CA 123.948 0.899 . . . . 0.0 111.379 170.066 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 42.6 mt -75.89 -33.52 25.64 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.391 0 CA-C-O 119.092 -0.48 . . . . 0.0 110.184 -177.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.519 ' HG3' ' HE3' ' A' ' 57' ' ' LYS . 1.5 mp0 -70.24 -53.23 17.88 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 125.48 1.512 . . . . 0.0 112.781 177.382 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -53.37 -35.11 59.94 Favored 'General case' 0 CA--C 1.545 0.752 0 O-C-N 121.267 -0.895 . . . . 0.0 113.028 173.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 19.2 t60 -73.9 -43.18 59.27 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.535 1.134 . . . . 0.0 113.931 174.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.519 ' HE3' ' HG3' ' A' ' 54' ' ' GLU . 26.3 mtmt -53.16 -52.21 59.51 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 125.275 1.43 . . . . 0.0 111.339 175.302 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -66.56 -37.58 85.27 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 122.99 0.516 . . . . 0.0 111.586 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 18.6 t -52.57 -59.64 4.21 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-O 117.805 -1.093 . . . . 0.0 112.162 167.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 92.9 mtp -47.6 -51.6 20.63 Favored 'General case' 0 N--CA 1.488 1.464 0 CA-C-N 120.69 1.586 . . . . 0.0 110.821 171.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 37.5 mtt180 -54.91 -34.8 63.47 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 125.453 1.501 . . . . 0.0 114.0 -177.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -48.45 -39.09 21.61 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 119.203 0.91 . . . . 0.0 113.192 169.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 3.6 mp -81.0 8.86 7.47 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 124.84 1.256 . . . . 0.0 111.746 -173.704 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 86.65 18.81 57.82 Favored Glycine 0 CA--C 1.535 1.334 0 C-N-CA 125.278 1.418 . . . . 0.0 114.404 -178.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -72.59 170.67 13.95 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.538 1.535 . . . . 0.0 114.846 -166.039 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.31 88.93 3.01 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 125.103 1.361 . . . . 0.0 108.369 -177.158 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 26.0 mm . . . . . 0 C--O 1.244 0.765 0 C-N-CA 130.69 3.596 . . . . 0.0 107.458 -162.392 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.574 0 N-CA-C 109.313 -1.515 . . . . 0.0 109.313 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.9 m -64.57 -10.13 24.02 Favored 'General case' 0 N--CA 1.479 0.984 0 N-CA-C 117.784 2.512 . . . . 0.0 117.784 -162.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 8.7 t80 42.35 34.29 0.5 Allowed 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 126.951 2.1 . . . . 0.0 115.42 176.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.2 m -90.99 141.0 29.31 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 120.833 -1.167 . . . . 0.0 111.16 -167.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 8.0 tpt -122.21 76.2 42.01 Favored Pre-proline 0 CA--C 1.542 0.656 0 C-N-CA 124.397 1.079 . . . . 0.0 110.536 175.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -73.58 6.83 2.55 Favored 'Trans proline' 0 CA--C 1.543 0.956 0 C-N-CA 123.541 2.828 . . . . 0.0 114.349 177.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -79.62 34.25 2.07 Favored Glycine 0 CA--C 1.533 1.183 0 O-C-N 120.852 -1.155 . . . . 0.0 114.407 -176.419 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.7 mp -114.15 113.52 24.8 Favored 'General case' 0 C--O 1.224 -0.281 0 C-N-CA 125.919 1.688 . . . . 0.0 109.041 -171.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 63.0 t 50.66 95.31 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 126.455 1.902 . . . . 0.0 114.195 177.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -59.95 109.09 0.87 Allowed 'General case' 0 CA--C 1.54 0.567 0 O-C-N 121.414 -0.804 . . . . 0.0 110.815 159.425 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 31.5 p -67.37 130.67 43.81 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 121.977 0.894 . . . . 0.0 110.346 169.34 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -152.99 57.81 2.16 Favored Pre-proline 0 CA--C 1.544 0.721 0 N-CA-C 114.436 1.273 . . . . 0.0 114.436 -178.281 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -68.06 172.33 11.09 Favored 'Trans proline' 0 N--CA 1.451 -1.028 0 C-N-CA 124.255 3.303 . . . . 0.0 111.98 176.378 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -72.27 157.76 88.69 Favored Pre-proline 0 CA--C 1.546 0.793 0 CA-C-N 113.69 -1.595 . . . . 0.0 111.166 165.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -68.16 160.84 47.05 Favored 'Trans proline' 0 CA--C 1.545 1.025 0 C-N-CA 122.834 2.356 . . . . 0.0 110.967 163.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -71.17 174.41 10.75 Favored 'Trans proline' 0 CA--C 1.535 0.574 0 C-N-CA 122.697 2.265 . . . . 0.0 112.506 176.518 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -140.76 167.59 21.81 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.183 1.393 . . . . 0.0 111.258 -167.51 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.1 p -155.45 57.58 0.63 Allowed 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.857 1.263 . . . . 0.0 112.52 178.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -146.1 161.52 39.99 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.397 -0.814 . . . . 0.0 109.07 174.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -59.54 154.72 16.78 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 122.937 1.351 . . . . 0.0 112.61 163.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -163.71 146.96 10.0 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 127.489 2.316 . . . . 0.0 107.911 175.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 64.6 mttt -63.14 142.58 97.74 Favored Pre-proline 0 N--CA 1.474 0.769 0 O-C-N 121.324 -0.86 . . . . 0.0 110.604 170.042 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -79.65 163.25 24.08 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 121.891 1.728 . . . . 0.0 113.674 -160.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.75 158.96 32.62 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 113.439 -1.71 . . . . 0.0 113.12 169.595 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.05 147.64 37.63 Favored Pre-proline 0 N--CA 1.463 0.205 0 C-N-CA 124.734 1.213 . . . . 0.0 108.297 166.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -67.2 -35.42 24.73 Favored 'Trans proline' 0 CA--C 1.535 0.559 0 C-N-CA 121.625 1.55 . . . . 0.0 111.461 -178.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 29.7 p -77.69 -23.64 49.48 Favored 'General case' 0 CA--C 1.557 1.241 0 C-N-CA 125.507 1.523 . . . . 0.0 113.658 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 82.2 m -98.21 -17.43 18.99 Favored 'General case' 0 CA--C 1.553 1.094 0 N-CA-C 114.511 1.301 . . . . 0.0 114.511 -179.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.35 163.7 8.18 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.182 0.993 . . . . 0.0 112.87 -178.566 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 56.7 m 42.21 54.54 9.1 Favored Pre-proline 0 CA--C 1.547 0.852 0 C-N-CA 124.815 1.246 . . . . 0.0 113.328 -174.446 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -69.65 -24.09 30.57 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 123.319 2.679 . . . . 0.0 112.776 -158.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.41 ' HG3' ' H ' ' A' ' 33' ' ' THR . 0.1 OUTLIER -53.48 -69.83 0.11 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 127.785 2.434 . . . . 0.0 113.76 164.177 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.41 ' H ' ' HG3' ' A' ' 32' ' ' GLU . 0.0 OUTLIER -60.84 -35.28 76.13 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 126.129 1.771 . . . . 0.0 110.96 176.554 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 9.2 tmtm? -53.41 -52.01 60.74 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.969 1.708 . . . . 0.0 112.264 169.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 50.4 tttm -58.5 -47.89 82.6 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.806 0.842 . . . . 0.0 111.984 175.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.14 -39.76 95.61 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 114.731 -1.122 . . . . 0.0 112.209 -178.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 11.8 ttp85 -61.48 -57.12 13.44 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 125.729 1.612 . . . . 0.0 109.918 174.453 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -66.35 -28.51 68.72 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.851 0.861 . . . . 0.0 112.92 -176.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.97 -42.39 80.92 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 120.216 -1.552 . . . . 0.0 112.646 169.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.7 t -55.43 -34.41 64.42 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 122.173 0.987 . . . . 0.0 111.545 171.386 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 61.8 mt -77.36 -33.55 19.89 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 C-N-CA 125.381 1.472 . . . . 0.0 112.428 178.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 73.2 mt -66.05 -34.06 67.69 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 123.883 0.873 . . . . 0.0 111.44 168.207 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -74.01 -36.3 64.45 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.013 1.325 . . . . 0.0 114.509 178.595 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.7 mppt? -138.43 -55.97 0.64 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.162 1.385 . . . . 0.0 113.646 175.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 136.75 163.54 9.82 Favored Glycine 0 CA--C 1.532 1.103 0 C-N-CA 126.32 1.914 . . . . 0.0 109.6 -159.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.521 ' HB3' HD11 ' A' ' 53' ' ' ILE . 0.2 OUTLIER -74.1 -28.22 61.26 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 120.927 -1.337 . . . . 0.0 112.893 -169.091 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 -57.49 -32.49 67.06 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 178.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -84.79 5.22 29.46 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.941 1.296 . . . . 0.0 113.13 177.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 6.9 m -147.47 16.11 1.14 Allowed 'General case' 0 N--CA 1.441 -0.901 0 C-N-CA 125.067 1.347 . . . . 0.0 113.107 -154.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . 0.643 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -65.76 -27.59 72.84 Favored Glycine 0 C--O 1.216 -0.983 0 O-C-N 120.115 -1.615 . . . . 0.0 114.964 -179.549 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 40.8 p-80 -54.93 -25.58 30.34 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 120.973 2.386 . . . . 0.0 113.852 165.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.58 -34.04 31.24 Favored 'General case' 0 N--CA 1.462 0.135 0 C-N-CA 123.718 0.807 . . . . 0.0 110.956 173.081 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.643 HD12 ' HA2' ' A' ' 50' ' ' GLY . 35.9 mt -74.45 -38.57 46.77 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-O 119.202 -0.428 . . . . 0.0 110.626 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.68 -53.12 56.29 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 125.851 1.66 . . . . 0.0 111.404 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -56.37 -40.5 74.66 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.052 -1.03 . . . . 0.0 112.65 177.324 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 15.5 t60 -68.31 -48.12 65.75 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.937 1.295 . . . . 0.0 113.737 177.14 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 4.1 mtpp -48.97 -53.05 21.5 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 126.258 1.823 . . . . 0.0 111.498 174.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 34.8 mm-40 -72.9 -36.82 67.38 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.206 0.602 . . . . 0.0 111.564 -176.346 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 48.6 t -49.89 -56.49 10.31 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.594 0.757 . . . . 0.0 112.16 165.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 8.1 mtp -54.36 -53.59 51.96 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.89 1.276 . . . . 0.0 110.168 174.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 57.9 mtt180 -53.34 -30.93 41.93 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 126.137 1.775 . . . . 0.0 114.683 -176.362 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -47.56 -35.89 9.71 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.346 1.058 . . . . 0.0 112.911 169.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.3 mp -79.0 5.62 11.27 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.909 1.283 . . . . 0.0 112.381 -172.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.56 8.6 70.31 Favored Glycine 0 CA--C 1.535 1.291 0 C-N-CA 125.899 1.714 . . . . 0.0 113.049 -170.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -72.36 160.74 31.85 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 127.407 2.283 . . . . 0.0 112.74 -172.656 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.9 94.44 4.68 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.727 1.211 . . . . 0.0 108.131 -179.245 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.308 0 C-N-CA 127.469 2.308 . . . . 0.0 109.676 174.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.394 0 N-CA-C 108.321 -1.911 . . . . 0.0 108.321 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.1 m -148.21 161.88 40.59 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 118.238 1.019 . . . . 0.0 110.979 -167.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 85.2 t80 -149.76 157.75 43.51 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.322 1.449 . . . . 0.0 109.765 176.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.7 m -158.54 -50.33 0.06 Allowed 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 171.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 18.4 ttt 31.87 54.23 0.9 Allowed Pre-proline 0 N--CA 1.482 1.143 0 C-N-CA 126.932 2.093 . . . . 0.0 116.103 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -74.5 1.38 7.5 Favored 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 122.588 2.192 . . . . 0.0 115.903 -163.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 126.65 87.72 0.64 Allowed Glycine 0 N--CA 1.47 0.957 0 CA-C-N 118.928 0.786 . . . . 0.0 111.709 -176.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -159.2 148.58 18.59 Favored 'General case' 0 N--CA 1.463 0.176 0 C-N-CA 124.364 1.066 . . . . 0.0 112.175 -171.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 41.9 t 67.74 145.81 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 C-N-CA 128.191 2.596 . . . . 0.0 114.452 175.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -130.0 -37.4 1.5 Allowed 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 125.836 1.654 . . . . 0.0 113.768 -172.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.0 t 46.11 22.82 0.15 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 128.362 2.665 . . . . 0.0 115.831 -171.411 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 -148.78 61.08 5.3 Favored Pre-proline 0 CA--C 1.555 1.135 0 C-N-CA 126.432 1.893 . . . . 0.0 112.253 -172.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -65.86 162.8 33.39 Favored 'Trans proline' 0 N--CA 1.45 -1.072 0 C-N-CA 124.013 3.142 . . . . 0.0 110.51 166.011 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -75.6 148.94 83.27 Favored Pre-proline 0 CA--C 1.547 0.849 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -67.51 169.08 16.45 Favored 'Trans proline' 0 CA--C 1.546 1.118 0 C-N-CA 124.205 3.27 . . . . 0.0 112.404 167.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.81 176.51 8.85 Favored 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 123.252 2.635 . . . . 0.0 112.869 172.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -97.41 139.89 32.68 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 114.912 -1.04 . . . . 0.0 112.432 175.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.0 m -67.22 14.24 0.05 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 126.981 2.112 . . . . 0.0 115.787 -178.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 18.5 tp60 -66.02 -32.85 74.56 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.651 1.18 . . . . 0.0 113.735 -171.117 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -169.17 -159.69 0.24 Allowed 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.884 1.674 . . . . 0.0 109.554 174.787 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 40.1 mmtm -55.27 33.62 0.0 OUTLIER 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 129.876 3.27 . . . . 0.0 117.123 173.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 44.7 mttt -57.97 153.24 34.85 Favored Pre-proline 0 N--CA 1.472 0.663 0 O-C-N 120.197 -1.564 . . . . 0.0 112.472 176.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -73.5 166.59 29.46 Favored 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 122.34 2.027 . . . . 0.0 112.635 -177.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.441 HD22 ' HB2' ' A' ' 29' ' ' ALA . 1.2 mt -122.6 167.09 13.83 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.762 1.225 . . . . 0.0 112.439 175.356 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 4.6 mttp -129.44 150.62 76.1 Favored Pre-proline 0 N--CA 1.472 0.664 0 C-N-CA 126.467 1.907 . . . . 0.0 107.772 174.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -78.41 -19.0 12.0 Favored 'Trans proline' 0 CA--C 1.55 1.297 0 C-N-CA 122.246 1.964 . . . . 0.0 112.425 -179.036 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 26.8 p -73.9 -14.6 61.09 Favored 'General case' 0 CA--C 1.557 1.217 0 C-N-CA 125.726 1.61 . . . . 0.0 112.629 165.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 64.6 m -111.77 -36.22 5.5 Favored 'General case' 0 CA--C 1.547 0.858 0 N-CA-C 114.622 1.342 . . . . 0.0 114.622 -177.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.441 ' HB2' HD22 ' A' ' 24' ' ' LEU . . . -63.26 157.15 23.46 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.901 0.88 . . . . 0.0 110.003 -179.769 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 53.6 m 43.55 55.16 11.62 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 123.567 0.747 . . . . 0.0 113.004 -179.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -68.98 -7.93 22.17 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 123.906 3.071 . . . . 0.0 113.578 -158.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 36.2 mm-40 -96.37 -43.54 7.62 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 125.215 1.406 . . . . 0.0 110.685 -176.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.1 p -66.58 -27.26 67.59 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 117.948 -1.025 . . . . 0.0 111.99 161.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 9.8 tmtt? -58.32 -55.43 35.11 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 120.276 1.398 . . . . 0.0 111.457 169.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.6 mttp -55.16 -43.38 74.19 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 125.355 1.462 . . . . 0.0 112.458 172.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.61 -39.8 80.67 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 177.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 12.0 ttp85 -58.49 -53.25 60.44 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.514 1.125 . . . . 0.0 109.106 176.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -74.37 -30.11 61.84 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 115.124 -0.944 . . . . 0.0 112.817 -174.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.49 -43.32 99.08 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 120.772 -1.205 . . . . 0.0 111.794 166.148 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.8 t -56.27 -33.45 65.5 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.952 0.901 . . . . 0.0 111.741 173.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 67.0 mt -77.88 -35.46 20.84 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 124.769 1.228 . . . . 0.0 112.482 177.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 84.4 mt -64.46 -36.29 76.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 124.375 1.07 . . . . 0.0 111.379 168.364 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -71.98 -37.84 69.82 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.761 1.625 . . . . 0.0 113.983 178.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.9 mppt? -139.12 -59.23 0.59 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.582 1.553 . . . . 0.0 113.706 178.043 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 135.61 158.24 8.17 Favored Glycine 0 CA--C 1.531 1.033 0 C-N-CA 126.104 1.811 . . . . 0.0 109.714 -159.102 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.505 ' HB3' HD11 ' A' ' 53' ' ' ILE . 0.4 OUTLIER -72.96 -27.48 61.85 Favored 'General case' 0 N--CA 1.465 0.28 0 O-C-N 120.746 -1.444 . . . . 0.0 113.011 -165.857 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -56.46 -36.18 68.77 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 122.76 0.424 . . . . 0.0 111.76 177.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -81.51 4.46 21.16 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.81 1.244 . . . . 0.0 113.1 177.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 6.0 m -147.81 15.84 1.09 Allowed 'General case' 0 N--CA 1.439 -0.994 0 C-N-CA 125.945 1.698 . . . . 0.0 112.473 -154.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . 0.756 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -75.33 -13.16 83.08 Favored Glycine 0 C--O 1.222 -0.652 0 O-C-N 119.707 -1.87 . . . . 0.0 115.378 -178.061 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 35.2 p-80 -60.65 -33.82 73.38 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.889 1.844 . . . . 0.0 112.214 158.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.84 -37.85 67.28 Favored 'General case' 0 CA--C 1.516 -0.332 0 C-N-CA 124.132 0.973 . . . . 0.0 108.944 177.147 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.756 HD12 ' HA2' ' A' ' 50' ' ' GLY . 17.6 mt -71.23 -43.05 74.91 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.614 0 CA-C-O 118.853 -0.594 . . . . 0.0 109.673 177.617 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -60.93 -46.67 89.75 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 119.43 1.014 . . . . 0.0 112.267 179.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -61.54 -44.52 96.89 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.501 0.72 . . . . 0.0 112.865 175.339 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 14.2 t60 -63.33 -45.42 91.36 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 121.142 -0.973 . . . . 0.0 112.643 174.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.6 mtmt -54.76 -48.29 72.83 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.598 0.759 . . . . 0.0 111.235 173.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 87.3 mt-10 -70.94 -28.29 64.38 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 117.929 -1.034 . . . . 0.0 113.112 -178.563 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 48.9 t -57.02 -60.24 3.88 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 119.183 0.901 . . . . 0.0 111.212 160.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 76.0 mtm -54.05 -45.51 71.69 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 119.576 1.08 . . . . 0.0 113.355 178.212 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 47.7 mtt180 -50.71 -37.28 40.6 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 126.636 1.974 . . . . 0.0 113.292 -178.196 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.57 ' HB3' HD12 ' A' ' 63' ' ' LEU . . . -47.45 -39.08 14.9 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 169.428 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.57 HD12 ' HB3' ' A' ' 62' ' ' ALA . 1.7 mp -84.1 10.26 10.55 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 126.367 1.867 . . . . 0.0 111.571 -172.397 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.11 33.46 10.76 Favored Glycine 0 CA--C 1.534 1.247 0 O-C-N 120.623 -1.298 . . . . 0.0 113.685 -179.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -99.07 156.46 16.92 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.038 1.735 . . . . 0.0 112.749 -168.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 3.1 mppt? -116.37 73.11 0.84 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.0 1.72 . . . . 0.0 109.504 -160.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.028 0 C-N-CA 125.801 1.64 . . . . 0.0 111.759 -165.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.5 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 7.8 t -157.8 -176.72 6.09 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.069 1.348 . . . . 0.0 109.541 173.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 24.9 p90 -141.05 172.4 12.73 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.718 1.607 . . . . 0.0 110.357 174.551 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 3.4 m -158.45 158.35 33.97 Favored 'General case' 0 N--CA 1.478 0.949 0 O-C-N 120.821 -1.175 . . . . 0.0 110.187 178.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.3 tpt -127.13 73.83 77.0 Favored Pre-proline 0 N--CA 1.471 0.593 0 C-N-CA 125.117 1.367 . . . . 0.0 108.947 167.312 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -68.1 0.74 4.11 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 123.768 2.979 . . . . 0.0 115.21 -169.167 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -104.46 -18.65 12.62 Favored Glycine 0 CA--C 1.533 1.206 0 CA-C-O 118.902 -0.943 . . . . 0.0 114.665 173.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 46.83 -165.73 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.821 1.249 . . . . 0.0 113.135 -165.388 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.4 p -158.69 147.5 8.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 O-C-N 121.159 -0.963 . . . . 0.0 112.673 179.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -137.05 162.54 33.06 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 127.531 2.332 . . . . 0.0 107.055 151.172 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 24.9 m -158.62 56.34 0.44 Allowed 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.697 1.199 . . . . 0.0 110.551 163.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -121.13 63.69 12.45 Favored Pre-proline 0 CA--C 1.552 1.041 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -176.37 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_endo -81.49 -169.99 0.89 Allowed 'Trans proline' 0 CA--C 1.544 0.994 0 C-N-CA 124.774 3.65 . . . . 0.0 111.515 170.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -127.29 156.37 74.92 Favored Pre-proline 0 CA--C 1.544 0.712 0 C-N-CA 124.339 1.056 . . . . 0.0 111.423 167.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -70.07 156.8 61.66 Favored 'Trans proline' 0 CA--C 1.543 0.956 0 C-N-CA 122.888 2.392 . . . . 0.0 112.706 171.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -75.28 175.52 11.16 Favored 'Trans proline' 0 CA--C 1.537 0.638 0 C-N-CA 123.031 2.487 . . . . 0.0 112.333 166.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -82.46 156.54 24.03 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.468 1.107 . . . . 0.0 113.519 -176.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 10.1 m -65.34 15.99 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 127.968 2.507 . . . . 0.0 116.858 -176.569 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -36.85 -52.33 0.92 Allowed 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 127.885 2.474 . . . . 0.0 114.344 -168.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -162.74 167.82 22.43 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.618 1.167 . . . . 0.0 108.281 148.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.28 51.75 0.17 Allowed 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 127.742 2.417 . . . . 0.0 111.894 175.286 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 41.1 mmtm -72.82 158.4 87.3 Favored Pre-proline 0 N--CA 1.474 0.745 0 C-N-CA 125.49 1.516 . . . . 0.0 113.083 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -83.13 171.51 11.43 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 123.372 2.715 . . . . 0.0 111.652 168.177 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.74 ' CD1' ' H ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -98.7 165.1 11.96 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-O 122.503 1.144 . . . . 0.0 111.246 172.244 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.74 ' H ' ' CD1' ' A' ' 24' ' ' LEU . 0.1 OUTLIER -147.46 120.51 4.81 Favored Pre-proline 0 CA--C 1.538 0.485 0 C-N-CA 131.505 3.922 . . . . 0.0 105.41 -168.497 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -62.18 -32.88 82.84 Favored 'Trans proline' 0 CA--C 1.536 0.6 0 C-N-CA 124.047 3.165 . . . . 0.0 114.401 -148.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 29.6 p -64.46 -19.4 65.54 Favored 'General case' 0 CA--C 1.555 1.169 0 C-N-CA 125.379 1.472 . . . . 0.0 113.81 179.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 61.5 m -110.01 -4.75 15.71 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.897 1.679 . . . . 0.0 114.457 -177.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.74 154.55 38.7 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.133 -0.979 . . . . 0.0 110.261 -177.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 55.6 m 42.31 59.75 10.0 Favored Pre-proline 0 CA--C 1.548 0.879 0 N-CA-C 113.777 1.028 . . . . 0.0 113.777 179.471 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -69.9 -18.22 36.48 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.642 2.228 . . . . 0.0 112.747 -156.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 27.5 mm-40 -85.37 -40.8 16.08 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.691 1.196 . . . . 0.0 112.295 -178.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.4 p -65.53 -30.28 71.01 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 120.725 -1.235 . . . . 0.0 111.328 161.134 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 9.6 tmtt? -60.85 -48.14 83.18 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 120.39 1.45 . . . . 0.0 111.836 171.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 42.4 mttt -55.04 -49.64 71.07 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 126.106 1.763 . . . . 0.0 111.694 171.297 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.17 -36.6 83.51 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 112.921 0.712 . . . . 0.0 112.921 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 8.3 ttp85 -58.87 -53.46 58.18 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.939 1.296 . . . . 0.0 109.6 174.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 60.6 m-20 -70.46 -30.39 67.2 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.78 0.832 . . . . 0.0 112.836 -176.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.42 -39.42 93.8 Favored 'General case' 0 CA--C 1.547 0.857 0 O-C-N 120.418 -1.426 . . . . 0.0 112.969 166.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.8 t -59.73 -32.38 70.49 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 122.773 1.273 . . . . 0.0 112.095 169.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 67.9 mt -75.57 -33.01 25.84 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 O-C-N 120.386 -1.446 . . . . 0.0 111.341 177.522 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 77.3 mt -62.48 -36.63 75.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.617 1.167 . . . . 0.0 112.173 166.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -64.88 -48.67 73.42 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 119.573 1.079 . . . . 0.0 113.269 175.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.4 pttm -155.5 -4.91 0.13 Allowed 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 116.407 2.003 . . . . 0.0 116.407 -160.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 83.71 158.42 26.76 Favored Glycine 0 CA--C 1.527 0.811 0 CA-C-N 119.057 0.844 . . . . 0.0 112.62 -167.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.09 -28.36 68.11 Favored 'General case' 0 C--N 1.334 -0.101 0 O-C-N 121.578 -0.954 . . . . 0.0 112.723 -169.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.416 ' HG3' ' CD2' ' A' ' 48' ' ' HIS . 11.3 pt-20 -59.69 -26.22 65.4 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-O 118.122 -0.942 . . . . 0.0 112.905 175.613 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.416 ' CD2' ' HG3' ' A' ' 47' ' ' GLU . 82.5 m-70 -98.72 15.33 25.64 Favored 'General case' 0 C--N 1.352 0.683 0 CA-C-N 120.61 1.55 . . . . 0.0 110.528 -179.594 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 1.8 m -147.79 14.74 1.07 Allowed 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 125.973 1.709 . . . . 0.0 113.503 -157.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . 0.544 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -67.11 -17.63 68.15 Favored Glycine 0 C--O 1.215 -1.064 0 O-C-N 119.569 -1.957 . . . . 0.0 115.825 -175.508 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 35.2 p-80 -58.94 -33.69 70.89 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 121.572 2.686 . . . . 0.0 112.795 164.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.24 -34.64 61.43 Favored 'General case' 0 N--CA 1.462 0.175 0 C-N-CA 126.354 1.862 . . . . 0.0 111.453 173.737 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.544 HD12 ' HA2' ' A' ' 50' ' ' GLY . 3.5 mt -70.54 -43.44 77.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 118.911 -1.115 . . . . 0.0 110.914 171.058 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -63.02 -53.78 48.54 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.921 0.888 . . . . 0.0 112.278 -176.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -58.45 -32.69 68.95 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.34 -1.475 . . . . 0.0 113.646 178.082 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 10.7 t60 -74.02 -44.67 53.66 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.677 1.191 . . . . 0.0 113.043 175.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.519 ' HD3' HG22 ' A' ' 53' ' ' ILE . 35.0 mtpt -53.54 -53.1 56.46 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.162 1.385 . . . . 0.0 112.07 176.27 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -62.76 -40.62 97.83 Favored 'General case' 0 C--N 1.327 -0.405 0 O-C-N 123.318 0.386 . . . . 0.0 111.713 -176.285 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 44.0 t -51.5 -51.28 56.51 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 124.069 0.948 . . . . 0.0 112.844 169.269 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 72.8 mtm -62.06 -51.72 66.81 Favored 'General case' 0 N--CA 1.481 1.081 0 O-C-N 120.979 -1.076 . . . . 0.0 111.507 171.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 69.0 mtt180 -53.77 -32.37 52.1 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 126.981 2.112 . . . . 0.0 113.87 -175.44 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -44.86 -33.35 1.92 Allowed 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.047 1.339 . . . . 0.0 113.804 168.605 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.3 mp -82.19 5.63 19.2 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.195 0.998 . . . . 0.0 112.375 -173.286 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.29 17.9 75.3 Favored Glycine 0 CA--C 1.534 1.233 0 C-N-CA 125.039 1.304 . . . . 0.0 112.614 -166.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -70.49 144.24 51.45 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.999 1.72 . . . . 0.0 110.692 179.371 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? -106.34 101.72 11.17 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 125.084 1.354 . . . . 0.0 108.979 -175.124 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.252 1.207 0 C-N-CA 128.512 2.725 . . . . 0.0 109.191 -172.027 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.357 0 N-CA-C 108.251 -1.94 . . . . 0.0 108.251 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 12.8 m -147.61 158.79 44.16 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 118.391 1.096 . . . . 0.0 111.272 -164.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -56.22 137.4 52.05 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 160.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.9 m -147.66 141.09 25.34 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.55 1.14 . . . . 0.0 108.544 -178.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . 0.25 12.6 ptt? -134.0 65.58 69.99 Favored Pre-proline 0 CA--C 1.545 0.779 0 N-CA-C 113.577 0.955 . . . . 0.0 113.577 -173.707 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -73.62 -3.92 14.55 Favored 'Trans proline' 0 CA--C 1.546 1.103 0 C-N-CA 123.1 2.534 . . . . 0.0 115.464 -178.023 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -94.95 45.9 2.09 Favored Glycine 0 N--CA 1.473 1.146 0 C-N-CA 125.219 1.39 . . . . 0.0 113.883 -174.11 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 5.4 mp -112.17 138.6 48.62 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 125.335 1.454 . . . . 0.0 111.373 -172.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 24.8 t 46.49 65.45 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 C-N-CA 126.071 1.748 . . . . 0.0 112.093 161.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 14.2 t0 -123.22 164.91 17.82 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -153.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 61.6 m -67.13 126.04 27.94 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.444 1.098 . . . . 0.0 112.778 -179.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -126.92 79.9 71.97 Favored Pre-proline 0 CA--C 1.542 0.67 0 C-N-CA 125.56 1.544 . . . . 0.0 108.307 174.64 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -78.95 179.69 6.25 Favored 'Trans proline' 0 N--CA 1.454 -0.82 0 C-N-CA 123.938 3.092 . . . . 0.0 111.962 -175.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.27 153.53 75.01 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 123.739 0.816 . . . . 0.0 112.923 172.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -69.63 165.53 30.49 Favored 'Trans proline' 0 CA--C 1.545 1.029 0 C-N-CA 123.294 2.662 . . . . 0.0 111.884 166.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -70.72 176.08 7.99 Favored 'Trans proline' 0 CA--C 1.537 0.657 0 C-N-CA 122.847 2.365 . . . . 0.0 112.313 169.17 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -74.81 154.75 38.16 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.302 1.041 . . . . 0.0 113.207 -178.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.7 p -155.37 -3.24 0.14 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 126.946 2.098 . . . . 0.0 114.944 -179.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -142.61 170.29 15.99 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 119.42 1.009 . . . . 0.0 109.937 -174.805 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -56.97 137.13 56.0 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 120.09 -1.631 . . . . 0.0 111.492 157.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -134.86 -175.64 3.97 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 130.141 3.376 . . . . 0.0 109.839 171.124 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 35.4 mmtm -129.38 150.54 75.84 Favored Pre-proline 0 N--CA 1.474 0.734 0 O-C-N 121.197 -0.939 . . . . 0.0 110.184 162.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -82.57 166.49 15.58 Favored 'Trans proline' 0 CA--C 1.534 0.494 0 C-N-CA 122.356 2.037 . . . . 0.0 113.5 -162.399 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.617 ' CD1' ' H ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -135.96 163.8 29.44 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.153 1.381 . . . . 0.0 109.353 171.271 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.617 ' H ' ' CD1' ' A' ' 24' ' ' LEU . 12.4 ptmm? -139.01 130.71 15.3 Favored Pre-proline 0 CA--C 1.536 0.429 0 C-N-CA 129.781 3.232 . . . . 0.0 106.342 -176.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -61.43 -28.9 84.39 Favored 'Trans proline' 0 CA--C 1.541 0.836 0 C-N-CA 123.939 3.092 . . . . 0.0 114.714 -154.46 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 29.3 p -71.95 -21.36 61.61 Favored 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 125.461 1.504 . . . . 0.0 113.961 177.127 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 99.2 m -100.68 -12.57 19.05 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.737 1.615 . . . . 0.0 114.085 -178.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.31 151.74 43.02 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.267 0.627 . . . . 0.0 110.666 -174.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 57.4 m 42.04 58.4 10.12 Favored Pre-proline 0 CA--C 1.552 1.032 0 N-CA-C 114.1 1.148 . . . . 0.0 114.1 -176.377 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -65.57 -30.84 51.43 Favored 'Trans proline' 0 CA--C 1.534 0.495 0 C-N-CA 123.729 2.953 . . . . 0.0 112.041 -166.092 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -41.5 -70.04 0.12 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 127.349 2.26 . . . . 0.0 115.31 158.365 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -65.25 -28.7 69.53 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.007 -1.058 . . . . 0.0 111.726 177.046 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 5.0 tmtt? -58.12 -46.69 85.15 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 120.359 1.436 . . . . 0.0 111.088 171.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 4.5 tmtm? -63.34 -45.06 92.98 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 123.721 0.808 . . . . 0.0 110.716 176.434 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.78 -42.4 97.46 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 176.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 11.4 ttp85 -59.45 -53.72 54.93 Favored 'General case' 0 C--O 1.221 -0.429 0 C-N-CA 126.148 1.779 . . . . 0.0 110.247 175.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 56.8 m-20 -66.19 -31.97 73.12 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.014 0.926 . . . . 0.0 113.137 179.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -69.22 -37.08 77.87 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 120.728 -1.232 . . . . 0.0 112.447 172.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 9.3 t -55.91 -43.21 77.08 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 121.949 0.88 . . . . 0.0 110.89 169.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 71.4 mt -69.16 -29.01 41.24 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 C-N-CA 124.319 1.048 . . . . 0.0 111.272 -179.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 89.3 mt -70.31 -35.15 61.41 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 C-N-CA 123.509 0.724 . . . . 0.0 112.092 169.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -76.41 -32.58 58.59 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 114.561 1.319 . . . . 0.0 114.561 178.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.414 ' HG3' ' HB2' ' A' ' 48' ' ' HIS . 0.0 OUTLIER -146.2 -18.14 0.44 Allowed 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 117.238 2.31 . . . . 0.0 117.238 -175.413 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 91.33 174.66 43.47 Favored Glycine 0 CA--C 1.536 1.364 0 CA-C-N 118.868 0.758 . . . . 0.0 113.386 -167.179 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -79.6 -35.07 40.13 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 115.592 1.701 . . . . 0.0 115.592 -157.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -60.89 -34.38 74.56 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.086 0.954 . . . . 0.0 113.423 174.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.414 ' HB2' ' HG3' ' A' ' 44' ' ' LYS . 99.4 m-70 -81.92 9.16 8.7 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.574 1.15 . . . . 0.0 112.514 -178.439 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 9.8 m -140.03 12.56 2.43 Favored 'General case' 0 N--CA 1.441 -0.906 0 C-N-CA 125.805 1.642 . . . . 0.0 113.949 -162.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -63.96 -30.11 76.78 Favored Glycine 0 C--O 1.213 -1.182 0 O-C-N 120.126 -1.609 . . . . 0.0 114.973 179.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 40.6 p-80 -57.14 -28.17 62.51 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 121.537 2.668 . . . . 0.0 113.523 167.44 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.83 -36.38 56.9 Favored 'General case' 0 CA--C 1.522 -0.13 0 C-N-CA 123.721 0.808 . . . . 0.0 110.757 171.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.532 HG22 ' HD3' ' A' ' 57' ' ' LYS . 27.9 mt -72.04 -39.68 66.31 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 CA-C-O 119.321 -0.371 . . . . 0.0 110.64 179.335 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.15 -49.12 63.06 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 125.464 1.506 . . . . 0.0 111.594 -177.029 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -58.23 -45.23 88.08 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.912 0.885 . . . . 0.0 112.563 172.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 11.9 t60 -60.49 -45.66 92.93 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 122.184 0.992 . . . . 0.0 112.644 174.142 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.532 ' HD3' HG22 ' A' ' 53' ' ' ILE . 17.0 mtpp -55.34 -48.53 74.07 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.851 1.261 . . . . 0.0 111.283 174.027 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 60.3 mm-40 -60.15 -41.58 93.08 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 120.934 1.697 . . . . 0.0 111.244 177.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 41.8 t -55.88 -52.88 62.54 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.353 0.661 . . . . 0.0 111.582 178.173 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 71.4 mtm -60.32 -45.25 94.05 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.503 0.721 . . . . 0.0 111.116 172.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 25.2 mtm180 -54.67 -32.81 59.88 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 119.821 -1.799 . . . . 0.0 114.051 -178.101 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -44.63 -36.06 2.9 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.12 0.968 . . . . 0.0 113.445 169.434 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.8 mp -79.33 6.62 9.55 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 123.919 0.888 . . . . 0.0 112.644 -173.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 82.93 23.98 54.02 Favored Glycine 0 CA--C 1.534 1.241 0 C-N-CA 125.994 1.759 . . . . 0.0 112.399 -172.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -87.05 154.09 21.03 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.047 1.739 . . . . 0.0 113.052 -156.749 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.5 mmpt? -92.91 72.72 4.8 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.366 1.866 . . . . 0.0 110.543 -172.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 12.5 mm . . . . . 0 C--O 1.252 1.214 0 N-CA-C 114.966 1.469 . . . . 0.0 114.966 -151.781 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.148 0 N-CA-C 106.284 -2.727 . . . . 0.0 106.284 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 30.4 m -76.92 -71.8 0.38 Allowed 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 106.127 -1.805 . . . . 0.0 106.127 136.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 33.8 p90 -44.15 129.05 6.16 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.055 1.342 . . . . 0.0 112.156 158.31 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 25.1 m -152.03 140.71 20.83 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.999 1.32 . . . . 0.0 108.511 -175.138 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.61 57.92 4.54 Favored Pre-proline 0 CA--C 1.549 0.921 0 N-CA-C 113.843 1.053 . . . . 0.0 113.843 -163.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -78.23 -4.62 14.45 Favored 'Trans proline' 0 CA--C 1.545 1.052 0 C-N-CA 122.498 2.132 . . . . 0.0 114.088 177.044 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -122.32 83.63 0.36 Allowed Glycine 0 N--CA 1.469 0.85 0 C-N-CA 125.537 1.542 . . . . 0.0 111.309 -174.147 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -118.2 139.71 50.88 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 124.842 1.257 . . . . 0.0 112.962 -170.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 93.5 t 57.09 88.4 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 C-N-CA 126.83 2.052 . . . . 0.0 111.862 169.477 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -147.53 160.58 42.46 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 126.085 1.754 . . . . 0.0 110.716 -172.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 33.4 m -158.27 55.86 0.46 Allowed 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.847 1.659 . . . . 0.0 108.669 176.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -123.35 85.84 52.01 Favored Pre-proline 0 CA--C 1.548 0.866 0 C-N-CA 125.438 1.495 . . . . 0.0 107.117 -163.788 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_endo -87.53 177.55 3.68 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 124.281 3.32 . . . . 0.0 112.614 -167.384 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -98.69 157.03 34.95 Favored Pre-proline 0 CA--C 1.545 0.776 0 C-N-CA 124.858 1.263 . . . . 0.0 110.838 167.244 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -68.72 162.22 42.1 Favored 'Trans proline' 0 CA--C 1.545 1.048 0 C-N-CA 122.876 2.384 . . . . 0.0 112.323 169.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -72.5 179.37 5.19 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 123.291 2.66 . . . . 0.0 112.228 166.258 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -104.96 161.18 14.42 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.97 0.908 . . . . 0.0 111.369 174.254 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.4 m -66.54 154.23 40.91 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 116.642 2.09 . . . . 0.0 116.642 -161.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -69.87 62.66 0.19 Allowed 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 125.579 1.552 . . . . 0.0 112.007 153.322 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -130.76 161.54 31.49 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 120.829 -1.169 . . . . 0.0 111.212 175.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 22.5 tptt -81.76 41.41 0.65 Allowed 'General case' 0 CA--C 1.545 0.761 0 O-C-N 120.683 -1.261 . . . . 0.0 112.917 -178.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 36.4 mtpt -111.46 164.94 13.79 Favored Pre-proline 0 N--CA 1.478 0.958 0 C-N-CA 125.736 1.615 . . . . 0.0 112.988 -164.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -85.38 156.46 10.84 Favored 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 122.407 2.071 . . . . 0.0 112.413 -176.802 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.531 HD13 ' H ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -64.38 156.35 29.54 Favored 'General case' 0 CA--C 1.556 1.18 0 CA-C-N 114.108 -1.405 . . . . 0.0 110.828 164.454 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.531 ' H ' HD13 ' A' ' 24' ' ' LEU . 23.5 pttm -121.4 130.15 24.93 Favored Pre-proline 0 CA--C 1.539 0.551 0 C-N-CA 128.785 2.834 . . . . 0.0 108.011 173.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -60.82 -27.83 85.43 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 124.264 3.31 . . . . 0.0 114.636 -156.435 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 31.8 p -66.47 -20.76 66.13 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 126.126 1.77 . . . . 0.0 113.501 176.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 57.9 m -114.52 1.93 14.45 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.401 1.481 . . . . 0.0 114.422 -179.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.457 ' HB2' ' CE2' ' A' ' 65' ' ' PHE . . . -64.25 150.59 45.64 Favored 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 121.83 -0.544 . . . . 0.0 110.952 -178.168 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.2 m 44.52 61.53 11.19 Favored Pre-proline 0 CA--C 1.549 0.91 0 N-CA-C 112.535 0.568 . . . . 0.0 112.535 -175.377 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -67.36 -9.29 24.76 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 123.722 2.948 . . . . 0.0 112.944 -162.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 40.6 mm-40 -90.66 -48.69 6.91 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 126.589 1.956 . . . . 0.0 111.888 -178.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 9.1 p -65.79 -28.22 68.85 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 119.761 1.164 . . . . 0.0 111.862 163.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 24.3 tttt -57.94 -57.76 11.38 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.934 0.893 . . . . 0.0 110.476 169.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.0 mtmp? -58.73 -37.63 76.6 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.132 0.973 . . . . 0.0 112.718 176.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.86 -39.3 87.5 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 174.19 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 4.3 ttp180 -60.2 -53.05 62.37 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.388 1.075 . . . . 0.0 109.564 171.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -62.05 -37.91 86.74 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.46 1.504 . . . . 0.0 112.352 -177.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.29 -37.98 84.28 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 120.839 -1.163 . . . . 0.0 112.882 171.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.2 t -57.68 -36.14 71.53 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 122.298 1.047 . . . . 0.0 111.848 173.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 92.0 mt -70.82 -35.21 59.21 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 O-C-N 120.828 -1.17 . . . . 0.0 110.565 177.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 97.2 mt -64.59 -36.99 78.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 123.633 0.773 . . . . 0.0 112.189 169.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 67.2 mt-10 -65.37 -47.03 77.82 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 119.777 1.172 . . . . 0.0 113.276 177.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -151.99 -8.35 0.21 Allowed 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 -165.417 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 87.88 159.81 34.89 Favored Glycine 0 CA--C 1.524 0.619 0 CA-C-O 122.47 1.039 . . . . 0.0 111.799 -172.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.484 ' HG2' HD11 ' A' ' 53' ' ' ILE . 39.5 tt0 -66.97 -28.53 68.34 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 -165.508 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -61.45 -25.55 67.3 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 113.828 1.048 . . . . 0.0 113.828 173.041 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 80.7 m-70 -96.71 18.06 15.17 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 120.646 1.567 . . . . 0.0 110.571 -177.116 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 5.9 m -146.99 14.27 1.15 Allowed 'General case' 0 N--CA 1.442 -0.863 0 N-CA-C 115.819 1.785 . . . . 0.0 115.819 -156.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . 0.846 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -69.93 -27.44 73.09 Favored Glycine 0 N--CA 1.474 1.194 0 CA-C-N 122.12 2.236 . . . . 0.0 116.809 -174.012 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 43.4 p-80 -54.54 -26.18 30.35 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 120.811 2.305 . . . . 0.0 113.833 163.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.17 -35.52 36.38 Favored 'General case' 0 CA--C 1.518 -0.262 0 C-N-CA 123.476 0.711 . . . . 0.0 110.968 173.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.846 HD12 ' HA2' ' A' ' 50' ' ' GLY . 15.5 mt -71.69 -38.23 65.72 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 CA-C-O 119.42 -0.324 . . . . 0.0 110.697 177.341 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.412 ' HG3' ' HE3' ' A' ' 57' ' ' LYS . 1.1 mp0 -73.53 -52.35 13.85 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 125.985 1.714 . . . . 0.0 114.619 -178.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -56.29 -35.68 67.76 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 122.005 0.907 . . . . 0.0 112.042 174.117 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 9.5 t60 -68.71 -48.41 63.91 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 113.589 0.959 . . . . 0.0 113.589 173.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.412 ' HE3' ' HG3' ' A' ' 54' ' ' GLU . 2.3 mtmt -46.99 -53.07 13.21 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.543 1.137 . . . . 0.0 111.395 172.008 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -65.15 -39.79 93.48 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.154 0.981 . . . . 0.0 112.101 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 18.8 t -54.21 -50.92 66.01 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 123.592 0.757 . . . . 0.0 112.149 172.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 71.0 mtm -60.15 -46.83 88.33 Favored 'General case' 0 N--CA 1.48 1.032 0 O-C-N 120.819 -1.176 . . . . 0.0 111.528 169.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 1.5 mtt180 -61.56 -25.82 67.56 Favored 'General case' 0 CA--C 1.53 0.197 0 O-C-N 119.943 -1.723 . . . . 0.0 113.641 -175.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -46.88 -33.0 4.16 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 124.724 1.21 . . . . 0.0 113.362 167.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.9 mp -81.74 9.65 7.54 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-O 121.64 0.733 . . . . 0.0 112.598 -174.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 71.2 25.89 74.69 Favored Glycine 0 CA--C 1.532 1.143 0 C-N-CA 125.947 1.737 . . . . 0.0 112.179 -169.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.457 ' CE2' ' HB2' ' A' ' 29' ' ' ALA . 0.1 OUTLIER -74.47 147.12 42.21 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 126.034 1.733 . . . . 0.0 112.22 -162.388 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.35 77.94 3.11 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.991 1.316 . . . . 0.0 110.619 -175.794 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.107 0 C-N-CA 128.527 2.731 . . . . 0.0 108.042 179.07 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.329 0 N-CA-C 107.908 -2.077 . . . . 0.0 107.908 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.3 m -56.39 157.24 5.16 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 118.503 1.151 . . . . 0.0 111.917 165.154 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -155.11 171.37 19.89 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.929 1.291 . . . . 0.0 110.219 173.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.446 HG22 ' H ' ' A' ' 5' ' ' MET . 6.6 m 66.48 171.6 0.24 Allowed 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 125.647 1.579 . . . . 0.0 112.052 -175.556 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.446 ' H ' HG22 ' A' ' 4' ' ' THR . 22.3 ptm -132.9 58.37 35.08 Favored Pre-proline 0 CA--C 1.547 0.845 0 C-N-CA 125.032 1.333 . . . . 0.0 112.181 -178.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -77.33 -5.47 15.68 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 123.427 2.751 . . . . 0.0 114.471 -177.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -77.56 42.6 2.0 Favored Glycine 0 N--CA 1.474 1.226 0 C-N-CA 124.854 1.216 . . . . 0.0 114.368 -176.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 8.3 mp -123.89 136.18 54.18 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 126.312 1.845 . . . . 0.0 109.385 -172.332 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 18.9 t 40.78 77.06 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 126.062 1.745 . . . . 0.0 114.763 158.136 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -51.51 150.62 3.58 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.941 1.696 . . . . 0.0 114.683 175.207 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.8 p -50.39 53.41 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 130.981 3.712 . . . . 0.0 115.126 157.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -128.55 73.27 80.69 Favored Pre-proline 0 CA--C 1.539 0.543 0 O-C-N 120.448 -1.407 . . . . 0.0 110.53 -159.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_endo -76.65 -160.37 0.11 Allowed 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 125.008 3.805 . . . . 0.0 112.607 -173.514 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -137.95 159.74 67.31 Favored Pre-proline 0 CA--C 1.547 0.834 0 C-N-CA 126.83 2.052 . . . . 0.0 109.687 165.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -68.52 164.74 31.7 Favored 'Trans proline' 0 CA--C 1.545 1.04 0 C-N-CA 122.27 1.98 . . . . 0.0 111.739 167.089 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -68.27 -176.91 1.21 Allowed 'Trans proline' 0 CA--C 1.537 0.637 0 C-N-CA 122.688 2.259 . . . . 0.0 111.487 160.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -58.13 146.25 33.98 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 122.665 1.221 . . . . 0.0 113.25 165.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 18.4 m 179.34 165.95 1.02 Allowed 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 128.778 2.831 . . . . 0.0 108.715 -178.091 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -154.09 143.18 21.23 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.167 -0.958 . . . . 0.0 112.108 178.048 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -138.22 149.39 45.74 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 124.641 1.176 . . . . 0.0 110.281 158.019 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -78.58 28.97 0.2 Allowed 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.654 1.582 . . . . 0.0 113.107 -179.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 29.5 mttt -70.39 168.41 19.42 Favored Pre-proline 0 N--CA 1.472 0.643 0 C-N-CA 127.967 2.507 . . . . 0.0 114.281 -172.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -82.38 162.9 17.21 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.806 2.338 . . . . 0.0 111.285 163.093 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.58 ' CD1' ' H ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -77.25 163.69 26.27 Favored 'General case' 0 CA--C 1.552 1.047 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.835 167.347 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.58 ' H ' ' CD1' ' A' ' 24' ' ' LEU . 12.5 ptmm? -139.53 128.77 13.87 Favored Pre-proline 0 CA--C 1.536 0.429 0 C-N-CA 130.293 3.437 . . . . 0.0 105.846 178.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -57.93 -40.09 80.97 Favored 'Trans proline' 0 CA--C 1.538 0.704 0 C-N-CA 123.864 3.043 . . . . 0.0 114.288 -152.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 28.7 p -60.62 -25.92 66.62 Favored 'General case' 0 CA--C 1.557 1.249 0 C-N-CA 125.754 1.621 . . . . 0.0 113.91 178.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 90.2 m -95.82 -7.44 36.98 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 126.0 1.72 . . . . 0.0 114.079 179.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.403 ' HB2' ' CE2' ' A' ' 65' ' ' PHE . . . -66.19 147.74 52.87 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 121.467 -0.771 . . . . 0.0 110.436 -175.288 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 33.5 m 42.66 59.78 10.47 Favored Pre-proline 0 CA--C 1.549 0.937 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -171.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -63.9 -29.9 67.49 Favored 'Trans proline' 0 CA--C 1.537 0.669 0 C-N-CA 122.843 2.362 . . . . 0.0 111.745 -170.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.487 ' HG3' ' H ' ' A' ' 33' ' ' THR . 0.3 OUTLIER -39.81 -69.76 0.12 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 127.064 2.146 . . . . 0.0 114.842 161.413 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.487 ' H ' ' HG3' ' A' ' 32' ' ' GLU . 0.0 OUTLIER -74.43 -23.74 58.97 Favored 'General case' 0 C--O 1.224 -0.252 0 C-N-CA 124.939 1.296 . . . . 0.0 111.464 -178.842 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 4.7 tmtt? -58.31 -49.62 76.52 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 119.797 1.18 . . . . 0.0 111.207 167.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.1 tmtp? -62.52 -43.66 98.27 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.454 0.702 . . . . 0.0 111.309 177.355 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.44 -42.23 95.66 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 113.182 0.808 . . . . 0.0 113.182 174.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 8.1 ttp85 -59.8 -52.79 63.97 Favored 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 125.639 1.576 . . . . 0.0 110.326 174.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 61.8 m-20 -65.06 -32.14 73.71 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.63 0.772 . . . . 0.0 112.862 179.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -65.85 -36.37 83.27 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 120.781 -1.199 . . . . 0.0 113.015 170.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 11.3 t -59.62 -44.04 93.59 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 121.921 0.867 . . . . 0.0 111.121 168.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 58.4 mt -68.91 -32.5 54.87 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 C-N-CA 124.263 1.025 . . . . 0.0 110.966 -178.604 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 35.4 mt -60.82 -39.71 82.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 124.1 0.96 . . . . 0.0 112.328 167.514 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -70.26 -44.5 68.32 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 177.061 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.44 ' HG3' ' HB2' ' A' ' 48' ' ' HIS . 0.0 OUTLIER -140.37 -10.41 1.09 Allowed 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 117.133 2.271 . . . . 0.0 117.133 -165.477 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.25 175.96 49.35 Favored Glycine 0 CA--C 1.533 1.202 0 CA-C-N 119.203 0.911 . . . . 0.0 113.252 -165.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -83.81 -30.44 26.55 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 115.065 1.505 . . . . 0.0 115.065 -156.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -62.86 -32.61 73.88 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.079 0.952 . . . . 0.0 113.567 174.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.44 ' HB2' ' HG3' ' A' ' 44' ' ' LYS . 95.1 m-70 -85.16 12.22 8.32 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.792 1.237 . . . . 0.0 112.595 -178.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 9.7 m -138.41 13.51 2.78 Favored 'General case' 0 N--CA 1.445 -0.701 0 C-N-CA 125.592 1.557 . . . . 0.0 114.354 -163.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . 0.406 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -62.77 -33.37 86.67 Favored Glycine 0 C--O 1.216 -1.029 0 CA-C-O 117.844 -1.531 . . . . 0.0 115.728 -176.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 41.1 p-80 -55.95 -29.97 60.98 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 121.095 2.447 . . . . 0.0 113.415 168.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.35 -33.45 42.96 Favored 'General case' 0 CA--C 1.519 -0.219 0 C-N-CA 124.428 1.091 . . . . 0.0 110.76 173.505 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.406 HD12 ' HA2' ' A' ' 50' ' ' GLY . 37.1 mt -72.51 -37.74 57.88 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.564 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 177.354 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -72.37 -53.07 13.37 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.818 1.647 . . . . 0.0 114.239 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.08 -31.95 53.36 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 118.951 0.796 . . . . 0.0 112.834 174.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 10.5 t60 -74.12 -51.13 16.59 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.719 1.608 . . . . 0.0 113.986 170.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -48.52 -54.44 14.36 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 125.346 1.459 . . . . 0.0 110.378 176.17 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -61.22 -39.03 88.77 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.526 0.73 . . . . 0.0 112.204 -177.329 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 34.5 t -53.64 -48.43 69.37 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 124.231 1.013 . . . . 0.0 113.122 169.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 23.8 mtp -62.87 -53.06 59.99 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 125.468 1.507 . . . . 0.0 110.389 172.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.409 ' HG3' ' HB ' ' A' ' 67' ' ' ILE . 22.1 mtp85 -52.52 -33.91 47.35 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 127.977 2.511 . . . . 0.0 115.21 -176.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -42.88 -35.07 1.08 Allowed 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.841 1.257 . . . . 0.0 114.025 167.45 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.2 mp -81.14 5.48 16.65 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.383 1.073 . . . . 0.0 112.784 -173.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.73 15.58 70.25 Favored Glycine 0 CA--C 1.536 1.352 0 C-N-CA 125.94 1.733 . . . . 0.0 112.797 -169.718 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.403 ' CE2' ' HB2' ' A' ' 29' ' ' ALA . 0.1 OUTLIER -75.09 142.92 43.61 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.946 2.098 . . . . 0.0 112.353 -168.591 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.1 mppt? -92.9 82.73 4.68 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.138 1.375 . . . . 0.0 108.909 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.409 ' HB ' ' HG3' ' A' ' 61' ' ' ARG . 4.3 mm . . . . . 0 C--O 1.254 1.328 0 C-N-CA 131.11 3.764 . . . . 0.0 107.801 -165.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.407 0 N-CA-C 109.476 -1.45 . . . . 0.0 109.476 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 24.2 p -155.78 -42.34 0.08 Allowed 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.146 0.979 . . . . 0.0 112.148 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 -130.54 171.91 12.5 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 125.828 1.651 . . . . 0.0 109.875 179.367 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 8.5 m -153.55 -45.71 0.09 Allowed 'General case' 0 N--CA 1.483 1.22 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 174.584 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.441 ' HG3' HD23 ' A' ' 8' ' ' LEU . 25.0 tpp 33.08 68.58 0.96 Allowed Pre-proline 0 N--CA 1.483 1.213 0 C-N-CA 125.531 1.532 . . . . 0.0 114.684 -172.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -80.39 42.43 1.32 Allowed 'Trans proline' 0 CA--C 1.548 1.22 0 C-N-CA 122.273 1.982 . . . . 0.0 112.296 176.381 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -130.78 -64.91 0.1 OUTLIER Glycine 0 N--CA 1.472 1.085 0 C-N-CA 124.261 0.934 . . . . 0.0 112.319 176.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.441 HD23 ' HG3' ' A' ' 5' ' ' MET . 7.3 mt 57.19 -144.85 0.63 Allowed 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.338 1.055 . . . . 0.0 112.338 173.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 25.6 t 70.82 -14.41 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 127.79 2.436 . . . . 0.0 116.689 165.46 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 26.95 46.26 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.955 1 C-N-CA 131.778 4.031 . . . . 0.0 116.67 158.417 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 4.7 t -161.33 -152.23 0.25 Allowed 'General case' 0 CA--C 1.543 0.675 0 O-C-N 120.596 -1.315 . . . . 0.0 112.314 -169.177 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 63.85 64.3 1.33 Allowed Pre-proline 0 CA--C 1.548 0.879 0 C-N-CA 127.08 2.152 . . . . 0.0 112.027 -171.731 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_endo -73.38 -179.75 4.73 Favored 'Trans proline' 0 CA--C 1.543 0.943 0 C-N-CA 123.851 3.034 . . . . 0.0 111.684 176.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -145.38 162.09 38.54 Favored Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 125.659 1.583 . . . . 0.0 111.35 -176.207 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -68.93 154.69 70.45 Favored 'Trans proline' 0 CA--C 1.547 1.146 0 C-N-CA 122.807 2.338 . . . . 0.0 112.418 169.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -81.82 -179.37 4.77 Favored 'Trans proline' 0 CA--C 1.542 0.916 0 C-N-CA 124.113 3.209 . . . . 0.0 113.703 175.279 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -74.78 -172.07 1.47 Allowed 'General case' 0 CA--C 1.557 1.236 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.514 155.356 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.2 m -51.51 159.83 0.68 Allowed 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 115.381 1.622 . . . . 0.0 115.381 176.179 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -126.73 -3.33 6.58 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 115.343 -0.844 . . . . 0.0 113.121 166.64 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -60.21 -179.02 0.09 Allowed 'General case' 0 CA--C 1.54 0.592 0 O-C-N 120.646 -1.284 . . . . 0.0 112.155 162.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -74.44 52.5 0.49 Allowed 'General case' 0 CA--C 1.542 0.654 0 O-C-N 120.21 -1.556 . . . . 0.0 113.706 171.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 10.8 mptt -65.43 166.25 14.85 Favored Pre-proline 0 CA--C 1.545 0.781 0 C-N-CA 125.522 1.529 . . . . 0.0 111.17 160.407 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -79.94 -174.93 2.46 Favored 'Trans proline' 0 N--CA 1.459 -0.511 0 C-N-CA 123.051 2.5 . . . . 0.0 111.299 160.12 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.418 HD23 ' H ' ' A' ' 25' ' ' LYS . 0.8 OUTLIER -127.33 156.74 41.5 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.567 170.149 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.418 ' H ' HD23 ' A' ' 24' ' ' LEU . 26.2 mtmm -93.49 143.04 25.99 Favored Pre-proline 0 CA--C 1.535 0.393 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 177.655 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_endo -71.88 -9.99 25.58 Favored 'Trans proline' 0 CA--C 1.535 0.571 0 C-N-CA 123.492 2.795 . . . . 0.0 113.165 -175.36 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . 0.251 22.2 p -101.03 -40.7 7.1 Favored 'General case' 0 N--CA 1.44 -0.956 0 C-N-CA 127.722 2.409 . . . . 0.0 111.063 179.735 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.425 ' HA ' ' HE3' ' A' ' 34' ' ' LYS . 64.4 m -97.7 -10.88 24.18 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 115.979 1.844 . . . . 0.0 115.979 -173.547 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.88 149.47 14.9 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 119.716 1.144 . . . . 0.0 110.047 162.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 83.6 m 52.4 54.27 13.51 Favored Pre-proline 0 CA--C 1.552 1.034 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -178.134 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -73.59 -5.47 17.14 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 123.169 2.579 . . . . 0.0 112.694 -162.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -101.37 -40.51 7.07 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 125.058 1.343 . . . . 0.0 112.521 -177.187 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.3 p -60.8 -34.62 74.78 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-O 117.765 -1.112 . . . . 0.0 110.278 157.664 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.425 ' HE3' ' HA ' ' A' ' 28' ' ' CYS . 2.0 ttmt -58.21 -54.86 42.26 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 119.598 1.09 . . . . 0.0 112.244 169.111 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.76 -49.22 58.64 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.819 0.847 . . . . 0.0 112.135 176.621 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.19 -37.05 84.66 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 114.674 -1.148 . . . . 0.0 113.268 176.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.408 ' CG ' HG13 ' A' ' 53' ' ' ILE . 3.4 ttp180 -58.1 -56.03 27.36 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.142 1.377 . . . . 0.0 109.126 173.632 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -65.41 -37.15 86.09 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.423 1.489 . . . . 0.0 111.265 -173.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.25 -43.4 98.11 Favored 'General case' 0 CA--C 1.545 0.788 0 O-C-N 120.983 -1.073 . . . . 0.0 113.255 170.381 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -58.74 -34.21 71.13 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.177 -0.952 . . . . 0.0 111.232 172.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 81.8 mt -75.55 -35.53 32.26 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 O-C-N 120.911 -1.118 . . . . 0.0 111.642 177.22 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 70.2 mt -62.29 -34.18 62.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 124.309 1.044 . . . . 0.0 111.587 169.325 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.426 ' HB3' ' HD2' ' A' ' 44' ' ' LYS . 45.9 mt-10 -70.87 -41.57 71.22 Favored 'General case' 0 CA--C 1.555 1.159 0 N-CA-C 114.183 1.179 . . . . 0.0 114.183 177.02 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.426 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -150.58 -11.59 0.24 Allowed 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 117.586 2.439 . . . . 0.0 117.586 -170.633 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 86.13 159.96 33.29 Favored Glycine 0 CA--C 1.534 1.266 0 CA-C-N 119.224 0.92 . . . . 0.0 112.525 -161.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -73.2 -33.97 65.7 Favored 'General case' 0 C--N 1.337 0.065 0 O-C-N 120.741 -1.446 . . . . 0.0 113.623 -166.397 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -53.82 -36.83 62.93 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.782 0.833 . . . . 0.0 112.534 176.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 79.8 m-70 -87.55 12.45 12.41 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.6 1.56 . . . . 0.0 112.937 178.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -146.38 5.08 0.93 Allowed 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.863 1.665 . . . . 0.0 113.831 -170.312 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . 0.403 ' HA2' ' CD1' ' A' ' 53' ' ' ILE . . . -60.73 -14.55 37.15 Favored Glycine 0 N--CA 1.474 1.178 0 N-CA-C 118.69 2.236 . . . . 0.0 118.69 -160.216 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 30.2 p-80 -55.3 -36.27 66.01 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 121.08 2.44 . . . . 0.0 112.87 164.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.41 -42.24 96.18 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 125.157 1.383 . . . . 0.0 110.75 172.402 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.408 HG13 ' CG ' ' A' ' 37' ' ' ARG . 4.2 mp -72.9 -37.98 55.57 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.344 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.177 -178.427 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.475 ' HA ' ' HE3' ' A' ' 57' ' ' LYS . 3.5 mm-40 -64.85 -52.65 55.51 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 123.511 0.725 . . . . 0.0 112.557 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.76 -39.97 86.63 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.628 0.771 . . . . 0.0 112.61 177.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 16.1 t60 -65.81 -48.13 72.77 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 123.438 0.695 . . . . 0.0 112.576 174.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.475 ' HE3' ' HA ' ' A' ' 54' ' ' GLU . 1.6 mtmp? -52.56 -46.47 66.84 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-O 118.968 -0.539 . . . . 0.0 111.669 171.467 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -65.15 -37.6 87.91 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 123.895 0.878 . . . . 0.0 112.793 177.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 49.7 t -56.97 -52.82 63.7 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 118.795 0.725 . . . . 0.0 111.912 169.367 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 77.6 mtm -56.94 -48.93 77.15 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.32 1.048 . . . . 0.0 111.714 173.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.531 ' HE ' ' C ' ' A' ' 67' ' ' ILE . 11.5 mtt-85 -56.49 -30.3 62.81 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.26 1.824 . . . . 0.0 114.374 -176.474 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -46.26 -31.61 2.61 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.166 0.986 . . . . 0.0 113.284 167.518 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.2 mp -84.47 4.75 30.29 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 123.802 0.841 . . . . 0.0 112.364 -173.347 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.58 19.35 71.3 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 124.507 1.051 . . . . 0.0 112.547 -168.399 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -74.94 141.74 44.03 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 126.607 1.963 . . . . 0.0 110.601 178.197 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.5 mppt? -100.15 76.8 1.93 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 125.077 1.351 . . . . 0.0 109.593 -171.371 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.531 ' C ' ' HE ' ' A' ' 61' ' ' ARG . 0.2 OUTLIER . . . . . 0 C--O 1.248 0.99 0 CA-C-O 116.913 -1.518 . . . . 0.0 111.076 -171.28 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.385 0 N-CA-C 108.614 -1.794 . . . . 0.0 108.614 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.6 m -141.24 138.71 33.45 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.308 1.043 . . . . 0.0 108.746 -173.208 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 45.8 m-85 -142.26 35.74 1.52 Allowed 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.235 0.614 . . . . 0.0 111.748 -159.415 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -139.05 143.28 38.3 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.353 1.061 . . . . 0.0 110.339 -165.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 12.3 tpt -128.12 70.24 78.33 Favored Pre-proline 0 CA--C 1.543 0.674 0 C-N-CA 124.537 1.135 . . . . 0.0 110.482 179.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -68.36 2.65 2.64 Favored 'Trans proline' 0 CA--C 1.543 0.948 0 C-N-CA 123.963 3.109 . . . . 0.0 115.904 -172.315 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -160.04 137.83 5.25 Favored Glycine 0 CA--C 1.53 0.997 0 C-N-CA 124.604 1.097 . . . . 0.0 110.531 170.26 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -168.02 171.87 9.31 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.924 1.689 . . . . 0.0 110.854 -173.212 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 10.7 p -149.29 155.9 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 C-N-CA 125.489 1.516 . . . . 0.0 109.527 177.449 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -62.5 137.88 58.35 Favored 'General case' 0 CA--C 1.548 0.87 0 O-C-N 121.567 -0.708 . . . . 0.0 111.415 172.302 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 58.7 m -82.35 136.57 34.97 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 121.563 -0.711 . . . . 0.0 112.025 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -138.4 71.65 45.37 Favored Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 124.594 1.158 . . . . 0.0 111.092 -174.396 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -73.88 128.65 12.6 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 123.177 2.585 . . . . 0.0 110.731 -176.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -148.8 161.57 32.45 Favored Pre-proline 0 CA--C 1.545 0.776 0 C-N-CA 126.314 1.846 . . . . 0.0 111.348 -177.312 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -72.11 151.44 55.47 Favored 'Trans proline' 0 CA--C 1.546 1.115 0 C-N-CA 122.515 2.144 . . . . 0.0 112.263 168.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -76.65 178.97 6.92 Favored 'Trans proline' 0 CA--C 1.537 0.666 0 C-N-CA 123.438 2.759 . . . . 0.0 112.183 164.692 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -91.01 -46.15 8.31 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.657 1.583 . . . . 0.0 112.351 170.146 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 58.3 m -169.94 -23.72 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 128.099 2.56 . . . . 0.0 114.62 -177.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 35.83 51.36 0.71 Allowed 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 128.256 2.622 . . . . 0.0 113.42 -175.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 5.0 tm-20 -90.88 -171.17 2.92 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.065 1.346 . . . . 0.0 112.466 -166.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 8.7 mtmp? -71.98 51.54 0.22 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 126.927 2.091 . . . . 0.0 113.3 -179.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 7.7 mtpp -100.99 152.83 37.95 Favored Pre-proline 0 N--CA 1.476 0.848 0 C-N-CA 124.5 1.12 . . . . 0.0 112.547 -164.269 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -74.88 176.86 9.31 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.337 2.025 . . . . 0.0 111.402 165.211 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.502 HD22 ' HB2' ' A' ' 29' ' ' ALA . 1.6 mt -135.51 165.49 25.39 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-O 122.294 1.045 . . . . 0.0 113.604 174.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.1 mtpt -122.79 136.59 26.91 Favored Pre-proline 0 N--CA 1.464 0.233 0 C-N-CA 127.541 2.337 . . . . 0.0 106.24 174.041 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -64.48 -42.3 17.23 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 C-N-CA 121.619 1.546 . . . . 0.0 111.016 -172.153 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 29.4 p -58.9 -36.31 74.46 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 126.268 1.827 . . . . 0.0 113.257 176.05 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 93.3 m -90.68 -10.45 43.11 Favored 'General case' 0 CA--C 1.554 1.097 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 177.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.502 ' HB2' HD22 ' A' ' 24' ' ' LEU . . . -80.76 -31.85 35.75 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 114.582 1.327 . . . . 0.0 114.582 -175.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 3.4 m -124.23 61.79 27.81 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 127.892 2.477 . . . . 0.0 110.441 168.362 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_endo -71.3 -18.17 30.34 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 122.634 2.223 . . . . 0.0 112.355 -170.268 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 36.9 mm-40 -81.57 -40.41 23.09 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.132 1.373 . . . . 0.0 112.554 -176.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.0 p -70.02 -30.45 67.75 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 120.879 -1.138 . . . . 0.0 111.741 161.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 10.1 tmtt? -58.85 -44.78 91.08 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 120.551 1.523 . . . . 0.0 112.201 170.486 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.1 mttt -52.95 -51.66 60.66 Favored 'General case' 0 C--O 1.223 -0.3 0 C-N-CA 127.52 2.328 . . . . 0.0 111.243 172.021 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.32 -37.77 80.91 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 178.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 6.5 ttp85 -57.95 -51.9 67.73 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.705 1.202 . . . . 0.0 109.566 174.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -73.25 -30.14 63.25 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.11 0.964 . . . . 0.0 113.14 -178.189 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.26 -39.27 92.35 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 120.644 -1.285 . . . . 0.0 111.946 167.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.8 t -60.35 -32.88 71.68 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 122.45 1.119 . . . . 0.0 112.322 172.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 70.4 mt -75.84 -33.83 26.55 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 124.528 1.131 . . . . 0.0 111.807 176.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 88.5 mt -66.34 -34.53 70.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 124.564 1.146 . . . . 0.0 111.724 168.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -71.18 -38.86 72.12 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 174.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.9 mppt? -140.87 -59.17 0.51 Allowed 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.384 1.473 . . . . 0.0 113.944 -177.027 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 137.54 160.73 8.66 Favored Glycine 0 CA--C 1.533 1.181 0 C-N-CA 126.144 1.83 . . . . 0.0 109.659 -158.019 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -73.8 -29.51 62.21 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 119.219 1.51 . . . . 0.0 112.529 -168.77 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 22.9 pt-20 -58.36 -34.02 70.21 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 123.274 0.63 . . . . 0.0 112.204 179.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 98.5 m-70 -82.71 5.4 21.43 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.136 1.374 . . . . 0.0 113.148 177.764 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 4.3 m -145.52 20.28 1.51 Allowed 'General case' 0 N--CA 1.442 -0.869 0 C-N-CA 125.541 1.536 . . . . 0.0 112.258 -154.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . 0.581 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -70.3 -17.0 73.81 Favored Glycine 0 C--O 1.219 -0.784 0 O-C-N 120.131 -1.606 . . . . 0.0 115.306 177.211 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 41.5 p-80 -61.17 -30.44 70.41 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 120.213 2.007 . . . . 0.0 112.35 161.196 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -80.29 -35.21 36.16 Favored 'General case' 0 C--O 1.232 0.177 0 C-N-CA 124.225 1.01 . . . . 0.0 111.073 174.637 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.655 HG22 ' HD3' ' A' ' 57' ' ' LYS . 10.4 mt -66.38 -42.47 90.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 CA-C-O 118.105 -0.95 . . . . 0.0 109.79 173.118 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.57 -53.96 49.41 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 118.526 0.603 . . . . 0.0 111.655 178.618 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.94 -39.27 68.7 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 120.952 -1.092 . . . . 0.0 113.271 179.459 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 13.5 t60 -69.49 -41.98 75.38 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 124.987 1.315 . . . . 0.0 114.253 173.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.655 ' HD3' HG22 ' A' ' 53' ' ' ILE . 39.5 mtpt -56.29 -52.7 63.55 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.49 1.116 . . . . 0.0 111.795 175.255 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -61.9 -39.62 92.61 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 123.093 0.557 . . . . 0.0 111.718 177.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 49.4 t -48.92 -59.74 3.34 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-O 118.709 -0.662 . . . . 0.0 111.503 170.28 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 74.2 mtm -56.43 -50.81 70.58 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.173 0.989 . . . . 0.0 111.763 174.663 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 74.3 mtt180 -54.04 -33.03 56.23 Favored 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 120.232 -1.542 . . . . 0.0 113.941 -174.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.528 ' HB3' HD12 ' A' ' 63' ' ' LEU . . . -44.19 -42.8 6.71 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.864 1.266 . . . . 0.0 113.837 166.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.528 HD12 ' HB3' ' A' ' 62' ' ' ALA . 1.4 mp -79.25 9.12 4.9 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.432 1.493 . . . . 0.0 111.777 -173.295 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 82.38 16.7 70.7 Favored Glycine 0 CA--C 1.532 1.135 0 C-N-CA 124.42 1.009 . . . . 0.0 113.636 -173.328 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -65.39 164.61 13.4 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 119.091 1.445 . . . . 0.0 112.385 -178.059 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.02 97.87 5.44 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 120.449 -1.407 . . . . 0.0 109.64 -177.838 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.15 0 C-N-CA 129.742 3.217 . . . . 0.0 107.735 -169.014 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.313 0 N-CA-C 105.557 -3.017 . . . . 0.0 105.557 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.6 m -50.15 157.72 0.63 Allowed 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 117.266 0.533 . . . . 0.0 110.751 140.38 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 37.4 p90 -159.66 -178.0 6.78 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.277 1.831 . . . . 0.0 109.331 179.285 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.2 m -135.94 148.53 48.56 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.679 0.791 . . . . 0.0 109.022 172.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 20.3 ptm -141.03 58.82 9.76 Favored Pre-proline 0 CA--C 1.546 0.799 0 C-N-CA 123.98 0.912 . . . . 0.0 113.146 -174.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -71.39 7.42 1.49 Allowed 'Trans proline' 0 CA--C 1.547 1.14 0 C-N-CA 123.914 3.076 . . . . 0.0 115.898 -170.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -82.83 41.19 2.84 Favored Glycine 0 CA--C 1.535 1.297 0 CA-C-N 119.876 1.216 . . . . 0.0 114.551 -175.078 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 5.9 mp -116.04 156.32 26.55 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 125.579 1.552 . . . . 0.0 112.7 -169.232 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 9.2 p -158.81 167.86 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 C-N-CA 127.1 2.16 . . . . 0.0 108.817 176.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -136.98 151.96 49.59 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.724 1.21 . . . . 0.0 109.598 165.18 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.9 t 54.39 -168.97 0.07 Allowed 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.854 1.661 . . . . 0.0 114.513 177.267 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -151.44 71.25 8.31 Favored Pre-proline 0 CA--C 1.544 0.741 0 C-N-CA 125.012 1.325 . . . . 0.0 109.914 169.228 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -70.24 102.67 1.13 Allowed 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 123.645 2.896 . . . . 0.0 111.766 -179.734 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -153.39 159.92 31.56 Favored Pre-proline 0 CA--C 1.544 0.716 0 C-N-CA 125.567 1.547 . . . . 0.0 112.053 -176.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -72.39 163.64 38.0 Favored 'Trans proline' 0 CA--C 1.546 1.084 0 C-N-CA 122.639 2.226 . . . . 0.0 111.168 161.41 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -76.01 176.84 9.51 Favored 'Trans proline' 0 CA--C 1.536 0.597 0 C-N-CA 122.699 2.266 . . . . 0.0 112.263 165.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -136.74 164.98 26.99 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.597 1.959 . . . . 0.0 111.545 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 93.9 p -53.43 151.21 5.79 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.313 1.845 . . . . 0.0 113.112 168.026 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.26 146.16 48.3 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 123.776 0.831 . . . . 0.0 110.526 173.361 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.05 -164.54 0.14 Allowed 'General case' 0 CA--C 1.543 0.677 0 CA-C-O 122.0 0.905 . . . . 0.0 111.029 168.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.21 45.79 1.09 Allowed 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.798 2.039 . . . . 0.0 109.208 178.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 26.1 mttp -145.84 167.84 13.24 Favored Pre-proline 0 N--CA 1.469 0.521 0 C-N-CA 126.364 1.865 . . . . 0.0 113.636 -165.29 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -63.15 109.53 0.98 Allowed 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 122.074 1.849 . . . . 0.0 107.716 158.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.814 HD12 ' H ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER 55.67 -162.56 0.16 Allowed 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 124.558 1.143 . . . . 0.0 112.591 -171.896 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.814 ' H ' HD12 ' A' ' 24' ' ' LEU . 5.4 ptmt -135.69 149.46 69.09 Favored Pre-proline 0 CA--C 1.543 0.683 1 C-N-CA 132.129 4.172 . . . . 0.0 106.038 169.122 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -71.15 -13.89 31.4 Favored 'Trans proline' 0 CA--C 1.535 0.558 0 C-N-CA 123.887 3.058 . . . . 0.0 115.168 -166.499 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.54 ' SG ' ' HE2' ' A' ' 25' ' ' LYS . 20.6 p -97.12 -33.92 11.33 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 126.74 2.016 . . . . 0.0 111.863 -174.313 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 99.0 m -87.43 -15.9 36.39 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.001 1.321 . . . . 0.0 114.051 177.249 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.36 142.85 30.65 Favored 'General case' 0 CA--C 1.533 0.291 0 O-C-N 121.738 -0.601 . . . . 0.0 111.902 -177.536 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 9.1 m 46.88 60.68 14.63 Favored Pre-proline 0 CA--C 1.548 0.886 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -173.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -66.63 -19.62 53.87 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.792 2.328 . . . . 0.0 111.555 -165.231 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.6 mm-40 -75.12 -49.3 20.04 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 125.951 1.701 . . . . 0.0 112.369 -179.143 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.7 p -69.09 -26.21 64.81 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 118.334 -0.841 . . . . 0.0 112.034 166.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 10.3 tmtt? -61.51 -50.96 70.61 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 119.969 1.259 . . . . 0.0 111.405 170.433 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 25.6 ttpt -54.22 -48.2 71.31 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 127.666 2.386 . . . . 0.0 111.485 172.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.74 -41.49 98.03 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 176.275 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 4.1 ttp180 -58.85 -55.59 33.11 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.736 1.214 . . . . 0.0 109.385 174.344 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -61.19 -37.32 82.51 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.169 1.388 . . . . 0.0 112.858 -179.081 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.65 -35.77 79.5 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 121.081 -1.012 . . . . 0.0 112.89 172.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.9 t -59.16 -41.59 88.74 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.339 -0.85 . . . . 0.0 111.298 170.488 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 78.5 mt -70.27 -31.36 46.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 C-N-CA 124.899 1.28 . . . . 0.0 111.267 -178.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 60.7 mt -60.56 -44.34 96.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 CA-C-N 118.765 0.712 . . . . 0.0 111.185 165.653 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -71.3 -35.18 71.18 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 115.218 1.562 . . . . 0.0 115.218 -174.563 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.4 -10.49 0.48 Allowed 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 117.061 2.245 . . . . 0.0 117.061 -177.7 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 84.63 172.25 48.9 Favored Glycine 0 CA--C 1.531 1.087 0 CA-C-N 119.367 0.985 . . . . 0.0 112.052 -165.612 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.46 ' CG ' HD11 ' A' ' 53' ' ' ILE . 45.3 tt0 -81.75 -35.54 29.54 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 114.981 1.475 . . . . 0.0 114.981 -159.198 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -55.05 -37.25 66.47 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 174.587 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -80.36 5.84 13.77 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.2 1.4 . . . . 0.0 113.008 -179.244 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 2.3 m -137.17 18.0 2.98 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 125.846 1.658 . . . . 0.0 113.589 -164.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . 0.826 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -75.99 -14.9 81.78 Favored Glycine 0 N--CA 1.467 0.742 0 O-C-N 119.706 -1.871 . . . . 0.0 117.52 -174.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 40.3 p-80 -59.3 -31.31 69.02 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.844 1.822 . . . . 0.0 112.321 157.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.19 -37.76 52.94 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 123.449 0.7 . . . . 0.0 109.923 177.162 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.826 HD12 ' HA2' ' A' ' 50' ' ' GLY . 14.7 mt -67.44 -40.73 85.12 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.358 0 CA-C-O 119.301 -0.381 . . . . 0.0 109.974 177.259 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -65.36 -54.33 30.38 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.209 1.004 . . . . 0.0 113.409 178.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -57.03 -35.6 69.47 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 119.008 0.822 . . . . 0.0 112.315 179.008 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 7.6 t60 -69.97 -47.36 62.6 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 173.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -50.32 -52.07 39.89 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 125.193 1.397 . . . . 0.0 112.051 177.331 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -66.4 -36.86 83.9 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.117 0.567 . . . . 0.0 111.964 -177.468 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 17.5 t -52.9 -56.02 18.96 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.522 0.729 . . . . 0.0 112.866 168.559 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 7.7 mtt -53.06 -52.2 59.32 Favored 'General case' 0 N--CA 1.487 1.387 0 CA-C-N 119.888 1.222 . . . . 0.0 110.983 170.438 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 30.3 mtt180 -55.42 -31.44 61.88 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 125.774 1.63 . . . . 0.0 114.69 -174.053 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -45.84 -36.29 5.13 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.338 1.055 . . . . 0.0 113.053 169.418 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.1 mp -80.5 4.26 18.88 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.559 1.143 . . . . 0.0 112.248 -172.311 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 94.62 4.39 62.14 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 125.546 1.546 . . . . 0.0 113.446 -171.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.462 ' C ' ' HE3' ' A' ' 66' ' ' LYS . 1.3 m-85 -70.64 150.41 46.04 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 126.353 1.861 . . . . 0.0 113.45 -171.833 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.462 ' HE3' ' C ' ' A' ' 65' ' ' PHE . 0.0 OUTLIER -114.32 76.67 1.0 Allowed 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.661 1.584 . . . . 0.0 108.893 -163.402 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.026 0 C-N-CA 127.395 2.278 . . . . 0.0 109.504 -173.356 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.447 0 N-CA-C 109.144 -1.582 . . . . 0.0 109.144 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 71.7 p -160.92 176.79 11.04 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.812 1.245 . . . . 0.0 110.701 -173.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 45.2 m-85 -51.94 142.85 14.76 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 153.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 4.3 m -150.89 150.38 30.81 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.807 1.243 . . . . 0.0 108.852 -177.044 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.7 tpt -132.03 73.19 78.47 Favored Pre-proline 0 N--CA 1.471 0.595 0 C-N-CA 124.367 1.067 . . . . 0.0 110.827 178.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -72.27 36.46 0.33 Allowed 'Trans proline' 0 CA--C 1.547 1.175 0 C-N-CA 124.243 3.295 . . . . 0.0 113.428 177.376 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -135.32 -87.79 0.26 Allowed Glycine 0 CA--C 1.53 0.973 0 O-C-N 121.584 -0.698 . . . . 0.0 114.054 176.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.7 mm? 51.41 -149.24 0.33 Allowed 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 117.365 0.582 . . . . 0.0 111.381 -157.259 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 75.1 t 65.54 41.67 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 CA-C-O 124.522 2.106 . . . . 0.0 110.74 167.515 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -38.5 131.84 1.2 Allowed 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 129.47 3.108 . . . . 0.0 115.082 -179.049 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.3 t -59.15 76.3 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 128.202 2.601 . . . . 0.0 114.407 -171.585 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -148.31 70.37 10.78 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 124.942 1.297 . . . . 0.0 110.575 -168.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_endo -78.99 -174.25 2.21 Favored 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 124.349 3.366 . . . . 0.0 110.909 170.306 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -137.32 156.52 75.2 Favored Pre-proline 0 CA--C 1.542 0.656 0 C-N-CA 124.547 1.139 . . . . 0.0 111.432 172.393 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -70.79 152.83 64.27 Favored 'Trans proline' 0 CA--C 1.543 0.944 0 C-N-CA 122.337 2.025 . . . . 0.0 110.978 165.477 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_endo -74.25 174.6 12.22 Favored 'Trans proline' 0 CA--C 1.536 0.584 0 C-N-CA 122.482 2.121 . . . . 0.0 111.884 169.49 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.04 142.54 36.44 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 161.606 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 16.6 p -54.18 135.03 44.45 Favored 'General case' 0 C--O 1.238 0.49 0 O-C-N 121.626 -0.671 . . . . 0.0 112.068 167.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -67.03 128.0 34.7 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 121.188 0.518 . . . . 0.0 111.02 174.488 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -158.25 176.12 12.87 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.069 1.348 . . . . 0.0 109.683 167.329 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.43 96.31 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 124.694 1.198 . . . . 0.0 112.387 160.344 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 2.0 tttt -161.05 163.18 21.09 Favored Pre-proline 0 N--CA 1.476 0.866 0 C-N-CA 125.477 1.511 . . . . 0.0 112.75 -177.127 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -84.48 179.05 4.67 Favored 'Trans proline' 0 N--CA 1.457 -0.632 0 C-N-CA 123.587 2.858 . . . . 0.0 110.699 149.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.583 HD23 ' H ' ' A' ' 25' ' ' LYS . 0.4 OUTLIER -100.14 160.39 14.36 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 114.86 -1.064 . . . . 0.0 110.595 172.384 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.583 ' H ' HD23 ' A' ' 24' ' ' LEU . 6.0 mtpt -89.01 141.19 29.31 Favored Pre-proline 0 N--CA 1.47 0.567 0 CA-C-O 117.539 -1.219 . . . . 0.0 108.03 178.393 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -79.32 -13.92 13.43 Favored 'Trans proline' 0 CA--C 1.548 1.187 0 C-N-CA 121.557 1.505 . . . . 0.0 111.684 -178.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.48 ' HA ' ' HE3' ' A' ' 34' ' ' LYS . 17.2 p -82.01 -20.83 37.61 Favored 'General case' 0 CA--C 1.557 1.237 0 C-N-CA 125.843 1.657 . . . . 0.0 111.734 175.156 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 90.8 m -119.06 -25.27 6.25 Favored 'General case' 0 CA--C 1.558 1.255 0 N-CA-C 115.457 1.651 . . . . 0.0 115.457 -178.241 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.58 154.98 30.95 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 120.981 -1.074 . . . . 0.0 110.6 177.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 42.6 m 44.54 50.21 6.77 Favored Pre-proline 0 CA--C 1.554 1.109 0 N-CA-C 113.264 0.838 . . . . 0.0 113.264 -175.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -64.93 -29.54 57.85 Favored 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 123.583 2.855 . . . . 0.0 112.432 -162.359 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -41.34 -69.4 0.14 Allowed 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 127.206 2.202 . . . . 0.0 115.275 158.202 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.5 p -69.11 -26.84 65.11 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 121.24 -0.913 . . . . 0.0 111.992 177.106 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.48 ' HE3' ' HA ' ' A' ' 27' ' ' CYS . 6.2 tmtt? -61.54 -51.01 70.38 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 119.54 1.064 . . . . 0.0 111.61 174.665 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 12.9 ttpt -62.26 -43.86 97.86 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.862 0.865 . . . . 0.0 111.385 176.522 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.34 -39.57 91.03 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 176.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 11.7 ttp85 -60.84 -54.24 47.51 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.733 1.213 . . . . 0.0 110.009 175.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 58.0 m-20 -71.73 -26.7 62.57 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 115.229 -0.896 . . . . 0.0 112.685 -175.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.22 -40.13 90.1 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 120.368 -1.458 . . . . 0.0 112.606 167.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 2.3 t -59.01 -33.83 71.17 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 122.695 1.236 . . . . 0.0 111.819 170.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 70.9 mt -76.53 -34.12 23.79 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 C-N-CA 124.619 1.168 . . . . 0.0 111.855 177.349 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 66.3 mt -64.63 -34.13 67.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 124.474 1.11 . . . . 0.0 111.734 167.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -70.79 -37.26 73.3 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 113.966 1.099 . . . . 0.0 113.966 174.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.2 mppt? -142.64 -60.65 0.44 Allowed 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 125.488 1.515 . . . . 0.0 113.488 -174.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 136.37 160.3 8.71 Favored Glycine 0 CA--C 1.531 1.072 0 C-N-CA 126.045 1.783 . . . . 0.0 109.374 -158.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.483 ' HB3' HD11 ' A' ' 53' ' ' ILE . 0.4 OUTLIER -73.05 -29.53 63.04 Favored 'General case' 0 N--CA 1.466 0.325 0 O-C-N 120.786 -1.42 . . . . 0.0 112.934 -167.581 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.6 pt-20 -56.1 -31.45 63.27 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 123.2 0.6 . . . . 0.0 112.583 178.104 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -85.94 3.31 42.56 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.045 1.338 . . . . 0.0 113.188 177.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 4.6 m -147.08 17.84 1.22 Allowed 'General case' 0 N--CA 1.441 -0.903 0 C-N-CA 125.423 1.489 . . . . 0.0 112.881 -154.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . 0.691 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -63.63 -30.95 79.15 Favored Glycine 0 C--O 1.215 -1.05 0 O-C-N 120.217 -1.552 . . . . 0.0 114.58 179.742 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 39.3 p-80 -53.36 -25.59 15.88 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 121.292 2.546 . . . . 0.0 113.944 168.38 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.85 -35.85 32.25 Favored 'General case' 0 C--N 1.341 0.196 0 C-N-CA 123.7 0.8 . . . . 0.0 111.138 172.266 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.691 HD12 ' HA2' ' A' ' 50' ' ' GLY . 34.4 mt -72.35 -37.43 58.15 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.444 0 CA-C-O 118.757 -0.64 . . . . 0.0 110.012 178.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.556 ' HG3' ' HE3' ' A' ' 57' ' ' LYS . 1.4 mp0 -67.17 -52.84 36.41 Favored 'General case' 0 N--CA 1.436 -1.157 0 C-N-CA 124.835 1.254 . . . . 0.0 112.818 176.665 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.41 -37.83 57.6 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 119.161 0.891 . . . . 0.0 112.95 174.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -72.52 -41.53 65.79 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 114.324 1.231 . . . . 0.0 114.324 173.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.556 ' HE3' ' HG3' ' A' ' 54' ' ' GLU . 23.7 mtmt -55.04 -52.62 62.61 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.942 1.297 . . . . 0.0 111.161 175.706 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -64.88 -38.44 90.97 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.408 0.683 . . . . 0.0 111.65 178.786 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 36.2 t -52.07 -60.69 2.9 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 118.284 -0.865 . . . . 0.0 111.741 169.458 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 79.3 mtm -49.64 -50.16 44.22 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 124.832 1.253 . . . . 0.0 111.474 172.437 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 22.3 mtt180 -53.11 -35.8 60.04 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 120.353 1.433 . . . . 0.0 114.133 -177.333 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.415 ' HB3' HD12 ' A' ' 63' ' ' LEU . . . -48.95 -37.03 18.86 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 119.272 0.942 . . . . 0.0 113.331 170.019 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.415 HD12 ' HB3' ' A' ' 62' ' ' ALA . 4.9 mp -82.87 8.74 11.62 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 125.154 1.381 . . . . 0.0 112.051 -172.825 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.53 22.55 43.19 Favored Glycine 0 CA--C 1.535 1.311 0 C-N-CA 124.931 1.253 . . . . 0.0 114.025 -179.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.501 ' C ' ' HE3' ' A' ' 66' ' ' LYS . 0.8 OUTLIER -84.49 153.67 23.19 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.494 1.518 . . . . 0.0 114.75 -163.265 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.501 ' HE3' ' C ' ' A' ' 65' ' ' PHE . 0.1 OUTLIER -94.97 81.34 3.71 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 126.441 1.897 . . . . 0.0 107.906 -174.32 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 29.4 mm . . . . . 0 C--O 1.245 0.862 0 C-N-CA 128.85 2.86 . . . . 0.0 108.896 -165.011 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.472 0 N-CA-C 109.441 -1.464 . . . . 0.0 109.441 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.5 p -135.67 8.16 3.3 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.143 1.377 . . . . 0.0 113.076 -176.539 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 53.7 p90 -157.43 177.9 10.91 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 127.589 2.356 . . . . 0.0 108.674 -178.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.9 m -127.26 148.5 50.22 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.603 1.161 . . . . 0.0 109.268 178.561 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 7.6 tpt -131.32 79.35 70.27 Favored Pre-proline 0 CA--C 1.539 0.552 0 C-N-CA 123.915 0.886 . . . . 0.0 110.15 175.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -73.61 -0.26 9.09 Favored 'Trans proline' 0 CA--C 1.543 0.962 0 C-N-CA 123.414 2.743 . . . . 0.0 114.574 177.333 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -79.65 44.82 2.79 Favored Glycine 0 CA--C 1.534 1.256 0 CA-C-N 119.661 1.118 . . . . 0.0 114.554 -174.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 6.3 mp -118.41 133.15 56.11 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 126.06 1.744 . . . . 0.0 110.593 -172.657 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.4 p -160.36 163.1 1.1 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 125.972 1.709 . . . . 0.0 109.152 178.119 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -138.46 158.41 44.32 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.47 1.108 . . . . 0.0 109.87 165.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 75.0 m -156.16 12.77 0.3 Allowed 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.534 1.933 . . . . 0.0 111.942 169.02 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -136.35 62.05 41.83 Favored Pre-proline 0 CA--C 1.55 0.979 0 CA-C-N 119.458 1.026 . . . . 0.0 112.612 -173.207 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -71.17 -176.91 2.06 Favored 'Trans proline' 0 CA--C 1.542 0.916 0 C-N-CA 123.725 2.95 . . . . 0.0 111.113 169.785 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -136.05 156.28 77.11 Favored Pre-proline 0 CA--C 1.542 0.636 0 C-N-CA 124.537 1.135 . . . . 0.0 111.682 -179.12 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -64.03 131.06 29.29 Favored 'Trans proline' 0 CA--C 1.545 1.03 0 C-N-CA 122.233 1.955 . . . . 0.0 111.175 172.285 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -77.72 -178.09 4.34 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.345 2.697 . . . . 0.0 112.305 172.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -123.99 165.12 17.99 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.805 1.242 . . . . 0.0 110.56 167.676 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 5.0 m -159.63 -1.17 0.08 Allowed 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 114.183 1.179 . . . . 0.0 114.183 175.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -152.92 98.24 2.3 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 114.257 1.206 . . . . 0.0 114.257 -174.347 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . 0.256 0.0 OUTLIER -140.36 -169.54 2.79 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.37 1.468 . . . . 0.0 109.007 151.599 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.82 -3.4 8.68 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 117.096 2.258 . . . . 0.0 117.096 -167.278 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 23.2 mtpp -89.92 167.27 17.59 Favored Pre-proline 0 N--CA 1.474 0.728 0 C-N-CA 126.861 2.065 . . . . 0.0 112.155 175.588 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -91.48 160.93 3.61 Favored 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 123.866 3.044 . . . . 0.0 112.052 170.545 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.583 ' CD1' ' H ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -71.99 165.54 24.02 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.32 166.744 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.583 ' H ' ' CD1' ' A' ' 24' ' ' LEU . 12.4 ptmm? -137.78 137.26 21.22 Favored Pre-proline 0 CA--C 1.536 0.42 0 C-N-CA 128.637 2.775 . . . . 0.0 107.209 -178.898 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -64.28 -20.08 66.38 Favored 'Trans proline' 0 CA--C 1.535 0.569 0 C-N-CA 124.646 3.564 . . . . 0.0 115.944 -154.55 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 26.9 p -84.36 -23.46 30.15 Favored 'General case' 0 CA--C 1.558 1.279 0 C-N-CA 125.265 1.426 . . . . 0.0 113.372 175.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 69.7 m -94.69 -13.06 26.15 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 115.307 1.595 . . . . 0.0 115.307 -174.123 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.55 156.58 32.19 Favored 'General case' 0 CA--C 1.545 0.767 0 O-C-N 121.625 -0.672 . . . . 0.0 111.506 -170.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 13.7 m 45.9 63.49 9.45 Favored Pre-proline 0 CA--C 1.55 0.965 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 177.082 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -68.7 -17.64 42.51 Favored 'Trans proline' 0 CA--C 1.536 0.577 0 C-N-CA 123.13 2.554 . . . . 0.0 113.176 -161.395 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -88.17 -41.09 13.22 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.93 1.292 . . . . 0.0 112.493 -174.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.7 p -64.01 -33.22 75.26 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 120.89 -1.131 . . . . 0.0 110.833 158.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 5.1 tmtt? -59.04 -47.89 83.59 Favored 'General case' 0 N--CA 1.478 0.962 0 CA-C-N 120.727 1.603 . . . . 0.0 111.691 173.284 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 26.9 mttt -54.29 -49.97 68.4 Favored 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 126.022 1.729 . . . . 0.0 111.772 173.27 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.83 -35.05 76.5 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.452 0.701 . . . . 0.0 112.756 179.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 3.1 ttp180 -57.96 -55.5 34.15 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 124.728 1.211 . . . . 0.0 109.914 172.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -62.46 -39.45 93.42 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.444 1.098 . . . . 0.0 111.98 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.1 -41.8 97.33 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 113.207 0.818 . . . . 0.0 113.207 172.031 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.9 t -59.38 -36.16 75.26 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 122.496 1.141 . . . . 0.0 111.584 174.088 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 68.6 mt -73.09 -29.53 28.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 O-C-N 120.657 -1.277 . . . . 0.0 111.279 177.793 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 96.8 mt -69.29 -36.36 72.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.435 1.094 . . . . 0.0 112.005 168.251 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -67.49 -42.1 83.46 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 124.507 1.123 . . . . 0.0 113.716 178.29 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.85 -17.42 0.31 Allowed 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 116.923 2.194 . . . . 0.0 116.923 -171.504 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 95.74 164.65 34.26 Favored Glycine 0 CA--C 1.535 1.318 0 C-N-CA 123.933 0.778 . . . . 0.0 112.815 -167.685 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -69.23 -39.67 78.41 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 -165.287 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -55.73 -34.44 65.16 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.513 1.525 . . . . 0.0 113.769 175.729 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 78.0 m-70 -91.13 15.11 12.37 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.823 1.249 . . . . 0.0 112.306 -176.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 1.2 m -143.2 1.22 1.22 Allowed 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 115.73 1.752 . . . . 0.0 115.73 -166.034 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -51.46 -27.35 17.29 Favored Glycine 0 N--CA 1.473 1.11 0 CA-C-O 115.979 -2.567 . . . . 0.0 118.068 -163.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 34.3 p-80 -51.77 -35.12 42.52 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 121.798 2.799 . . . . 0.0 113.255 170.143 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.59 -40.48 76.65 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 125.722 1.609 . . . . 0.0 112.056 171.283 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.473 HG22 ' HD3' ' A' ' 57' ' ' LYS . 3.3 mp -70.74 -36.32 64.37 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 C-N-CA 120.488 -0.485 . . . . 0.0 110.497 178.914 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -73.53 -51.19 17.87 Favored 'General case' 0 N--CA 1.444 -0.759 0 C-N-CA 126.741 2.016 . . . . 0.0 112.32 -174.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -56.89 -37.93 72.08 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 121.453 0.644 . . . . 0.0 112.294 172.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 20.9 t60 -69.02 -49.87 53.81 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 113.113 0.782 . . . . 0.0 113.113 175.244 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.473 ' HD3' HG22 ' A' ' 53' ' ' ILE . 13.7 mtpp -46.43 -49.94 17.46 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 125.736 1.614 . . . . 0.0 111.378 170.745 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 60.4 mm-40 -58.29 -48.32 80.83 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 119.433 1.015 . . . . 0.0 112.357 174.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 24.5 t -55.33 -47.84 75.07 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 123.558 0.743 . . . . 0.0 112.682 178.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 12.4 mtp -62.54 -49.68 74.37 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.535 1.134 . . . . 0.0 110.532 169.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 18.1 mtp180 -56.3 -30.6 62.73 Favored 'General case' 0 C--N 1.34 0.164 0 O-C-N 119.601 -1.937 . . . . 0.0 114.139 -175.64 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -42.31 -35.43 0.99 Allowed 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.319 1.447 . . . . 0.0 113.9 168.354 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.0 mp -79.52 3.69 17.97 Favored 'General case' 0 CA--C 1.548 0.894 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 -171.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 90.95 20.82 38.12 Favored Glycine 0 CA--C 1.536 1.346 0 C-N-CA 125.598 1.57 . . . . 0.0 112.381 -168.208 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.442 ' C ' ' HE3' ' A' ' 66' ' ' LYS . 0.0 OUTLIER -94.85 158.93 15.27 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 126.482 1.913 . . . . 0.0 112.815 -161.368 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.442 ' HE3' ' C ' ' A' ' 65' ' ' PHE . 0.1 OUTLIER -116.0 106.52 13.87 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 125.925 1.69 . . . . 0.0 107.477 -174.41 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.407 HG22 ' HG2' ' A' ' 57' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--O 1.246 0.889 0 C-N-CA 125.198 1.399 . . . . 0.0 111.046 -170.126 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.554 0 CA-C-O 117.931 -1.483 . . . . 0.0 109.448 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 12.9 p -139.97 -0.56 1.67 Allowed 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 114.781 1.4 . . . . 0.0 114.781 -171.131 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -72.31 110.86 7.03 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 118.853 0.751 . . . . 0.0 111.313 177.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.6 m -63.35 141.82 58.62 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.209 0.603 . . . . 0.0 110.472 168.68 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 24.5 ttt -126.59 63.15 52.26 Favored Pre-proline 0 N--CA 1.471 0.623 0 C-N-CA 123.914 0.886 . . . . 0.0 111.648 -178.445 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -76.63 -9.98 18.56 Favored 'Trans proline' 0 CA--C 1.537 0.655 0 C-N-CA 122.417 2.078 . . . . 0.0 115.96 -167.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 134.65 78.74 0.11 Allowed Glycine 0 N--CA 1.471 0.979 0 CA-C-N 118.953 0.797 . . . . 0.0 111.93 -170.607 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -152.68 151.99 31.22 Favored 'General case' 0 CA--C 1.518 -0.25 0 C-N-CA 124.437 1.095 . . . . 0.0 111.911 -170.068 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 70.8 t 64.81 102.91 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.493 0 C-N-CA 126.384 1.874 . . . . 0.0 112.27 175.357 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -68.89 50.01 0.08 Allowed 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 127.686 2.394 . . . . 0.0 113.061 177.035 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.4 t 52.03 20.57 1.29 Allowed 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 126.233 1.813 . . . . 0.0 114.497 -167.264 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 48.7 t-20 -132.8 84.08 50.91 Favored Pre-proline 0 CA--C 1.544 0.73 0 C-N-CA 125.339 1.456 . . . . 0.0 109.555 -163.466 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_endo -85.45 -167.01 0.37 Allowed 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 125.162 3.908 . . . . 0.0 112.665 -172.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -123.92 161.61 45.82 Favored Pre-proline 0 CA--C 1.544 0.728 0 C-N-CA 125.814 1.646 . . . . 0.0 109.901 168.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -67.46 154.23 74.36 Favored 'Trans proline' 0 CA--C 1.545 1.067 0 C-N-CA 121.996 1.797 . . . . 0.0 111.134 167.018 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -77.72 176.12 10.41 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 123.566 2.844 . . . . 0.0 113.094 176.18 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -67.76 138.36 56.16 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.462 1.905 . . . . 0.0 114.587 -168.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 57.9 p -167.16 152.06 7.25 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.46 1.104 . . . . 0.0 110.734 151.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -150.33 17.13 0.83 Allowed 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 115.091 1.515 . . . . 0.0 115.091 -162.634 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.8 -176.7 0.2 Allowed 'General case' 0 CA--C 1.545 0.759 0 O-C-N 119.51 -1.994 . . . . 0.0 112.182 165.312 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 2.8 tptp -70.91 55.56 0.18 Allowed 'General case' 0 CA--C 1.549 0.915 0 O-C-N 120.519 -1.363 . . . . 0.0 113.337 175.289 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -49.6 155.92 1.28 Allowed Pre-proline 0 CA--C 1.55 0.963 0 C-N-CA 128.05 2.54 . . . . 0.0 114.005 178.001 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -90.72 -174.78 0.75 Allowed 'Trans proline' 0 CA--C 1.535 0.565 0 C-N-CA 125.069 3.846 . . . . 0.0 110.627 159.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.7 ' CD1' ' H ' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -131.16 165.34 23.53 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 122.151 0.977 . . . . 0.0 110.634 165.647 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.7 ' H ' ' CD1' ' A' ' 24' ' ' LEU . 0.1 OUTLIER -152.77 122.33 3.34 Favored Pre-proline 0 C--N 1.327 -0.37 0 C-N-CA 129.923 3.289 . . . . 0.0 104.224 -163.949 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -64.71 -29.08 59.96 Favored 'Trans proline' 0 CA--C 1.534 0.49 0 C-N-CA 123.719 2.946 . . . . 0.0 114.325 -148.279 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 29.0 p -67.17 -18.36 65.24 Favored 'General case' 0 CA--C 1.555 1.141 0 C-N-CA 124.586 1.154 . . . . 0.0 113.342 177.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 56.2 m -111.96 -4.0 14.66 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 115.216 1.562 . . . . 0.0 115.216 -175.25 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.48 ' HB3' ' SD ' ' A' ' 60' ' ' MET . . . -64.43 158.41 23.87 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 120.0 1.273 . . . . 0.0 110.933 -179.376 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 33.5 m 36.33 62.25 2.94 Favored Pre-proline 0 CA--C 1.546 0.816 0 C-N-CA 124.717 1.207 . . . . 0.0 114.11 -179.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -69.16 -18.67 39.71 Favored 'Trans proline' 0 N--CA 1.459 -0.526 0 C-N-CA 122.38 2.054 . . . . 0.0 111.499 -161.462 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -76.46 -47.7 22.12 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.821 1.248 . . . . 0.0 111.726 -179.515 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.7 p -65.82 -31.62 72.69 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 117.841 -1.076 . . . . 0.0 111.612 165.704 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.2 tmtp? -58.76 -50.83 72.49 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 120.509 1.504 . . . . 0.0 112.112 171.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 23.6 ttpt -54.72 -47.42 73.77 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 126.898 2.079 . . . . 0.0 112.12 175.025 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.77 -39.02 90.6 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 114.398 -1.274 . . . . 0.0 113.591 174.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 14.4 ttp85 -60.73 -53.29 59.21 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.625 1.57 . . . . 0.0 110.124 177.293 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -74.76 -30.65 61.55 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 115.364 -0.834 . . . . 0.0 111.836 -175.64 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.89 -39.38 81.25 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 120.531 -1.356 . . . . 0.0 112.698 165.413 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.9 t -59.41 -37.89 79.19 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.744 0.818 . . . . 0.0 111.825 175.083 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 72.3 mt -71.35 -35.52 57.77 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 C-N-CA 124.946 1.298 . . . . 0.0 111.145 176.517 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 86.0 mt -67.04 -31.54 53.84 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 C-N-CA 124.451 1.1 . . . . 0.0 112.127 171.09 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -78.84 -35.62 43.72 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.285 1.434 . . . . 0.0 114.486 178.107 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.2 mppt? -134.62 -59.8 0.8 Allowed 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 125.078 1.351 . . . . 0.0 112.788 176.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 139.08 173.94 13.26 Favored Glycine 0 CA--C 1.531 1.091 0 C-N-CA 126.09 1.805 . . . . 0.0 110.281 -160.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -78.94 -32.54 45.53 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 114.601 1.334 . . . . 0.0 114.601 -162.582 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -58.73 -34.7 71.65 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.834 1.254 . . . . 0.0 113.742 173.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -81.08 6.9 12.26 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.183 0.993 . . . . 0.0 112.942 -176.652 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 21.7 m -145.57 13.25 1.36 Allowed 'General case' 0 N--CA 1.437 -1.093 0 C-N-CA 124.053 0.941 . . . . 0.0 113.413 -154.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . 0.455 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -67.88 -29.48 73.68 Favored Glycine 0 N--CA 1.469 0.864 0 O-C-N 119.791 -1.818 . . . . 0.0 115.605 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 29.6 p-80 -56.82 -30.58 63.88 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 120.208 2.004 . . . . 0.0 112.582 165.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.06 -34.96 59.6 Favored 'General case' 0 CA--C 1.522 -0.119 0 C-N-CA 124.054 0.942 . . . . 0.0 109.698 174.661 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.455 HD12 ' HA2' ' A' ' 50' ' ' GLY . 44.4 mt -72.99 -27.44 24.63 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 N-CA-C 110.554 -0.165 . . . . 0.0 110.554 177.567 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 67.3 mt-10 -89.1 -47.16 8.29 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 -169.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.42 -37.89 57.75 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-O 121.737 0.78 . . . . 0.0 112.124 165.208 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 14.1 t60 -68.43 -46.36 70.09 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 173.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 19.8 mtmt -51.75 -52.74 46.46 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.906 1.283 . . . . 0.0 110.918 177.047 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -61.47 -41.59 97.48 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.023 0.529 . . . . 0.0 112.333 178.71 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 23.7 t -54.59 -50.39 68.13 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 123.438 0.695 . . . . 0.0 112.83 173.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.48 ' SD ' ' HB3' ' A' ' 29' ' ' ALA . 0.4 OUTLIER -58.03 -53.4 58.69 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 125.535 1.534 . . . . 0.0 110.34 170.259 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 74.6 mtt180 -55.32 -31.42 61.66 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 126.579 1.952 . . . . 0.0 114.39 -175.046 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -45.78 -34.74 3.86 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.791 1.237 . . . . 0.0 113.497 169.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.9 mp -81.22 3.8 22.54 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.733 1.213 . . . . 0.0 112.244 -173.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.94 11.81 67.14 Favored Glycine 0 CA--C 1.535 1.305 0 C-N-CA 125.22 1.39 . . . . 0.0 113.286 -169.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.405 ' C ' ' HE3' ' A' ' 66' ' ' LYS . 0.9 OUTLIER -70.16 151.51 45.33 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 126.317 1.847 . . . . 0.0 113.506 -176.659 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.405 ' HE3' ' C ' ' A' ' 65' ' ' PHE . 0.0 OUTLIER -111.39 93.66 4.58 Favored 'General case' 0 C--N 1.341 0.198 0 C-N-CA 126.366 1.866 . . . . 0.0 109.502 -170.488 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.247 0.923 0 C-N-CA 127.471 2.308 . . . . 0.0 109.602 -173.266 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.175 0 N-CA-C 106.38 -2.688 . . . . 0.0 106.38 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.5 p 178.76 22.19 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.887 0 O-C-N 124.235 0.609 . . . . 0.0 112.183 -146.554 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -160.72 155.27 23.61 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.787 2.035 . . . . 0.0 108.487 -174.391 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -154.05 151.82 29.78 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.843 1.257 . . . . 0.0 109.158 178.683 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 9.2 tpt -133.96 60.18 43.54 Favored Pre-proline 0 N--CA 1.474 0.748 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 176.093 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -76.73 49.01 2.59 Favored 'Trans proline' 0 CA--C 1.547 1.148 0 C-N-CA 123.758 2.972 . . . . 0.0 110.85 170.064 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -126.72 34.4 3.16 Favored Glycine 0 CA--C 1.53 0.97 0 C-N-CA 125.458 1.504 . . . . 0.0 114.093 -167.186 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -151.7 171.5 17.58 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.978 1.311 . . . . 0.0 112.051 -179.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 14.8 p -146.96 138.72 18.69 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 124.576 1.151 . . . . 0.0 109.667 177.176 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 2.8 t0 54.32 -170.75 0.06 Allowed 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 124.5 1.12 . . . . 0.0 112.262 -159.419 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 54.3 p -121.22 -27.75 4.82 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.216 -0.928 . . . . 0.0 111.671 148.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -175.11 117.58 0.31 Allowed Pre-proline 0 CA--C 1.543 0.688 0 C-N-CA 125.655 1.582 . . . . 0.0 108.767 178.308 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -86.58 177.57 4.22 Favored 'Trans proline' 0 CA--C 1.543 0.948 0 C-N-CA 124.967 3.778 . . . . 0.0 110.99 172.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -152.17 158.42 33.69 Favored Pre-proline 0 CA--C 1.544 0.724 0 C-N-CA 124.12 0.968 . . . . 0.0 111.752 176.243 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -68.97 129.53 18.61 Favored 'Trans proline' 0 CA--C 1.546 1.11 0 C-N-CA 122.666 2.244 . . . . 0.0 111.457 169.239 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -84.65 -172.19 1.18 Allowed 'Trans proline' 0 CA--C 1.544 0.997 0 C-N-CA 124.085 3.19 . . . . 0.0 112.387 169.694 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 82.83 157.6 0.12 Allowed 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 127.56 2.344 . . . . 0.0 114.185 167.301 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 80.4 p -167.84 158.43 10.79 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 120.619 -1.301 . . . . 0.0 113.15 167.203 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -114.05 -63.29 1.47 Allowed 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 125.568 1.547 . . . . 0.0 109.506 178.176 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.01 -178.38 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 123.809 0.843 . . . . 0.0 111.515 147.009 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -135.15 161.75 34.46 Favored 'General case' 0 N--CA 1.455 -0.216 0 O-C-N 119.026 -2.297 . . . . 0.0 112.426 179.842 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.5 mmpt? -128.81 158.37 72.57 Favored Pre-proline 0 N--CA 1.474 0.739 0 C-N-CA 126.25 1.82 . . . . 0.0 109.831 -167.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_endo -71.45 169.2 21.46 Favored 'Trans proline' 0 N--CA 1.461 -0.413 0 C-N-CA 121.756 1.637 . . . . 0.0 110.638 155.353 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -75.87 158.6 31.9 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 122.295 1.045 . . . . 0.0 113.059 175.118 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.403 ' HD3' ' HB2' ' A' ' 28' ' ' CYS . 1.5 ptpt -132.12 137.6 30.45 Favored Pre-proline 0 CA--C 1.538 0.514 0 C-N-CA 126.836 2.055 . . . . 0.0 108.872 -174.44 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.452 ' HB3' ' CE1' ' A' ' 65' ' ' PHE . 24.6 Cg_endo -75.83 -18.88 16.67 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 124.617 3.545 . . . . 0.0 114.073 -161.114 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 30.3 p -77.01 -19.01 57.79 Favored 'General case' 0 CA--C 1.558 1.266 0 C-N-CA 125.731 1.612 . . . . 0.0 112.835 176.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.403 ' HB2' ' HD3' ' A' ' 25' ' ' LYS . 38.7 m -119.98 -20.38 7.51 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.945 1.698 . . . . 0.0 114.502 -172.773 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.97 147.52 19.5 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.724 0.81 . . . . 0.0 111.015 178.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 54.6 m 48.99 54.28 15.93 Favored Pre-proline 0 CA--C 1.553 1.087 0 N-CA-C 113.704 1.001 . . . . 0.0 113.704 -171.04 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -66.2 -31.9 43.7 Favored 'Trans proline' 0 CA--C 1.537 0.634 0 C-N-CA 123.696 2.931 . . . . 0.0 112.649 -168.549 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -39.98 -69.59 0.13 Allowed 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.598 1.959 . . . . 0.0 114.633 158.094 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.1 p -66.86 -28.55 68.43 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-O 117.636 -1.173 . . . . 0.0 111.935 176.184 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 12.1 tmtt? -57.25 -47.82 80.4 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 120.738 1.608 . . . . 0.0 112.163 176.001 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.5 mttp -83.86 -26.26 29.61 Favored 'General case' 0 CA--C 1.516 -0.34 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 -179.327 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.29 -41.46 97.0 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 123.343 0.402 . . . . 0.0 111.923 163.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 7.5 ttp85 -57.93 -53.53 57.18 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 125.505 1.522 . . . . 0.0 109.981 173.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 82.7 m-20 -69.32 -30.18 68.18 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 115.042 -0.981 . . . . 0.0 113.496 -175.093 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.53 -45.63 92.08 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 120.351 1.432 . . . . 0.0 111.96 168.495 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.3 t -55.75 -34.11 64.9 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.058 0.943 . . . . 0.0 111.296 171.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 69.2 mt -77.3 -35.89 23.15 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 O-C-N 120.404 -1.435 . . . . 0.0 112.068 178.743 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 87.5 mt -59.92 -36.5 67.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 124.315 1.046 . . . . 0.0 111.385 167.793 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -70.35 -45.74 65.52 Favored 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 124.352 1.061 . . . . 0.0 113.718 178.473 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.58 -13.81 0.67 Allowed 'General case' 0 N--CA 1.483 1.224 0 N-CA-C 116.936 2.198 . . . . 0.0 116.936 -169.689 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 89.39 165.95 41.48 Favored Glycine 0 CA--C 1.536 1.395 0 C-N-CA 124.893 1.235 . . . . 0.0 112.476 -163.064 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.4 -34.66 63.34 Favored 'General case' 0 N--CA 1.466 0.326 0 O-C-N 120.553 -1.557 . . . . 0.0 113.259 -168.727 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -55.94 -35.21 66.39 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 123.118 0.567 . . . . 0.0 112.414 -179.629 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 84.5 m-70 -86.3 9.47 17.72 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.732 1.613 . . . . 0.0 112.961 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 1.3 m -143.0 9.19 1.7 Allowed 'General case' 0 N--CA 1.443 -0.825 0 C-N-CA 124.95 1.3 . . . . 0.0 113.895 -166.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -55.26 -22.21 28.95 Favored Glycine 0 C--O 1.215 -1.054 0 CA-C-O 117.041 -1.977 . . . . 0.0 117.656 -169.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 33.4 p-80 -54.46 -36.71 64.38 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 121.952 2.876 . . . . 0.0 113.145 167.207 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -70.73 -37.33 73.49 Favored 'General case' 0 N--CA 1.462 0.127 0 C-N-CA 125.332 1.453 . . . . 0.0 111.627 172.319 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.718 HG22 ' HD3' ' A' ' 57' ' ' LYS . 2.6 mp -71.12 -38.23 70.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 CA-C-N 118.912 0.778 . . . . 0.0 110.427 177.121 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.65 -53.66 21.12 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 125.393 1.477 . . . . 0.0 111.787 -173.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -57.88 -36.24 72.1 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-O 121.799 0.809 . . . . 0.0 112.755 175.7 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 15.4 t60 -68.48 -47.44 67.07 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.865 0.866 . . . . 0.0 112.775 175.028 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.718 ' HD3' HG22 ' A' ' 53' ' ' ILE . 31.1 mtpt -51.46 -49.14 62.34 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.53 1.132 . . . . 0.0 111.58 172.067 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -61.57 -46.5 89.62 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 124.215 1.006 . . . . 0.0 112.491 175.361 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 42.4 t -51.58 -52.65 45.61 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.073 0.949 . . . . 0.0 112.08 175.347 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 76.2 mtm -57.89 -48.93 78.41 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.913 0.885 . . . . 0.0 111.457 170.5 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.2 mtt-85 -58.47 -29.17 65.99 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 120.518 1.508 . . . . 0.0 114.205 -171.419 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -45.94 -35.22 4.47 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.22 1.008 . . . . 0.0 113.61 167.685 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.6 mp -81.95 6.65 15.31 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.221 1.008 . . . . 0.0 112.945 -170.552 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.07 27.07 42.01 Favored Glycine 0 CA--C 1.533 1.207 0 C-N-CA 124.722 1.153 . . . . 0.0 112.29 -169.084 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.452 ' CE1' ' HB3' ' A' ' 26' ' ' PRO . 0.2 OUTLIER -89.35 167.59 12.91 Favored 'General case' 0 N--CA 1.461 0.109 0 CA-C-O 123.694 1.711 . . . . 0.0 113.426 -171.623 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 16.0 ptpt -128.96 44.35 2.99 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 113.468 -1.696 . . . . 0.0 112.725 -136.04 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.917 0 C-N-CA 130.413 3.485 . . . . 0.0 109.593 -163.216 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.493 0 N-CA-C 109.337 -1.505 . . . . 0.0 109.337 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.2 t -153.79 175.7 13.0 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.005 1.322 . . . . 0.0 109.463 171.577 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -152.18 157.12 41.06 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.13 1.372 . . . . 0.0 110.771 -179.439 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -147.14 148.28 31.41 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.086 0.955 . . . . 0.0 110.109 -176.414 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 35.9 tpp -138.26 73.3 44.13 Favored Pre-proline 0 CA--C 1.541 0.624 0 C-N-CA 123.952 0.901 . . . . 0.0 110.332 174.041 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 79.1 Cg_endo -71.99 0.11 7.68 Favored 'Trans proline' 0 CA--C 1.542 0.9 0 C-N-CA 123.477 2.785 . . . . 0.0 115.352 -171.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -161.49 136.33 4.36 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.468 -1.053 . . . . 0.0 110.468 172.165 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -164.68 163.87 21.5 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.828 1.651 . . . . 0.0 110.412 -173.391 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 14.7 p -157.38 161.7 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 124.963 1.305 . . . . 0.0 110.382 -175.59 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -61.76 160.45 11.78 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 123.685 0.794 . . . . 0.0 111.896 166.231 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.8 t -128.62 105.95 8.62 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 124.35 1.06 . . . . 0.0 109.749 179.068 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -142.52 61.84 12.07 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 124.211 1.005 . . . . 0.0 111.501 -170.159 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -72.52 179.12 5.42 Favored 'Trans proline' 0 CA--C 1.542 0.88 0 C-N-CA 124.959 3.773 . . . . 0.0 112.707 179.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -95.89 160.43 30.15 Favored Pre-proline 0 CA--C 1.547 0.834 0 C-N-CA 125.989 1.716 . . . . 0.0 111.588 173.252 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -70.71 156.06 61.58 Favored 'Trans proline' 0 CA--C 1.546 1.085 0 C-N-CA 123.199 2.599 . . . . 0.0 112.444 170.543 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -78.87 -178.95 5.03 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 123.73 2.953 . . . . 0.0 112.819 170.775 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -53.25 -22.92 7.65 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 126.196 1.798 . . . . 0.0 114.706 174.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.7 m -61.12 11.49 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 127.954 2.502 . . . . 0.0 116.297 -179.757 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 57.6 tp60 -49.14 107.58 0.15 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.15 1.78 . . . . 0.0 112.142 178.068 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.71 175.12 3.73 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 124.068 1.889 . . . . 0.0 113.29 175.235 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 8.5 mptt -124.68 62.59 1.13 Allowed 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 129.499 3.12 . . . . 0.0 108.275 -167.384 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.48 158.29 76.06 Favored Pre-proline 0 N--CA 1.476 0.861 0 C-N-CA 127.761 2.425 . . . . 0.0 110.277 -176.116 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -73.55 159.81 45.42 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 122.24 1.96 . . . . 0.0 111.856 173.828 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.562 HD22 ' CB ' ' A' ' 29' ' ' ALA . 1.0 OUTLIER -80.17 162.86 24.48 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.478 1.111 . . . . 0.0 113.995 -176.899 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.7 ptmt -131.57 132.06 23.22 Favored Pre-proline 0 N--CA 1.468 0.43 0 C-N-CA 126.13 1.772 . . . . 0.0 106.771 171.734 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -70.51 -39.05 5.43 Favored 'Trans proline' 0 CA--C 1.533 0.473 0 C-N-CA 122.883 2.389 . . . . 0.0 114.762 -150.258 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 20.3 p -63.08 -24.97 68.15 Favored 'General case' 0 CA--C 1.554 1.098 0 C-N-CA 123.521 0.728 . . . . 0.0 112.715 178.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 64.7 m -98.63 -5.73 31.21 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 126.265 1.826 . . . . 0.0 113.101 175.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.562 ' CB ' HD22 ' A' ' 24' ' ' LEU . . . -92.07 -36.71 13.2 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-O 122.301 1.048 . . . . 0.0 113.542 -176.066 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 43.5 m -113.36 61.86 0.84 Allowed Pre-proline 0 CA--C 1.549 0.927 0 C-N-CA 127.381 2.272 . . . . 0.0 112.075 162.67 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -74.83 -22.41 15.25 Favored 'Trans proline' 0 CA--C 1.54 0.785 0 C-N-CA 122.778 2.318 . . . . 0.0 112.446 -171.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -66.41 -52.86 42.18 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.209 1.404 . . . . 0.0 112.767 174.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.1 p -65.4 -30.33 71.13 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 120.967 -1.083 . . . . 0.0 111.375 170.025 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 8.2 tmtt? -57.66 -49.02 77.87 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 120.378 1.445 . . . . 0.0 112.426 169.716 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 48.1 tttt -54.5 -50.58 67.48 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 125.922 1.689 . . . . 0.0 111.159 174.374 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.97 -42.05 97.37 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 114.853 -1.067 . . . . 0.0 112.962 179.727 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 9.1 ttp85 -60.12 -51.97 67.33 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 125.102 1.361 . . . . 0.0 110.371 177.269 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 25.0 m-20 -72.31 -29.99 64.36 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 115.771 -0.65 . . . . 0.0 112.553 -175.514 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.91 -37.0 85.77 Favored 'General case' 0 CA--C 1.546 0.792 0 O-C-N 120.821 -1.175 . . . . 0.0 113.131 167.124 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.8 t -60.39 -39.76 88.49 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 121.053 -1.029 . . . . 0.0 111.651 168.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 73.7 mt -72.02 -29.95 34.82 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 O-C-N 121.001 -1.062 . . . . 0.0 111.468 -177.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 60.1 mt -58.01 -43.05 84.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 123.38 0.672 . . . . 0.0 111.489 163.591 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.9 -41.97 97.57 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 114.069 1.137 . . . . 0.0 114.069 -178.207 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -153.48 -9.34 0.16 Allowed 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 116.992 2.219 . . . . 0.0 116.992 -166.487 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 83.58 159.57 28.55 Favored Glycine 0 CA--C 1.53 1.017 0 CA-C-N 119.179 0.9 . . . . 0.0 112.895 -164.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.521 ' HB3' HD11 ' A' ' 53' ' ' ILE . 0.5 OUTLIER -67.53 -28.72 68.05 Favored 'General case' 0 N--CA 1.463 0.181 0 O-C-N 121.147 -1.207 . . . . 0.0 112.728 -169.564 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.438 ' HG3' ' CD2' ' A' ' 48' ' ' HIS . 10.4 pt-20 -58.41 -24.42 59.99 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.911 0.885 . . . . 0.0 113.258 177.018 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.438 ' CD2' ' HG3' ' A' ' 47' ' ' GLU . 96.8 m-70 -104.21 11.97 34.33 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 120.345 1.429 . . . . 0.0 111.117 178.137 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 1.7 m -139.67 18.09 2.52 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 126.768 2.027 . . . . 0.0 113.051 -162.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . 0.47 ' HA2' HD12 ' A' ' 53' ' ' ILE . . . -63.81 -29.69 75.52 Favored Glycine 0 C--O 1.216 -1.001 0 CA-C-O 116.622 -2.21 . . . . 0.0 114.883 -175.728 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 41.0 p-80 -56.42 -24.75 47.26 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 120.358 2.079 . . . . 0.0 113.632 168.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -82.72 -33.63 27.47 Favored 'General case' 0 C--N 1.341 0.203 0 O-C-N 121.515 -0.74 . . . . 0.0 110.78 171.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.53 HG22 ' HD3' ' A' ' 57' ' ' LYS . 51.5 mt -75.11 -35.22 33.94 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-O 119.196 -0.43 . . . . 0.0 110.628 -179.18 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -67.84 -55.49 12.76 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 127.119 2.168 . . . . 0.0 110.94 -177.301 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.74 -40.76 72.96 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 173.138 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 13.6 t60 -66.3 -46.48 76.8 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 120.992 -1.067 . . . . 0.0 113.089 175.38 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.53 ' HD3' HG22 ' A' ' 53' ' ' ILE . 21.4 mtpp -54.06 -49.0 69.99 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.146 0.978 . . . . 0.0 111.269 172.658 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -61.74 -43.39 98.95 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 118.155 -0.926 . . . . 0.0 112.435 175.322 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 42.8 t -50.74 -58.2 6.47 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 119.016 0.825 . . . . 0.0 111.11 173.002 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 75.6 mtm -55.93 -45.89 78.62 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.203 0.601 . . . . 0.0 110.486 174.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 8.8 mtt-85 -58.91 -29.25 66.92 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 120.77 1.623 . . . . 0.0 115.232 -177.035 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -50.25 -31.32 13.79 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 118.9 0.773 . . . . 0.0 112.668 169.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.413 ' CD2' ' HB1' ' A' ' 29' ' ' ALA . 5.9 mp -85.21 26.74 0.85 Allowed 'General case' 0 CA--C 1.546 0.81 0 CA-C-O 122.732 1.253 . . . . 0.0 112.327 -172.195 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 68.09 30.1 73.75 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 127.156 2.312 . . . . 0.0 113.034 -174.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -102.35 170.35 8.12 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-O 124.03 1.871 . . . . 0.0 115.959 -148.578 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 13.0 ptpt -119.81 69.53 0.84 Allowed 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 124.1 1.905 . . . . 0.0 111.625 -152.273 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 17.8 mm . . . . . 0 C--O 1.254 1.313 0 CA-C-N 108.472 -3.967 . . . . 0.0 112.16 -147.72 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.402 0 N-CA-C 109.115 -1.594 . . . . 0.0 109.115 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.3 t -154.95 168.55 26.58 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.085 1.354 . . . . 0.0 108.972 169.244 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -142.78 152.53 42.35 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.355 1.462 . . . . 0.0 110.206 -179.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 3.2 m -160.58 145.17 14.21 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.405 1.082 . . . . 0.0 108.603 172.605 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 4.7 mpp? -129.46 66.44 76.92 Favored Pre-proline 0 CA--C 1.542 0.663 0 C-N-CA 123.734 0.813 . . . . 0.0 110.941 -177.555 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_endo -70.8 4.43 2.65 Favored 'Trans proline' 0 CA--C 1.544 1.019 0 C-N-CA 123.833 3.022 . . . . 0.0 116.477 -171.028 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -170.85 27.1 0.11 Allowed Glycine 0 CA--C 1.531 1.058 0 C-N-CA 124.213 0.911 . . . . 0.0 113.726 -179.589 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -163.16 -170.91 2.44 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.375 1.87 . . . . 0.0 109.657 -172.704 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 9.7 p -137.51 153.64 28.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 C-N-CA 124.24 1.016 . . . . 0.0 108.924 169.002 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -83.14 158.75 22.26 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 121.876 0.846 . . . . 0.0 111.194 172.756 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 75.1 m -157.12 0.79 0.12 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 126.429 1.892 . . . . 0.0 112.802 168.386 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -160.25 69.22 2.9 Favored Pre-proline 0 CA--C 1.551 1.002 0 C-N-CA 125.351 1.46 . . . . 0.0 109.93 -178.436 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -70.83 169.56 19.96 Favored 'Trans proline' 0 N--CA 1.45 -1.074 0 C-N-CA 123.527 2.818 . . . . 0.0 111.221 177.728 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -152.16 159.17 33.25 Favored Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 125.499 1.52 . . . . 0.0 110.417 175.246 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -68.38 158.76 56.22 Favored 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 121.471 1.447 . . . . 0.0 110.644 162.66 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -68.74 179.05 3.4 Favored 'Trans proline' 0 N--CA 1.459 -0.55 0 C-N-CA 121.569 1.513 . . . . 0.0 110.599 160.296 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -66.26 144.54 56.54 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-O 121.96 0.886 . . . . 0.0 111.673 162.541 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 77.8 p -161.44 43.5 0.16 Allowed 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 126.634 1.973 . . . . 0.0 111.533 174.365 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -152.4 -177.47 6.23 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 177.585 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -50.1 154.89 1.05 Allowed 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 124.343 2.021 . . . . 0.0 113.026 160.621 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 25.8 tttp 178.21 106.85 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 111.544 -2.571 . . . . 0.0 108.652 -161.237 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.1 mmpt? -61.87 145.47 92.45 Favored Pre-proline 0 N--CA 1.476 0.845 0 O-C-N 121.118 -0.989 . . . . 0.0 110.61 174.079 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.5 171.0 14.96 Favored 'Trans proline' 0 CA--C 1.534 0.517 0 C-N-CA 122.763 2.309 . . . . 0.0 112.427 -175.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.561 ' CD1' ' H ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -128.72 163.33 25.37 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.879 1.272 . . . . 0.0 109.182 177.014 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.561 ' H ' ' CD1' ' A' ' 24' ' ' LEU . 19.4 pttp -132.5 131.06 22.03 Favored Pre-proline 0 N--CA 1.465 0.299 0 C-N-CA 128.258 2.623 . . . . 0.0 107.373 179.18 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -64.14 -24.38 66.13 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 123.893 3.062 . . . . 0.0 114.226 -154.115 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 28.6 p -66.63 -21.26 66.12 Favored 'General case' 0 CA--C 1.558 1.269 0 C-N-CA 124.956 1.302 . . . . 0.0 113.418 175.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 40.4 m -111.13 -8.5 14.41 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.714 1.606 . . . . 0.0 114.973 -173.589 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.24 152.23 45.32 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 121.015 -1.053 . . . . 0.0 111.64 -170.113 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 64.9 m 42.77 57.18 11.4 Favored Pre-proline 0 CA--C 1.55 0.962 0 C-N-CA 124.7 1.2 . . . . 0.0 113.928 -173.014 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -63.68 -29.08 69.16 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 123.873 3.049 . . . . 0.0 112.63 -168.036 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -39.37 -72.19 0.07 Allowed 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.688 2.395 . . . . 0.0 115.753 156.299 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -68.72 -24.77 64.51 Favored 'General case' 0 N--CA 1.475 0.815 0 O-C-N 121.029 -1.044 . . . . 0.0 112.169 176.222 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 8.8 tmtt? -60.37 -43.74 96.28 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 120.419 1.463 . . . . 0.0 111.124 172.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 62.5 tttt -58.84 -49.74 76.58 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.858 1.263 . . . . 0.0 111.677 173.169 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.56 -37.17 86.29 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.332 -0.849 . . . . 0.0 112.739 178.131 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 6.6 ttp85 -59.35 -56.48 21.56 Favored 'General case' 0 C--O 1.223 -0.299 0 C-N-CA 125.619 1.568 . . . . 0.0 109.842 175.15 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -69.61 -27.4 65.05 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 115.315 -0.857 . . . . 0.0 112.572 -176.4 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.35 -44.31 91.85 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 120.768 -1.207 . . . . 0.0 112.971 166.356 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -57.76 -31.7 66.75 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 122.454 1.121 . . . . 0.0 111.57 171.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 72.3 mt -77.27 -34.33 21.07 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 O-C-N 120.524 -1.36 . . . . 0.0 111.726 177.259 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 70.2 mt -61.92 -34.72 64.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.2 1.0 . . . . 0.0 111.659 167.193 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -70.13 -43.03 71.79 Favored 'General case' 0 CA--C 1.556 1.181 0 N-CA-C 114.12 1.155 . . . . 0.0 114.12 177.104 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.87 -11.71 0.28 Allowed 'General case' 0 N--CA 1.485 1.297 0 N-CA-C 117.828 2.529 . . . . 0.0 117.828 -171.049 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 90.03 162.34 38.25 Favored Glycine 0 CA--C 1.536 1.36 0 CA-C-N 119.612 1.096 . . . . 0.0 112.663 -163.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.43 -34.99 68.22 Favored 'General case' 0 N--CA 1.465 0.3 0 O-C-N 120.707 -1.467 . . . . 0.0 113.422 -168.687 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -56.15 -34.9 66.56 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.765 0.826 . . . . 0.0 112.612 178.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 79.5 m-70 -90.21 12.15 18.93 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.698 1.599 . . . . 0.0 112.686 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -145.72 11.67 1.27 Allowed 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 124.954 1.302 . . . . 0.0 114.11 -169.286 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -53.73 -26.18 31.64 Favored Glycine 0 N--CA 1.472 1.038 0 CA-C-O 116.354 -2.359 . . . . 0.0 116.879 -169.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 37.1 p-80 -52.56 -33.67 46.79 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 120.997 2.399 . . . . 0.0 113.143 170.147 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -74.16 -38.5 63.69 Favored 'General case' 0 CA--C 1.522 -0.114 0 C-N-CA 125.117 1.367 . . . . 0.0 112.364 171.521 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 2.8 mp -67.91 -34.53 67.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 119.964 -0.695 . . . . 0.0 110.906 175.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -74.38 -53.63 9.23 Favored 'General case' 0 N--CA 1.44 -0.957 0 C-N-CA 125.28 1.432 . . . . 0.0 111.557 -176.211 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.23 -38.39 65.68 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.541 -0.724 . . . . 0.0 112.383 175.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 17.1 t60 -67.25 -49.81 62.97 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.593 1.157 . . . . 0.0 113.504 173.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -48.19 -49.78 31.51 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.632 1.573 . . . . 0.0 112.405 177.326 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -69.36 -39.81 77.86 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.366 0.666 . . . . 0.0 112.053 -176.214 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 48.8 t -50.13 -51.58 42.15 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 123.528 0.731 . . . . 0.0 112.493 167.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 36.0 mtp -57.95 -51.79 68.2 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.118 1.367 . . . . 0.0 110.787 172.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 45.9 mtt180 -54.9 -29.84 56.92 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 126.097 1.759 . . . . 0.0 114.392 -177.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -48.06 -22.06 0.56 Allowed 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 114.793 1.405 . . . . 0.0 114.793 168.071 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.8 mp -95.85 1.89 53.37 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.662 1.585 . . . . 0.0 112.186 -173.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 86.76 15.04 64.08 Favored Glycine 0 CA--C 1.535 1.33 0 C-N-CA 124.744 1.164 . . . . 0.0 113.07 -169.746 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -71.73 141.06 49.79 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 126.576 1.95 . . . . 0.0 111.524 -179.167 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -101.2 93.71 5.59 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.332 1.453 . . . . 0.0 108.344 -178.31 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.126 0 C-N-CA 127.544 2.338 . . . . 0.0 109.313 -177.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.319 0 N-CA-C 108.325 -1.91 . . . . 0.0 108.325 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 12.2 m -145.88 155.25 42.76 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.156 0.982 . . . . 0.0 109.792 -170.333 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 -143.27 154.5 43.87 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 123.881 0.872 . . . . 0.0 111.045 -172.414 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 4.0 m -148.88 157.94 43.8 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 125.41 1.484 . . . . 0.0 109.12 -174.278 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 35.8 tpp -127.59 72.52 78.0 Favored Pre-proline 0 N--CA 1.472 0.665 0 C-N-CA 123.671 0.789 . . . . 0.0 112.099 176.39 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -76.87 37.38 0.57 Allowed 'Trans proline' 0 CA--C 1.549 1.236 0 C-N-CA 124.0 3.134 . . . . 0.0 112.072 173.623 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -156.35 41.79 0.56 Allowed Glycine 0 CA--C 1.529 0.911 0 O-C-N 121.293 -0.879 . . . . 0.0 114.601 -163.725 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -138.23 170.23 16.39 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.384 1.074 . . . . 0.0 111.554 174.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 14.7 p -152.28 150.75 12.69 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 125.24 1.416 . . . . 0.0 109.407 173.219 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.4 p-10 -132.96 -9.08 3.06 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 126.177 1.791 . . . . 0.0 113.58 -172.092 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.3 m -86.66 29.44 0.79 Allowed 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 114.781 1.4 . . . . 0.0 114.781 -140.628 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -132.81 73.98 75.09 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 125.811 1.644 . . . . 0.0 110.022 -177.062 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -73.89 178.42 6.86 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 124.119 3.212 . . . . 0.0 112.367 -179.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -72.08 156.24 90.96 Favored Pre-proline 0 CA--C 1.547 0.837 0 C-N-CA 124.62 1.168 . . . . 0.0 112.236 172.509 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -70.24 162.06 43.71 Favored 'Trans proline' 0 CA--C 1.545 1.069 0 C-N-CA 122.884 2.39 . . . . 0.0 111.492 164.62 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -73.09 178.99 5.83 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 123.248 2.632 . . . . 0.0 112.534 171.23 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -66.34 149.26 50.64 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.869 1.268 . . . . 0.0 113.96 -178.742 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.3 m -65.48 27.38 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 127.512 2.325 . . . . 0.0 114.8 168.176 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 10.3 tm0? -65.1 128.45 35.84 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.157 1.383 . . . . 0.0 110.938 -174.091 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 62.93 171.83 0.15 Allowed 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 127.767 2.427 . . . . 0.0 116.694 176.322 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.544 ' HD3' ' H ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -70.68 137.48 49.84 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 113.897 -1.502 . . . . 0.0 109.404 156.419 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.8 mptt -133.03 161.11 65.78 Favored Pre-proline 0 N--CA 1.475 0.777 0 C-N-CA 125.003 1.321 . . . . 0.0 111.266 179.071 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -80.6 168.41 17.96 Favored 'Trans proline' 0 CA--C 1.535 0.546 0 C-N-CA 122.986 2.457 . . . . 0.0 112.131 175.196 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.601 ' CD1' ' H ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -100.48 163.62 12.28 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.193 0.997 . . . . 0.0 109.939 169.03 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.601 ' H ' ' CD1' ' A' ' 24' ' ' LEU . 19.1 pttp -139.39 129.93 14.53 Favored Pre-proline 0 CA--C 1.534 0.361 0 C-N-CA 129.668 3.187 . . . . 0.0 107.101 178.569 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -63.87 -24.49 67.92 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 124.121 3.214 . . . . 0.0 113.919 -155.43 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 19.1 p -65.96 -16.36 63.81 Favored 'General case' 0 CA--C 1.558 1.267 0 C-N-CA 125.488 1.515 . . . . 0.0 113.352 175.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 52.4 m -118.68 -6.31 10.64 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.358 1.863 . . . . 0.0 114.804 -176.549 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.421 ' HB2' ' CE2' ' A' ' 65' ' ' PHE . . . -65.47 151.67 45.8 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.183 -0.948 . . . . 0.0 110.968 -175.143 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 21.3 m 37.69 56.06 4.17 Favored Pre-proline 0 CA--C 1.549 0.92 0 N-CA-C 114.227 1.195 . . . . 0.0 114.227 -174.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -66.9 -11.47 32.27 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 123.149 2.566 . . . . 0.0 112.695 -166.24 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 38.0 mm-40 -88.02 -41.56 13.02 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.468 1.507 . . . . 0.0 112.44 -177.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -64.0 -35.31 80.28 Favored 'General case' 0 N--CA 1.48 1.049 0 O-C-N 120.635 -1.291 . . . . 0.0 110.674 158.297 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.432 ' HE2' ' OD2' ' A' ' 38' ' ' ASP . 17.3 tttt -59.82 -42.6 93.88 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 119.484 1.038 . . . . 0.0 112.656 175.475 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.4 mttt -55.43 -50.01 70.93 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 125.513 1.525 . . . . 0.0 110.552 176.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.46 -34.34 76.97 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.83 0.852 . . . . 0.0 113.018 174.645 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.408 ' CG ' HG13 ' A' ' 53' ' ' ILE . 4.3 ttp180 -59.48 -54.89 41.42 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.892 1.277 . . . . 0.0 109.943 176.568 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.432 ' OD2' ' HE2' ' A' ' 34' ' ' LYS . 84.2 m-20 -74.46 -28.69 61.14 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.526 1.13 . . . . 0.0 111.596 -175.4 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.01 -39.95 94.01 Favored 'General case' 0 CA--C 1.547 0.834 0 O-C-N 120.637 -1.289 . . . . 0.0 113.356 163.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.6 t -59.64 -34.07 72.33 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.007 -1.058 . . . . 0.0 111.435 173.467 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 91.4 mt -71.85 -35.14 53.71 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 O-C-N 120.62 -1.3 . . . . 0.0 111.183 176.172 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 87.6 mt -63.79 -35.45 73.14 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 124.05 0.94 . . . . 0.0 111.985 169.503 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -69.95 -43.62 71.2 Favored 'General case' 0 CA--C 1.556 1.21 0 N-CA-C 114.053 1.131 . . . . 0.0 114.053 177.611 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.51 -15.26 0.38 Allowed 'General case' 0 N--CA 1.485 1.31 0 N-CA-C 116.874 2.176 . . . . 0.0 116.874 -170.147 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 92.55 164.31 38.05 Favored Glycine 0 CA--C 1.536 1.36 0 CA-C-O 122.153 0.863 . . . . 0.0 113.148 -165.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -68.89 -41.99 77.56 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 -164.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -55.7 -34.83 65.44 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.771 1.228 . . . . 0.0 113.804 175.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 68.8 m-70 -87.64 12.23 13.13 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.561 1.145 . . . . 0.0 112.342 -176.592 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 1.2 m -141.41 2.59 1.66 Allowed 'General case' 0 N--CA 1.438 -1.064 0 C-N-CA 124.739 1.216 . . . . 0.0 114.163 -167.315 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -54.23 -21.16 17.94 Favored Glycine 0 N--CA 1.474 1.181 0 N-CA-C 118.136 2.014 . . . . 0.0 118.136 -167.427 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 30.1 p-80 -55.32 -36.79 66.6 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 121.72 2.76 . . . . 0.0 113.41 166.5 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.2 -41.6 85.54 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 125.377 1.471 . . . . 0.0 111.072 170.699 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.697 HG22 ' HD3' ' A' ' 57' ' ' LYS . 2.8 mp -70.04 -39.44 77.29 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 CA-C-N 118.73 0.695 . . . . 0.0 109.708 -178.683 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.08 -51.73 50.75 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 125.461 1.504 . . . . 0.0 112.62 -177.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.55 -38.58 84.95 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.479 0.657 . . . . 0.0 112.413 176.588 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 21.0 t60 -65.31 -48.29 73.59 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.648 0.779 . . . . 0.0 112.759 173.638 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.697 ' HD3' HG22 ' A' ' 53' ' ' ILE . 35.2 mtpt -52.11 -47.69 65.17 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.607 1.163 . . . . 0.0 112.617 171.833 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -57.74 -44.77 86.26 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 119.461 1.028 . . . . 0.0 112.375 172.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 38.1 t -56.09 -50.07 72.06 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 118.681 0.673 . . . . 0.0 112.299 175.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 71.8 mtm -59.06 -50.92 72.24 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 121.291 -0.88 . . . . 0.0 111.013 171.358 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 15.9 mtt180 -55.82 -30.89 62.12 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 126.068 1.747 . . . . 0.0 113.743 -174.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -44.66 -34.84 2.35 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.702 1.201 . . . . 0.0 113.749 168.304 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.1 mp -81.26 8.86 7.99 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 123.992 0.917 . . . . 0.0 112.744 -173.177 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 75.87 22.06 75.22 Favored Glycine 0 CA--C 1.533 1.194 0 C-N-CA 125.54 1.543 . . . . 0.0 112.408 -167.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.47 ' HB3' HG13 ' A' ' 67' ' ' ILE . 0.1 OUTLIER -78.06 129.25 35.0 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 126.354 1.862 . . . . 0.0 110.974 -172.427 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.4 mppt? -82.6 78.92 9.16 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.476 1.51 . . . . 0.0 109.391 -178.089 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.47 HG13 ' HB3' ' A' ' 65' ' ' PHE . 0.4 OUTLIER . . . . . 0 C--O 1.247 0.934 0 C-N-CA 125.898 1.679 . . . . 0.0 109.731 -176.041 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' CU1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_